*HEADER    DNA BINDING PROTEIN                     19-SEP-05   2D2W              
*TITLE     SOLUTION STRUCTURE AND DYNAMICS OF THE DNA-BINDING DOMAIN             
*TITLE    2 OF MYOCYTE NUCLEAR FACTOR                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FORKHEAD BOX PROTEIN K1;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: DNA-BINDING DOMAIN;                                        
*COMPND   5 SYNONYM: MYOCYTE NUCLEAR FACTOR, MNF;                                
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 GENE: FOXK1;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21A                                    
*KEYWDS    DNA-BINDING DOMAIN, WINGED-HELIX, FORKHEAD, NMR                       
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    W.-J.CHUANG, C.-H.CHANG, W.-Y.JENG, Y.-P.CHU                          
*REVDAT   1   05-SEP-06 2D2W    0                                                


!sequencial NOE (NHi-NHi+1,CAi-HN+1)

assign ( resid 6 and name hn ) ( resid 7 and name hn ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 8 and name hn ) 2.30 0.00 3.70
assign ( resid 8 and name hn ) ( resid 9 and name hn ) 1.80 0.00 3.20 
assign ( resid 9 and name hn ) ( resid 10 and name hn ) 1.80 0.00 3.20 
assign ( resid 10 and name hn ) ( resid 11 and name hn ) 1.80 0.00 3.20 
assign ( resid 11 and name hn ) ( resid 12 and name hn ) 1.80 0.00 1.80 
assign ( resid 12 and name hn ) ( resid 13 and name hn ) 1.80 0.00 3.20
assign ( resid 13 and name hn ) ( resid 14 and name hn ) 1.80 0.00 1.80
assign ( resid 14 and name hn ) ( resid 15 and name hn ) 1.80 0.00 3.20
assign ( resid 15 and name hn ) ( resid 16 and name hn ) 1.80 0.00 1.80
assign ( resid 16 and name hn ) ( resid 17 and name hn ) 1.80 0.00 3.20
assign ( resid 17 and name hn ) ( resid 18 and name hn ) 1.80 0.00 1.80
assign ( resid 18 and name hn ) ( resid 19 and name hn ) 1.80 0.00 1.00
assign ( resid 19 and name hn ) ( resid 20 and name hn ) 2.30 0.00 3.70
assign ( resid 21 and name hn ) ( resid 22 and name hn ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 23 and name hn ) 1.80 0.00 3.20
assign ( resid 23 and name hn ) ( resid 24 and name hn ) 1.80 0.00 3.20
assign ( resid 26 and name hn ) ( resid 27 and name hn ) 1.80 0.00 3.20 
assign ( resid 27 and name hn ) ( resid 28 and name hn ) 1.80 0.00 3.20
assign ( resid 28 and name hn ) ( resid 29 and name hn ) 1.80 0.00 3.20
assign ( resid 29 and name hn ) ( resid 30 and name hn ) 1.80 0.00 1.00
assign ( resid 31 and name hn ) ( resid 32 and name hn ) 1.80 0.00 1.80
assign ( resid 32 and name hn ) ( resid 33 and name hn ) 1.80 0.00 1.80
assign ( resid 33 and name hn ) ( resid 34 and name hn ) 1.80 0.00 3.20
assign ( resid 34 and name hn ) ( resid 35 and name hn ) 1.80 0.00 3.20
assign ( resid 35 and name hn ) ( resid 36 and name hn ) 2.30 0.00 3.70
assign ( resid 36 and name hn ) ( resid 37 and name hn ) 1.80 0.00 3.20
assign ( resid 39 and name hn ) ( resid 40 and name hn ) 2.30 0.00 3.70
assign ( resid 45 and name hn ) ( resid 46 and name hn ) 2.30 0.00 3.70
assign ( resid 46 and name hn ) ( resid 47 and name hn ) 2.30 0.00 3.70
assign ( resid 49 and name hn ) ( resid 50 and name hn ) 2.30 0.00 3.70
assign ( resid 50 and name hn ) ( resid 51 and name hn ) 2.30 0.00 3.70
assign ( resid 51 and name hn ) ( resid 52 and name hn ) 1.80 0.00 3.20
assign ( resid 52 and name hn ) ( resid 53 and name hn ) 1.80 0.00 1.80
assign ( resid 53 and name hn ) ( resid 54 and name hn ) 1.80 0.00 1.80
assign ( resid 54 and name hn ) ( resid 55 and name hn ) 1.80 0.00 1.80
assign ( resid 55 and name hn ) ( resid 56 and name hn ) 1.80 0.00 3.20
assign ( resid 56 and name hn ) ( resid 57 and name hn ) 1.80 0.00 3.20
assign ( resid 57 and name hn ) ( resid 58 and name hn ) 1.80 0.00 3.20
assign ( resid 58 and name hn ) ( resid 59 and name hn ) 2.30 0.00 3.70
assign ( resid 59 and name hn ) ( resid 60 and name hn ) 2.30 0.00 3.70
assign ( resid 60 and name hn ) ( resid 61 and name hn ) 1.80 0.00 1.80
assign ( resid 61 and name hn ) ( resid 62 and name hn ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 63 and name hn ) 2.30 0.00 3.70
assign ( resid 66 and name hn ) ( resid 67 and name hn ) 2.30 0.00 3.70
assign ( resid 68 and name hn ) ( resid 69 and name hn ) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 70 and name hn ) 2.30 0.00 3.70
assign ( resid 72 and name hn ) ( resid 73 and name hn ) 2.30 0.00 3.70
assign ( resid 73 and name hn ) ( resid 74 and name hn ) 2.30 0.00 3.70
assign ( resid 74 and name hn ) ( resid 75 and name hn ) 1.80 0.00 3.20
assign ( resid 79 and name hn ) ( resid 80 and name hn ) 2.30 0.00 3.70
assign ( resid 82 and name hn ) ( resid 83 and name hn ) 1.80 0.00 1.60
assign ( resid 83 and name hn ) ( resid 84 and name hn ) 1.80 0.00 1.60
assign ( resid 84 and name hn ) ( resid 85 and name hn ) 1.80 0.00 1.60
assign ( resid 85 and name hn ) ( resid 86 and name hn ) 1.80 0.00 1.60
assign ( resid 86 and name hn ) ( resid 87 and name hn ) 1.80 0.00 1.60
assign ( resid 87 and name hn ) ( resid 88 and name hn ) 1.80 0.00 1.60
assign ( resid 88 and name hn ) ( resid 89 and name hn ) 1.80 0.00 1.60
assign ( resid 89 and name hn ) ( resid 90 and name hn ) 1.80 0.00 1.60
assign ( resid 90 and name hn ) ( resid 91 and name hn ) 1.80 0.00 1.60
assign ( resid 91 and name hn ) ( resid 92 and name hn ) 1.80 0.00 3.20
assign ( resid 92 and name hn ) ( resid 93 and name hn ) 1.80 0.00 2.20
assign ( resid 93 and name hn ) ( resid 94 and name hn ) 2.30 0.00 3.70
assign ( resid 94 and name hn ) ( resid 95 and name hn ) 2.30 0.00 3.70
assign ( resid 2 and name hn ) ( resid 1 and name ha ) 2.30 0.00 3.70
assign ( resid 3 and name hn ) ( resid 2 and name ha ) 2.30 0.00 3.70
assign ( resid 6 and name hn ) ( resid 5 and name ha ) 1.80 0.00 1.80
assign ( resid 7 and name hn ) ( resid 6 and name ha ) 1.80 0.00 1.00
assign ( resid 8 and name hn ) ( resid 7 and name ha ) 2.30 0.00 3.70
assign ( resid 9 and name hn ) ( resid 8 and name ha ) 2.30 0.00 3.70
assign ( resid 10 and name hn ) ( resid 9 and name ha ) 2.30 0.00 3.70
assign ( resid 11 and name hn ) ( resid 10 and name ha ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 11 and name ha ) 2.30 0.00 3.70
assign ( resid 13 and name hn ) ( resid 12 and name ha ) 2.30 0.00 3.70
assign ( resid 14 and name hn ) ( resid 13 and name ha ) 2.30 0.00 3.70
assign ( resid 15 and name hn ) ( resid 14 and name ha ) 2.30 0.00 3.70
assign ( resid 16 and name hn ) ( resid 15 and name ha ) 2.30 0.00 3.70
assign ( resid 17 and name hn ) ( resid 16 and name ha ) 2.30 0.00 3.70
assign ( resid 18 and name hn ) ( resid 17 and name ha ) 2.30 0.00 3.70
assign ( resid 19 and name hn ) ( resid 18 and name ha ) 1.80 0.00 3.20
assign ( resid 20 and name hn ) ( resid 19 and name ha ) 2.30 0.00 3.70
assign ( resid 21 and name hn ) ( resid 20 and name ha ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 21 and name ha ) 2.30 0.00 3.70
assign ( resid 23 and name hn ) ( resid 22 and name ha ) 1.80 0.00 1.80
assign ( resid 24 and name hn ) ( resid 23 and name ha ) 1.80 0.00 1.80
assign ( resid 25 and name hn ) ( resid 24 and name ha ) 1.80 0.00 3.20
assign ( resid 26 and name hn ) ( resid 25 and name ha ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 26 and name ha ) 2.30 0.00 3.70
assign ( resid 28 and name hn ) ( resid 27 and name ha ) 2.30 0.00 3.70
assign ( resid 29 and name hn ) ( resid 28 and name ha* ) 2.30 0.00 3.70
assign ( resid 30 and name hn ) ( resid 29 and name ha ) 2.30 0.00 3.70
assign ( resid 31 and name hn ) ( resid 30 and name ha ) 2.30 0.00 3.70
assign ( resid 32 and name hn ) ( resid 31 and name ha ) 2.30 0.00 3.70
assign ( resid 33 and name hn ) ( resid 32 and name ha ) 2.30 0.00 3.70
assign ( resid 34 and name hn ) ( resid 33 and name ha ) 2.30 0.00 3.70
assign ( resid 35 and name hn ) ( resid 34 and name ha ) 2.30 0.00 3.70
assign ( resid 36 and name hn ) ( resid 35 and name ha ) 2.30 0.00 3.70
assign ( resid 37 and name hn ) ( resid 36 and name ha ) 1.80 0.00 3.20
assign ( resid 40 and name hn ) ( resid 39 and name ha ) 2.30 0.00 3.70
assign ( resid 41 and name hn ) ( resid 40 and name ha ) 2.30 0.00 3.70
assign ( resid 42 and name hn ) ( resid 41 and name ha ) 2.30 0.00 3.70
assign ( resid 43 and name hn ) ( resid 42 and name ha ) 2.30 0.00 3.70
assign ( resid 44 and name hn ) ( resid 43 and name ha ) 2.30 0.00 3.70
assign ( resid 45 and name hn ) ( resid 44 and name ha ) 2.30 0.00 3.70
assign ( resid 46 and name hn ) ( resid 45 and name ha ) 2.30 0.00 3.70
assign ( resid 47 and name hn ) ( resid 46 and name ha1 ) 2.30 0.00 3.70
assign ( resid 47 and name hn ) ( resid 46 and name ha2 ) 2.30 0.00 3.70
assign ( resid 49 and name hn ) ( resid 48 and name ha ) 2.30 0.00 3.70
assign ( resid 50 and name hn ) ( resid 49 and name ha ) 2.30 0.00 3.70
assign ( resid 51 and name hn ) ( resid 50 and name ha ) 2.30 0.00 3.70
assign ( resid 52 and name hn ) ( resid 51 and name ha ) 2.30 0.00 3.70
assign ( resid 53 and name hn ) ( resid 52 and name ha ) 2.30 0.00 3.70
assign ( resid 54 and name hn ) ( resid 53 and name ha ) 2.30 0.00 3.70
assign ( resid 55 and name hn ) ( resid 54 and name ha ) 2.30 0.00 3.70
assign ( resid 56 and name hn ) ( resid 55 and name ha ) 2.30 0.00 3.70
assign ( resid 57 and name hn ) ( resid 56 and name ha ) 2.30 0.00 3.70
assign ( resid 58 and name hn ) ( resid 57 and name ha ) 1.80 0.00 3.20
assign ( resid 59 and name hn ) ( resid 58 and name ha ) 1.80 0.00 1.80
assign ( resid 60 and name hn ) ( resid 59 and name ha ) 1.80 0.00 3.20
assign ( resid 61 and name hn ) ( resid 60 and name ha ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 61 and name ha ) 1.80 0.00 1.80
assign ( resid 63 and name hn ) ( resid 62 and name ha ) 1.80 0.00 1.80
assign ( resid 64 and name hn ) ( resid 63 and name ha ) 1.80 0.00 1.00
assign ( resid 66 and name hn ) ( resid 65 and name ha ) 1.80 0.00 1.80
assign ( resid 67 and name hn ) ( resid 66 and name ha ) 1.80 0.00 1.80
assign ( resid 68 and name hn ) ( resid 67 and name ha ) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 68 and name ha ) 2.30 0.00 3.70
assign ( resid 70 and name hn ) ( resid 69 and name ha ) 2.30 0.00 3.70
assign ( resid 72 and name hn ) ( resid 71 and name ha ) 1.80 0.00 1.80
assign ( resid 73 and name hn ) ( resid 72 and name ha1 ) 1.80 0.00 3.20
assign ( resid 73 and name hn ) ( resid 72 and name ha2 ) 1.80 0.00 3.20
assign ( resid 74 and name hn ) ( resid 73 and name ha ) 1.80 0.00 1.80
assign ( resid 75 and name hn ) ( resid 74 and name ha1 ) 1.80 0.00 1.80
assign ( resid 75 and name hn ) ( resid 74 and name ha2 ) 1.80 0.00 3.20
assign ( resid 76 and name hn ) ( resid 75 and name ha ) 1.80 0.00 3.20
assign ( resid 77 and name hn ) ( resid 76 and name ha ) 1.80 0.00 3.20
assign ( resid 78 and name hn ) ( resid 77 and name ha ) 1.80 0.00 1.80
assign ( resid 79 and name hn ) ( resid 78 and name ha ) 1.80 0.00 1.80
assign ( resid 80 and name hn ) ( resid 79 and name ha ) 1.80 0.00 1.80
assign ( resid 82 and name hn ) ( resid 81 and name ha ) 1.80 0.00 3.20
assign ( resid 83 and name hn ) ( resid 82 and name ha ) 1.80 0.00 3.20
assign ( resid 84 and name hn ) ( resid 83 and name ha ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 84 and name ha ) 2.30 0.00 3.70
assign ( resid 86 and name hn ) ( resid 85 and name ha ) 2.30 0.00 3.70
assign ( resid 87 and name hn ) ( resid 86 and name ha ) 2.30 0.00 3.70
assign ( resid 88 and name hn ) ( resid 87 and name ha ) 2.30 0.00 3.70
assign ( resid 89 and name hn ) ( resid 88 and name ha ) 2.30 0.00 3.70
assign ( resid 90 and name hn ) ( resid 89 and name ha ) 2.30 0.00 3.70
assign ( resid 91 and name hn ) ( resid 90 and name ha ) 2.30 0.00 3.70
assign ( resid 92 and name hn ) ( resid 91 and name ha ) 2.30 0.00 3.70
assign ( resid 93 and name hn ) ( resid 92 and name ha ) 1.80 0.00 1.80
assign ( resid 94 and name hn ) ( resid 93 and name ha ) 1.80 0.00 1.80
assign ( resid 95 and name hn ) ( resid 94 and name ha ) 1.80 0.00 1.80
assign ( resid 96 and name hn ) ( resid 95 and name ha ) 1.80 0.00 1.00
assign ( resid 97 and name hn ) ( resid 96 and name ha ) 1.80 0.00 3.20 
assign ( resid 98 and name hn ) ( resid 97 and name ha ) 1.80 0.00 3.20
assign ( resid 99 and name hn ) ( resid 98 and name ha ) 1.80 0.00 3.20
assign ( resid 100 and name hn ) ( resid 99 and name ha* ) 1.80 0.00 2.30
assign ( resid 101 and name hn ) ( resid 100 and name ha ) 1.80 0.00 3.20

!remote (i-i+5~~~~~~~~)

assign ( resid 62 and name hn ) ( resid 80 and name hn ) 1.80 0.00 3.20
assign ( resid 62 and name hn ) ( resid 78 and name hn ) 1.80 0.00 3.20
assign ( resid 77 and name hn ) ( resid 24 and name hn ) 1.80 0.00 3.20
assign ( resid 77 and name hn ) ( resid 64 and name hn ) 2.30 0.00 3.70
assign ( resid 78 and name hn ) ( resid 64 and name hn ) 2.30 0.00 3.70
assign ( resid 3 and name hn ) ( resid 39 and name he* ) 2.30 0.00 4.20
assign ( resid 3 and name hn ) ( resid 39 and name hd*) 2.30 0.00 4.20
assign ( resid 6 and name hn ) ( resid 11 and name hd1* ) 2.30 0.00 3.70
assign ( resid 6 and name hn ) ( resid 11 and name ha ) 2.30 0.00 3.70
!assign ( resid 6 and name hn ) ( resid 51 and name hd1* ) 2.30 0.00 4.70
assign ( resid 7 and name hn ) ( resid 95 and name hg* ) 2.30 0.00 4.20
assign ( resid 7 and name hn ) ( resid 95 and name hd* ) 2.30 0.00 4.20
assign ( resid 9 and name hn ) ( resid 51 and name hd1* ) 2.30 0.00 4.20
assign ( resid 11 and name hn ) ( resid 6 and name hb2 ) 2.30 0.00 3.70
assign ( resid 11 and name hn ) ( resid 51 and name hd1* ) 2.30 0.00 4.20
assign ( resid 11 and name hn ) ( resid 6 and name hd* ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 29 and name hb ) 2.30 0.00 4.70
assign ( resid 12 and name hn ) ( resid 61 and name he* ) 2.30 0.00 4.20
assign ( resid 12 and name hn ) ( resid 61 and name hz ) 1.80 0.00 3.20
assign ( resid 12 and name hn ) ( resid 51 and name hd1*) 2.30 0.00 4.20
assign ( resid 13 and name hn ) ( resid 61 and name he*) 1.80 0.00 3.70
assign ( resid 13 and name hn ) ( resid 61 and name hd*) 1.80 0.00 3.70
assign ( resid 13 and name hn ) ( resid 79 and name hd* ) 2.30 0.00 4.20
assign ( resid 13 and name hn ) ( resid 91 and name hb* ) 2.30 0.00 4.20
assign ( resid 15 and name hn ) ( resid 29 and name hd1* ) 2.30 0.00 3.70
assign ( resid 16 and name hn ) ( resid 29 and name hd1* ) 2.30 0.00 4.20 
assign ( resid 19 and name hn ) ( resid 24 and name hg ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 16 and name hg2* ) 2.30 0.00 4.20
assign ( resid 23 and name hn ) ( resid 78 and name ha ) 2.30 0.00 3.70
assign ( resid 23 and name hn ) ( resid 16 and name hg2* ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 76 and name hd* ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 77 and name hb* ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 76 and name ha ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 76 and name hb* ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 16 and name hg2* ) 1.80 0.00 2.30
assign ( resid 24 and name hn ) ( resid 16 and name hg11 ) 2.30 0.00 4.70
assign ( resid 26 and name hn ) ( resid 77 and name hd1) 2.30 0.00 3.70
assign ( resid 29 and name hn ) ( resid 24 and name hg) 2.30 0.00 3.70
assign ( resid 29 and name hn ) ( resid 12 and name hg2*) 2.30 0.00 4.20
assign ( resid 32 and name hn ) ( resid 15 and name hb* ) 1.80 0.00 3.70
assign ( resid 33 and name hn ) ( resid 15 and name hb* ) 1.80 0.00 3.70
assign ( resid 34 and name hn ) ( resid 47 and name hh2) 2.30 0.00 3.70
assign ( resid 34 and name hn ) ( resid 47 and name hz3) 2.30 0.00 3.70
assign ( resid 40 and name hn ) ( resid 33 and name hd1* ) 1.80 0.00 3.70
!assign ( resid 41 and name hn ) ( resid 47 and name he1 ) 2.30 0.00 3.70
assign ( resid 47 and name hn ) ( resid 40 and name he* ) 1.80 0.00 3.70
assign ( resid 51 and name hn ) ( resid 12 and name hg11 ) 2.30 0.00 4.70
assign ( resid 52 and name hn ) ( resid 30 and name he* ) 2.30 0.00 4.20
assign ( resid 54 and name hn ) ( resid 12 and name hg12 ) 2.30 0.00 4.70
assign ( resid 55 and name hn ) ( resid 12 and name hg11 ) 2.30 0.00 3.70
assign ( resid 55 and name hn ) ( resid 26 and name hg ) 2.30 0.00 4.70
assign ( resid 60 and name hn ) ( resid 87 and name hd2* ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 77 and name ha ) 2.30 0.00 4.70
assign ( resid 62 and name hn ) ( resid 79 and name ha ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 78 and name ha ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 77 and name he3 ) 2.30 0.00 4.70
assign ( resid 62 and name hn ) ( resid 55 and name hd* ) 2.30 0.00 4.70
assign ( resid 64 and name hn ) ( resid 76 and name hb* ) 1.80 0.00 3.70
assign ( resid 64 and name hn ) ( resid 77 and name ha ) 2.30 0.00 3.70
assign ( resid 64 and name hn ) ( resid 76 and name hd* ) 2.30 0.00 4.20
assign ( resid 76 and name hn ) ( resid 63 and name hb1 ) 2.30 0.00 3.70
assign ( resid 76 and name hn ) ( resid 64 and name hb ) 2.30 0.00 4.70
assign ( resid 77 and name hn ) ( resid 26 and name hg ) 2.30 0.00 3.70
assign ( resid 77 and name hn ) ( resid 25 and name hb ) 2.30 0.00 3.70
assign ( resid 77 and name hn ) ( resid 25 and name ha ) 2.30 0.00 3.70
assign ( resid 77 and name hn ) ( resid 23 and name ha ) 2.30 0.00 3.70
assign ( resid 78 and name hn ) ( resid 63 and name ha ) 2.30 0.00 3.70
assign ( resid 78 and name hn ) ( resid 61 and name ha ) 2.30 0.00 4.70
assign ( resid 78 and name hn ) ( resid 62 and name hg12) 1.80 0.00 3.20
assign ( resid 78 and name hn ) ( resid 62 and name hb) 2.30 0.00 4.20
assign ( resid 79 and name hn ) ( resid 16 and name hg11 ) 2.30 0.00 2.70
assign ( resid 79 and name hn ) ( resid 16 and name hg2* ) 1.80 0.00 3.20
assign ( resid 79 and name hn ) ( resid 23 and name ha ) 2.30 0.00 3.70
assign ( resid 80 and name hn ) ( resid 62 and name hg2* ) 1.80 0.00 3.70
assign ( resid 80 and name hn ) ( resid 61 and name hd2 ) 2.30 0.00 4.20
assign ( resid 80 and name hn ) ( resid 61 and name ha ) 2.30 0.00 3.70
assign ( resid 80 and name hn ) ( resid 87 and name hd2* ) 1.80 0.00 3.70
assign ( resid 80 and name hn ) ( resid 62 and name hg12 ) 1.80 0.00 2.70
assign ( resid 80 and name hn ) ( resid 60 and name hb1 ) 2.30 0.00 4.70
assign ( resid 80 and name hn ) ( resid 60 and name hb2 ) 2.30 0.00 4.70
assign ( resid 88 and name hn ) ( resid 13 and name hg1* ) 2.30 0.00 4.20
assign ( resid 90 and name hn ) ( resid 13 and name hg1* ) 2.30 0.00 4.20
assign ( resid 91 and name hn ) ( resid 13 and name hg1* ) 1.80 0.00 3.70
assign ( resid 93 and name hn ) ( resid  6 and name he1 ) 2.30 0.00 4.20
assign ( resid 94 and name hn ) ( resid  6 and name he1 ) 2.30 0.00 4.20
assign ( resid 95 and name hn ) ( resid  6 and name hd1 ) 2.30 0.00 4.20
assign ( resid 95 and name hn ) ( resid  6 and name he1 ) 2.30 0.00 4.20
assign ( resid 6 and name ha ) ( resid 11 and name hd1* ) 2.30 0.00 4.20
assign ( resid 6 and name ha ) ( resid 11 and name hd2* ) 2.30 0.00 4.70
assign ( resid 6 and name ha ) ( resid 95 and name hg* ) 1.80 0.00 3.70
assign ( resid 6 and name hb1 ) ( resid 11 and name hd1* ) 2.30 0.00 4.20
assign ( resid 8 and name hb2 ) ( resid 51 and name hd1* ) 2.30 0.00 4.20
assign ( resid 10 and name ha ) ( resid 91 and name hb* ) 1.80 0.00 3.0
assign ( resid 12 and name hg11 ) ( resid 55 and name hg ) 1.80 0.00 3.20
assign ( resid 12 and name hg11 ) ( resid 55 and name hd* ) 1.80 0.00 2.30
assign ( resid 12 and name hg2* ) ( resid 55 and name hg ) 1.80 0.00 3.70
assign ( resid 12 and name hg2* ) ( resid 55 and name hd* ) 1.80 0.00 4.20
assign ( resid 13 and name ha ) ( resid 79 and name hd* ) 2.30 0.00 3.70
assign ( resid 13 and name hb ) ( resid 91 and name hb* ) 1.80 0.00 2.30
assign ( resid 13 and name hg2* ) ( resid 87 and name hd1* ) 1.80 0.00 4.20
assign ( resid 13 and name hg2* ) ( resid 87 and name hd2* ) 1.80 0.00 4.20
assign ( resid 14 and name ha ) ( resid 91 and name hb* ) 1.80 0.00 3.70
assign ( resid 15 and name hb* ) ( resid 24 and name hd* ) 2.30 0.00 4.70
assign ( resid 16 and name ha ) ( resid 24 and name hg ) 1.80 0.00 3.20
assign ( resid 16 and name ha ) ( resid 24 and name hb1 ) 2.30 0.00 3.70
assign ( resid 16 and name ha) ( resid 24 and name hd* ) 1.80 0.00 2.30
assign ( resid 16 and name hb* ) ( resid 24 and name hg ) 1.80 0.00 3.70
assign ( resid 16 and name hg2* ) ( resid 78 and name ha ) 1.80 0.00 2.30
assign ( resid 16 and name hg2* ) ( resid 23 and name ha ) 1.80 0.00 3.70
assign ( resid 17 and name hb1 ) ( resid 88 and name hg1* ) 1.80 0.00 3.70
assign ( resid 17 and name hb2 ) ( resid 88 and name hg1* ) 1.80 0.00 3.70
assign ( resid 19 and name hb* ) ( resid 24 and name hg ) 1.80 0.00 3.70
assign ( resid 19 and name hb* ) ( resid 24 and name hd* ) 1.80 0.00 4.20
assign ( resid 23 and name ha ) ( resid 78 and name ha ) 1.80 0.00 3.20
assign ( resid 23 and name ha ) ( resid 16 and name ha ) 2.30 0.00 4.70
assign ( resid 23 and name ha ) ( resid 78 and name hb1 ) 2.30 0.00 4.70
assign ( resid 23 and name ha ) ( resid 78 and name hb2 ) 2.30 0.00 4.70
assign ( resid 23 and name ha ) ( resid 16 and name hb ) 2.30 0.00 3.70
assign ( resid 23 and name ha ) ( resid 16 and name hg2* ) 1.80 0.00 3.70
assign ( resid 23 and name ha ) ( resid 16 and name hg12 ) 2.30 0.00 3.70
assign ( resid 23 and name ha ) ( resid 16 and name hg11 ) 2.30 0.00 3.70
assign ( resid 24 and name hd* ) ( resid 12 and name hg2* ) 2.30 0.00 4.70
assign ( resid 24 and name hg ) ( resid 12 and name hg2* ) 2.30 0.00 4.70 
assign ( resid 24 and name hb2 ) ( resid 51 and name hg2* ) 2.30 0.00 4.70
assign ( resid 25 and name ha ) ( resid 76 and name ha ) 1.80 0.00 3.20
assign ( resid 25 and name hb ) ( resid 75 and name hb2 ) 2.30 0.00 3.70
assign ( resid 29 and name ha ) ( resid 15 and name hb* ) 1.80 0.00 3.70
assign ( resid 29 and name ha ) ( resid 24 and name hg ) 2.30 0.00 4.20
assign ( resid 29 and name ha ) ( resid 24 and name hd* ) 1.80 0.00 3.70
assign ( resid 29 and name hd1* ) ( resid 12 and name hg2* ) 1.80 0.00 4.20
assign ( resid 29 and name hd1* ) ( resid 55 and name hd* ) 2.30 0.00 4.20 
assign ( resid 29 and name hd1* ) ( resid 55 and name hg ) 2.30 0.00 4.20
assign ( resid 29 and name hg2* ) ( resid 12 and name hg2* ) 1.80 0.00 4.20
assign ( resid 29 and name hg2* ) ( resid 55 and name hd* ) 2.30 0.00 4.70
assign ( resid 29 and name hg2* ) ( resid 55 and name hg ) 2.30 0.00 4.70
assign ( resid 32 and name hb2 ) ( resid 24 and name hd* ) 2.30 0.00 4.20
assign ( resid 32 and name hb1 ) ( resid 24 and name hd* ) 2.30 0.00 4.20
assign ( resid 32 and name hb2 ) ( resid 15 and name hb* ) 1.80 0.00 3.70 
assign ( resid 32 and name hb1 ) ( resid 15 and name hb* ) 1.80 0.00 2.30
assign ( resid 34 and name ha ) ( resid 41 and name hb1 ) 2.30 0.00 4.70
assign ( resid 34 and name ha ) ( resid 41 and name hb2 ) 2.30 0.00 4.70
assign ( resid 40 and name ha ) ( resid 33 and name hd1* ) 1.80 0.00 3.70 
assign ( resid 40 and name ha ) ( resid 34 and name hg2* ) 2.30 0.00 4.20
assign ( resid 51 and name ha ) ( resid 12 and name hg12 ) 1.80 0.00 3.20
assign ( resid 51 and name hg2* ) ( resid 12 and name hg2*) 1.80 0.00 3.70
assign ( resid 51 and name hg2* ) ( resid 29 and name hd1* ) 1.80 0.00 4.20
assign ( resid 51 and name hg11 ) ( resid 12 and name hg2* ) 1.80 0.00 4.20 
assign ( resid 51 and name hg11 ) ( resid 12 and name hg11 ) 1.80 0.00 3.20
assign ( resid 51 and name hg12 ) ( resid 12 and name hg2* ) 2.30 0.00 4.70
assign ( resid 51 and name hg2* ) ( resid 12 and name hg11 ) 1.80 0.00 3.70
assign ( resid 51 and name hd1* ) ( resid 12 and name hg2* ) 2.30 0.00 4.70
assign ( resid 51 and name hd1* ) ( resid 29 and name hd1* ) 1.80 0.00 2.80
assign ( resid 54 and name hb1 ) ( resid 12 and name hg11 ) 2.30 0.00 3.70
assign ( resid 54 and name hb2 ) ( resid 12 and name hg11 ) 2.30 0.00 4.70
assign ( resid 55 and name ha ) ( resid 12 and name hg11 ) 2.30 0.00 4.70
assign ( resid 55 and name ha ) ( resid 61 and name hb1 ) 2.30 0.00 3.70
assign ( resid 55 and name ha ) ( resid 61 and name hb2 ) 2.30 0.00 3.70
assign ( resid 60 and name ha ) ( resid 87 and name hd2* ) 2.30 0.00 4.20 
assign ( resid 60 and name hb1 ) ( resid 87 and name hd1* ) 2.30 0.00 4.20
assign ( resid 60 and name hb1 ) ( resid 87 and name hd2* ) 1.80 0.00 3.70 
assign ( resid 60 and name hb2 ) ( resid 87 and name hd2* ) 2.30 0.00 4.20
assign ( resid 61 and name ha ) ( resid 79 and name ha ) 1.80 0.00 3.20
assign ( resid 61 and name hb2 ) ( resid 55 and name hd* ) 2.30 0.00 4.20
assign ( resid 61 and name hb1 ) ( resid 55 and name hd* ) 2.30 0.00 4.20
assign ( resid 63 and name ha ) ( resid 77 and name ha ) 1.80 0.00 3.20
assign ( resid 75 and name hb1 ) ( resid 63 and name he* ) 2.30 0.00 4.20
assign ( resid 76 and name hb* ) ( resid 64 and name hg1* ) 2.30 0.00 4.70
assign ( resid 76 and name hb* ) ( resid 64 and name hg2* ) 1.80 0.00 4.20
assign ( resid 76 and name hb* ) ( resid 64 and name hb ) 2.30 0.00 4.20
assign ( resid 77 and name ha ) ( resid 64 and name hg1* ) 2.30 0.00 4.20
assign ( resid 77 and name hb* ) ( resid 55 and name hd* ) 1.80 0.00 4.20
assign ( resid 77 and name hb* ) ( resid 55 and name hg ) 2.30 0.00 4.20
assign ( resid 78 and name ha ) ( resid 16 and name hg2* ) 1.80 0.00 2.30
assign ( resid 78 and name ha ) ( resid 16 and name hg11 ) 2.30 0.00 4.20
assign ( resid 78 and name ha ) ( resid 16 and name hg12 ) 2.30 0.00 4.70
assign ( resid 79 and name ha ) ( resid 87 and name hd1*) 1.80 0.00 4.20
assign ( resid 79 and name ha ) ( resid 87 and name hd2*) 1.80 0.00 4.20
assign ( resid 79 and name hg1* ) ( resid 87 and name hd1* ) 1.80 0.00 2.80
assign ( resid 79 and name hg1* ) ( resid 87 and name hd2* ) 2.30 0.00 4.70
assign ( resid 79 and name hg2* ) ( resid 87 and name hd1* ) 1.80 0.00 4.20
assign ( resid 79 and name hg2* ) ( resid 87 and name hd2* ) 1.80 0.00 3.70
assign ( resid 79 and name hg2* ) ( resid 16 and name hg11 ) 2.30 0.00 3.70
assign ( resid 79 and name hg2* ) ( resid 13 and name hg1* ) 1.80 0.00 4.20
assign ( resid 79 and name hg2* ) ( resid 16 and name hg2* ) 1.80 0.00 3.70
assign ( resid 80 and name ha ) ( resid 62 and name hg2* ) 1.80 0.00 3.70
assign ( resid 80 and name ha ) ( resid 62 and name hg12 ) 2.30 0.00 3.70
assign ( resid 80 and name ha ) ( resid 62 and name hg11 ) 2.30 0.00 4.70
assign ( resid 80 and name hb* ) ( resid 62 and name hg2* ) 2.30 0.00 4.70
assign ( resid 81 and name hd2 ) ( resid 62 and name hg2* ) 1.80 0.00 4.70
assign ( resid 81 and name hd1 ) ( resid 62 and name hg2* ) 1.80 0.00 3.70
assign ( resid 91 and name ha ) ( resid 13 and name hg1* ) 1.80 0.00 3.20
assign ( resid 91 and name hb* ) ( resid 13 and name hg1* ) 1.80 0.00 2.00
assign ( resid 6 and name he* ) ( resid 37 and name hd* ) 1.80 0.00 4.20
assign ( resid 6 and name he* ) ( resid 37 and name he* ) 1.80 0.00 2.80
assign ( resid 6 and name he* ) ( resid 92 and name ha ) 2.30 0.00 4.20
assign ( resid 6 and name he* ) ( resid 94 and name ha ) 2.30 0.00 4.20
assign ( resid 6 and name he* ) ( resid 37 and name hb2 ) 2.30 0.00 4.20
assign ( resid 6 and name he* ) ( resid 94 and name hg* ) 1.80 0.00 4.20
assign ( resid 6 and name he* ) ( resid 11 and name hd1* ) 1.80 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 11 and name hd2* ) 2.30 0.00 4.70
assign ( resid 6 and name hd* ) ( resid 11 and name hd1* ) 1.80 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 95 and name hn ) 2.30 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 37 and name hd* ) 2.30 0.00 4.70
assign ( resid 6 and name hd* ) ( resid 37 and name he* ) 1.80 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 94 and name ha ) 2.30 0.00 4.20
assign ( resid 8 and name he* ) ( resid 51 and name hd1* ) 1.80 0.00 3.70
assign ( resid 8 and name he* ) ( resid 47 and name hb2 ) 2.30 0.00 4.20
assign ( resid 8 and name he* ) ( resid 47 and name hb1 ) 1.80 0.00 3.70
assign ( resid 8 and name he* ) ( resid 50 and name hb1 ) 2.30 0.00 4.20
assign ( resid 8 and name he* ) ( resid 50 and name hb2 ) 2.30 0.00 4.20
assign ( resid 8 and name hd* ) ( resid 40 and name he* ) 2.30 0.00 4.70
assign ( resid 8 and name hd* ) ( resid 47 and name ha ) 1.80 0.00 3.70
assign ( resid 8 and name hd* ) ( resid 50 and name hb1 ) 1.80 0.00 3.70
assign ( resid 8 and name hd* ) ( resid 50 and name hb2 ) 2.30 0.00 4.70
assign ( resid 8 and name hd* ) ( resid 51 and name hd1* ) 1.80 0.00 4.20
assign ( resid 8 and name hd* ) ( resid 51 and name hn ) 2.30 0.00 4.20
assign ( resid 10 and name he21 ) ( resid 91 and name hb* ) 2.30 0.00 4.20
assign ( resid 14 and name he22 ) ( resid 91 and name hb* ) 2.30 0.00 3.70
assign ( resid 14 and name he22 ) ( resid 37 and name hb2 ) 2.30 0.00 4.70
assign ( resid 30 and name he* ) ( resid 48 and name ha ) 1.80 0.00 3.70
assign ( resid 30 and name he* ) ( resid 51 and name hb ) 1.80 0.00 1.50
assign ( resid 30 and name he* ) ( resid 51 and name hg12 ) 1.80 0.00 3.70
assign ( resid 30 and name he* ) ( resid 51 and name hg2* ) 1.80 0.00 2.80
assign ( resid 30 and name he* ) ( resid 51 and name hd1* ) 1.80 0.00 4.20
assign ( resid 30 and name hd* ) ( resid 47 and name hh2) 1.80 0.00 2.30
assign ( resid 30 and name hd* ) ( resid 48 and name hb2 ) 2.30 0.00 4.20
assign ( resid 30 and name hd* ) ( resid 51 and name hg2* ) 1.80 0.00 4.20
assign ( resid 30 and name hd* ) ( resid 51 and name hb ) 2.30 0.00 4.20
assign ( resid 37 and name he* ) ( resid 5 and name hb2 ) 2.30 0.00 4.70
assign ( resid 37 and name he* ) ( resid 11 and name hd1* ) 2.30 0.00 4.70
assign ( resid 37 and name hd* ) ( resid 11 and name hd1* ) 2.30 0.00 4.20
!assign ( resid 39 and name he* ) ( resid 3 and name hd* ) 2.30 0.00 4.70
assign ( resid 39 and name he* ) ( resid 3 and name he* ) 2.30 0.00 4.70
assign ( resid 39 and name he* ) ( resid 3 and name hg2 ) 2.30 0.00 4.20
assign ( resid 39 and name he* ) ( resid 3 and name hg1 ) 2.30 0.00 4.20
assign ( resid 39 and name he* ) ( resid 2 and name hb* ) 2.30 0.00 4.70
assign ( resid 39 and name he* ) ( resid 3 and name hb1 ) 2.30 0.00 4.20
assign ( resid 39 and name he* ) ( resid 3 and name hb2 ) 2.30 0.00 4.20
assign ( resid 39 and name he* ) ( resid 3 and name ha ) 2.30 0.00 4.20
assign ( resid 39 and name he* ) ( resid 2 and name ha ) 2.30 0.00 4.20
assign ( resid 39 and name hd* ) ( resid 2 and name ha ) 2.30 0.00 4.20
assign ( resid 39 and name hd* ) ( resid 3 and name ha ) 2.30 0.00 4.70
assign ( resid 40 and name hd* ) ( resid 34 and name ha ) 2.30 0.00 4.20
assign ( resid 40 and name hd* ) ( resid 34 and name hg2* ) 2.30 0.00 4.70
assign ( resid 40 and name hd* ) ( resid 47 and name he1 ) 2.30 0.00 4.20
assign ( resid 40 and name hd* ) ( resid 47 and name hd1 ) 2.30 0.00 4.20
assign ( resid 40 and name hd* ) ( resid 47 and name he3 ) 2.30 0.00 4.70
assign ( resid 40 and name hd* ) ( resid 11 and name hd1* ) 2.30 0.00 4.70
assign ( resid 40 and name hd* ) ( resid 11 and name hd2* ) 2.30 0.00 4.70
assign ( resid 40 and name hd* ) ( resid 33 and name hd1* ) 1.80 0.00 2.80
assign ( resid 40 and name he* ) ( resid 11 and name hd1* ) 1.80 0.00 4.20
assign ( resid 40 and name he* ) ( resid 11 and name hd2* ) 2.30 0.00 4.70
assign ( resid 40 and name he* ) ( resid 47 and name ha ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 33 and name hd1* ) 2.30 0.00 4.70
assign ( resid 40 and name he* ) ( resid 3 and name hg1 ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 3 and name hg2 ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 3 and name hb1 ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 3 and name hb2 ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 47 and name hn ) 2.30 0.00 4.20
assign ( resid 40 and name he* ) ( resid 8 and name he* ) 2.30 0.00 4.70
assign ( resid 40 and name he* ) ( resid 3 and name ha ) 2.30 0.00 4.70
assign ( resid 40 and name he* ) ( resid 11 and name hd1* ) 2.30 0.00 4.70
assign ( resid 40 and name he* ) ( resid 47 and name hb1 ) 1.80 0.00 2.30
assign ( resid 40 and name he* ) ( resid 47 and name hb2 ) 1.80 0.00 3.70
assign ( resid 47 and name hd1 ) ( resid 40 and name he* ) 2.30 0.00 4.20
assign ( resid 47 and name hd1 ) ( resid 40 and name hd* ) 2.30 0.00 4.20
assign ( resid 47 and name hh2 ) ( resid 33 and name hn ) 2.30 0.00 4.70
assign ( resid 47 and name hh2 ) ( resid 30 and name hd* ) 1.80 0.00 3.70
assign ( resid 47 and name hh2 ) ( resid 34 and name ha ) 2.30 0.00 3.70
assign ( resid 47 and name hh2 ) ( resid 33 and name hb ) 2.30 0.00 4.70
assign ( resid 47 and name hh2 ) ( resid 34 and name hb ) 2.30 0.00 3.70
assign ( resid 47 and name hh2 ) ( resid 30 and name hb1 ) 1.80 0.00 3.20
assign ( resid 47 and name hh2 ) ( resid 30 and name hb2 ) 1.80 0.00 3.20
assign ( resid 47 and name hh2 ) ( resid 33 and name hg2* ) 1.80 0.00 3.70
assign ( resid 47 and name hh2 ) ( resid 34 and name hg2* ) 1.80 0.00 2.30
assign ( resid 47 and name hh2 ) ( resid 33 and name hd1* ) 1.80 0.00 3.70
assign ( resid 47 and name he3 ) ( resid 29 and name hd1* ) 1.80 0.00 3.70
assign ( resid 47 and name he3 ) ( resid 29 and name hg2* ) 1.80 0.00 3.70
assign ( resid 47 and name he3 ) ( resid 54 and name hd21 ) 2.30 0.00 3.70
assign ( resid 47 and name he3 ) ( resid 30 and name he* ) 1.80 0.00 3.70
assign ( resid 47 and name hz2 ) ( resid 34 and name hg2* ) 1.80 0.00 3.70
assign ( resid 54 and name hd21 ) ( resid 12 and name hg11 ) 2.30 0.00 4.70
assign ( resid 58 and name hd21 ) ( resid 12 and name hg11 ) 2.30 0.00 3.70
assign ( resid 58 and name hd21 ) ( resid 9 and name hb* ) 2.30 0.00 4.20
assign ( resid 60 and name he* ) ( resid 83 and name hb1 ) 2.30 0.00 4.20
assign ( resid 60 and name he* ) ( resid 87 and name hd1* ) 1.80 0.00 4.80
assign ( resid 60 and name he* ) ( resid 87 and name hd2* ) 1.80 0.00 4.80
assign ( resid 60 and name hd* ) ( resid 87 and name hd1* ) 1.80 0.00 4.20
assign ( resid 60 and name hd* ) ( resid 87 and name hd2* ) 1.80 0.00 4.20
assign ( resid 60 and name hd* ) ( resid 83 and name hb1 ) 2.30 0.00 4.20
assign ( resid 61 and name he* ) ( resid 13 and name ha ) 1.80 0.00 3.70
assign ( resid 61 and name he* ) ( resid 12 and name hb ) 2.30 0.00 4.20
assign ( resid 61 and name he* ) ( resid 54 and name hb1 ) 2.30 0.00 4.20
assign ( resid 61 and name he* ) ( resid 79 and name hb ) 1.80 0.00 2.30
assign ( resid 61 and name he* ) ( resid 15 and name hb* ) 2.30 0.00 4.70
assign ( resid 61 and name he* ) ( resid 79 and name hg2* ) 1.80 0.00 4.20
assign ( resid 61 and name he* ) ( resid 12 and name hg11 ) 1.80 0.00 3.70
assign ( resid 61 and name he* ) ( resid 12 and name hg2* ) 1.80 0.00 4.20
assign ( resid 61 and name hd* ) ( resid 55 and name ha ) 1.80 0.00 3.70
assign ( resid 61 and name hd* ) ( resid 55 and name hd* ) 1.80 0.00 4.20
assign ( resid 61 and name hd* ) ( resid 55 and name hg ) 2.30 0.00 4.20
assign ( resid 61 and name hd* ) ( resid 79 and name hb ) 1.80 0.00 2.30
assign ( resid 61 and name hd* ) ( resid 16 and name hg11) 1.80 0.00 3.70
assign ( resid 61 and name hd* ) ( resid 79 and name hg2* ) 1.80 0.00 4.20
assign ( resid 61 and name hd* ) ( resid 12 and name hg11 ) 2.30 0.00 4.20
assign ( resid 61 and name hd* ) ( resid 12 and name hg2* ) 1.80 0.00 4.20
assign ( resid 76 and name hd* ) ( resid 24 and name ha ) 2.30 0.00 4.20
assign ( resid 76 and name hz ) ( resid 23 and name he21 ) 2.30 0.00 3.70
assign ( resid 76 and name hd* ) ( resid 25 and name ha ) 2.30 0.00 4.20
assign ( resid 76 and name hd* ) ( resid 23 and name hb2 ) 2.30 0.00 4.20
assign ( resid 76 and name hd* ) ( resid 23 and name hg1) 2.30 0.00 4.20
assign ( resid 76 and name hd* ) ( resid 23 and name hg2 ) 2.30 0.00 4.70
assign ( resid 76 and name hd* ) ( resid 25 and name hg2* ) 1.80 0.00 4.20
assign ( resid 76 and name he* ) ( resid 25 and name hg2* ) 1.80 0.00 4.20
assign ( resid 76 and name he* ) ( resid 24 and name ha ) 2.30 0.00 4.20
assign ( resid 76 and name he* ) ( resid 24 and name hn ) 2.30 0.00 4.20
assign ( resid 76 and name he* ) ( resid 24 and name hd* ) 2.30 0.00 4.70
!assign ( resid 76 and name he* ) ( resid 66 and name ha ) 2.30 0.00 4.20
assign ( resid 77 and name hh2 ) ( resid 61 and name hb1 ) 1.80 0.00 3.20
assign ( resid 77 and name hh2 ) ( resid 61 and name hb2 ) 2.30 0.00 4.20                                                                   
assign ( resid 77 and name hh2 ) ( resid 55 and name hb2 ) 1.80 0.00 3.20
assign ( resid 77 and name hh2 ) ( resid 55 and name hb1 ) 2.30 0.00 3.70
assign ( resid 77 and name hh2 ) ( resid 55 and name hg ) 2.30 0.00 3.70
assign ( resid 77 and name hh2 ) ( resid 55 and name hd* ) 1.80 0.00 3.70
assign ( resid 77 and name hd1 ) ( resid 25 and name hb ) 2.30 0.00 4.70
assign ( resid 77 and name hd1 ) ( resid 25 and name ha ) 1.80 0.00 3.20
assign ( resid 77 and name hd1 ) ( resid 26 and name ha ) 2.30 0.00 4.20
assign ( resid 77 and name hd1 ) ( resid 26 and name hb1 ) 2.30 0.00 3.70
assign ( resid 77 and name hd1 ) ( resid 26 and name hd1*) 2.30 0.00 4.20
assign ( resid 77 and name hd1 ) ( resid 26 and name hg ) 2.30 0.00 3.70
assign ( resid 77 and name hd1 ) ( resid 55 and name hg ) 2.30 0.00 3.70
assign ( resid 77 and name hd1 ) ( resid 55 and name hd*) 2.30 0.00 4.20
assign ( resid 77 and name he1 ) ( resid 55 and name hg ) 2.30 0.00 3.70
assign ( resid 77 and name he1 ) ( resid 26 and name hn ) 2.30 0.00 3.70
assign ( resid 77 and name hz2 ) ( resid 55 and name hb1 ) 2.30 0.00 4.70
assign ( resid 77 and name hz2 ) ( resid 55 and name hb2 ) 2.30 0.00 3.70
assign ( resid 77 and name hz2 ) ( resid 26 and name hg ) 2.30 0.00 4.70
assign ( resid 77 and name hz2 ) ( resid 55 and name hd* ) 1.80 0.00 3.70
assign ( resid 77 and name hz2 ) ( resid 55 and name hg ) 1.80 0.00 3.20
assign ( resid 77 and name he3 ) ( resid 62 and name hn ) 2.30 0.00 4.70
assign ( resid 77 and name he3 ) ( resid 61 and name ha ) 1.80 0.00 3.20
assign ( resid 77 and name he3 ) ( resid 63 and name ha ) 1.80 0.00 3.20
assign ( resid 78 and name ne ) ( resid 64 and name hg1* ) 2.30 0.00 4.70
assign ( resid 78 and name ne ) ( resid 64 and name hg2* ) 2.30 0.00 4.70
assign ( resid 92 and name hd* ) ( resid 14 and name ha ) 2.30 0.00 4.70

!inter assign mediate NOEs  (i-i+1~~~i-i+4)

assign ( resid 2 and name hn ) ( resid 1 and name hb1 ) 2.30 0.00 3.70
assign ( resid 2 and name hn ) ( resid 1 and name hb2 ) 2.30 0.00 3.70
assign ( resid 3 and name hn ) ( resid 2 and name hb* ) 2.30 0.00 4.20
assign ( resid 3 and name hn ) ( resid 4 and name hd1 ) 2.30 0.00 3.70
assign ( resid 3 and name hn ) ( resid 4 and name hd2 ) 1.80 0.00 3.20
assign ( resid 6 and name hn ) ( resid 5 and name hb1 ) 2.30 0.00 3.70
assign ( resid 6 and name hn ) ( resid 5 and name hb2 ) 2.30 0.00 3.70
assign ( resid 6 and name he* ) ( resid 5 and name hb1 ) 2.30 0.00 4.20
assign ( resid 6 and name he* ) ( resid 10 and name he22 ) 2.30 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 7 and name hb2 ) 2.30 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 5 and name hb2 ) 2.30 0.00 4.20
assign ( resid 6 and name hd* ) ( resid 5 and name hb1 ) 1.80 0.00 3.70
assign ( resid 6 and name hd* ) ( resid 10 and name he22 ) 2.30 0.00 4.20
assign ( resid 7 and name hn ) ( resid 6 and name hb1 ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 6 and name hb2 ) 1.80 0.00 3.20
assign ( resid 7 and name hn ) ( resid 6 and name hd* ) 1.80 0.00 3.70
assign ( resid 7 and name hn ) ( resid 10 and name hg1 ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 10 and name hg2 ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 10 and name ha ) 2.30 0.00 4.70
assign ( resid 7 and name hn ) ( resid 10 and name hb2 ) 1.80 0.00 3.20
assign ( resid 8 and name hn ) ( resid 7 and name hb1 ) 1.80 0.00 1.80
assign ( resid 8 and name hn ) ( resid 7 and name hb2 ) 1.80 0.00 3.20
assign ( resid 8 and name hn ) ( resid 10 and name hn ) 2.30 0.00 3.70
!assign ( resid 8 and name he* ) ( resid 11 and name hg ) 2.30 0.00 4.70
assign ( resid 8 and name he* ) ( resid 11 and name hd2* ) 1.80 0.00 4.20
assign ( resid 8 and name he* ) ( resid 11 and name hd1* ) 2.30 0.00 4.70
assign ( resid 8 and name hd* ) ( resid 11 and name hd2* ) 1.80 0.00 4.20
assign ( resid 8 and name hd* ) ( resid 11 and name hd1* ) 2.30 0.00 4.70
assign ( resid 8 and name he* ) ( resid 11 and name hb1 ) 2.30 0.00 4.70
assign ( resid 8 and name he* ) ( resid 11 and name hb2 ) 2.30 0.00 4.70
assign ( resid 9 and name hn ) ( resid 8 and name hb1 ) 1.80 0.00 3.20
assign ( resid 9 and name hn ) ( resid 8 and name hb2 ) 1.80 0.00 3.20
assign ( resid 9 and name hn ) ( resid 7 and name hb1 ) 1.80 0.00 3.20
assign ( resid 9 and name hn ) ( resid 7 and name hb2 ) 1.80 0.00 3.20
assign ( resid 9 and name hn ) ( resid 8 and name he* ) 2.30 0.00 4.70
assign ( resid 9 and name hn ) ( resid 8 and name hd* ) 2.30 0.00 4.20
assign ( resid 9 and name hn ) ( resid 12 and name hg11 ) 2.30 0.00 4.70
assign ( resid 9 and name hn ) ( resid 7 and name ha ) 2.30 0.00 3.70
assign ( resid 9 and name hn ) ( resid 11 and name hn ) 1.80 0.00 1.80
assign ( resid 10 and name hn ) ( resid 9 and name hb* ) 1.80 0.00 2.30
assign ( resid 10 and name hn ) ( resid 7 and name hn ) 2.30 0.00 3.70
assign ( resid 10 and name hn ) ( resid 12 and name hn ) 1.80 0.00 1.80
assign ( resid 10 and name hn ) ( resid 6 and name ha ) 2.30 0.00 3.70
assign ( resid 11 and name hn ) ( resid 10 and name hb2) 1.80 0.00 3.20
assign ( resid 11 and name hn ) ( resid 10 and name hg2 ) 2.30 0.00 3.70
assign ( resid 11 and name hn ) ( resid 8 and name ha ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 8 and name ha ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 11 and name hb1 ) 1.80 0.00 3.20
assign ( resid 12 and name hn ) ( resid 11 and name hb2 ) 1.80 0.00 3.20
assign ( resid 12 and name hn ) ( resid 11 and name hg ) 1.80 0.00 3.20
assign ( resid 12 and name hn ) ( resid 11 and name hd1* ) 1.80 0.00 3.70
assign ( resid 12 and name hn ) ( resid 11 and name hd2* ) 1.80 0.00 3.70
assign ( resid 12 and name hn ) ( resid 10 and name ha ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 9 and name ha ) 2.30 0.00 3.70
assign ( resid 12 and name hn ) ( resid 15 and name hn ) 2.30 0.00 3.70
assign ( resid 13 and name hn ) ( resid 9 and name ha ) 2.30 0.00 4.20
assign ( resid 13 and name hn ) ( resid 12 and name hb ) 1.80 0.00 3.20
assign ( resid 13 and name hn ) ( resid 12 and name hg11 ) 2.30 0.00 3.70
assign ( resid 13 and name hn ) ( resid 12 and name hg12 ) 1.80 0.00 3.20
assign ( resid 13 and name hn ) ( resid 12 and name hg2* ) 1.80 0.00 3.70
assign ( resid 13 and name hn ) ( resid 10 and name ha ) 2.30 0.00 3.70
assign ( resid 14 and name hn ) ( resid 13 and name hg1* ) 1.80 0.00 3.70
assign ( resid 14 and name hn ) ( resid 13 and name hg2*) 1.80 0.00 3.70
assign ( resid 14 and name hn ) ( resid 13 and name hb ) 1.80 0.00 3.20
assign ( resid 14 and name hn ) ( resid 11 and name ha ) 2.30 0.00 3.70
assign ( resid 14 and name hn ) ( resid 10 and name ha ) 2.30 0.00 3.70
assign ( resid 15 and name hn ) ( resid 14 and name hb1 ) 1.80 0.00 3.20
assign ( resid 15 and name hn ) ( resid 14 and name hb2 ) 1.80 0.00 3.20
assign ( resid 15 and name hn ) ( resid 12 and name ha ) 2.30 0.00 3.70
assign ( resid 15 and name hn ) ( resid 17 and name hn ) 2.30 0.00 3.70
assign ( resid 15 and name hn ) ( resid 13 and name hg1* ) 2.30 0.00 4.20
assign ( resid 15 and name hn ) ( resid 13 and name ha ) 1.80 0.00 3.20
assign ( resid 16 and name hn ) ( resid 15 and name hb* ) 1.80 0.00 2.30
assign ( resid 16 and name hn ) ( resid 12 and name hg2* ) 2.30 0.00 4.20
assign ( resid 16 and name hn ) ( resid 12 and name hb ) 1.80 0.00 3.20
assign ( resid 16 and name hn ) ( resid 13 and name ha ) 2.30 0.00 3.70
assign ( resid 16 and name hn ) ( resid 18 and name hn ) 2.30 0.00 3.70
assign ( resid 17 and name hn ) ( resid 15 and name hb* ) 2.30 0.00 4.20
assign ( resid 17 and name hn ) ( resid 14 and name ha ) 2.30 0.00 3.70
assign ( resid 17 and name hn ) ( resid 16 and name hb ) 1.80 0.00 1.80
assign ( resid 17 and name hn ) ( resid 16 and name hg11 ) 1.80 0.00 3.20
assign ( resid 17 and name hn ) ( resid 16 and name hg12 ) 1.80 0.00 3.20
assign ( resid 17 and name hn ) ( resid 16 and name hg2*) 1.80 0.00 3.70
assign ( resid 18 and name hn ) ( resid 15 and name ha ) 2.30 0.00 3.70
assign ( resid 18 and name hn ) ( resid 17 and name hb1 ) 1.80 0.00 3.20
assign ( resid 18 and name hn ) ( resid 17 and name hb2 ) 1.80 0.00 1.80
assign ( resid 18 and name hn ) ( resid 19 and name hb* ) 1.80 0.00 3.70
assign ( resid 18 and name hn ) ( resid 16 and name hg12 ) 2.30 0.00 3.70
assign ( resid 18 and name hn ) ( resid 16 and name ha ) 2.30 0.00 3.70
assign ( resid 18 and name hn ) ( resid 14 and name ha ) 2.30 0.00 3.70
assign ( resid 19 and name hn ) ( resid 18 and name hb1 ) 1.80 0.00 3.20
assign ( resid 19 and name hn ) ( resid 18 and name hb2 ) 1.80 0.00 3.20
assign ( resid 19 and name hn ) ( resid 17 and name hn ) 1.80 0.00 3.20
assign ( resid 19 and name hn ) ( resid 16 and name hg2* ) 2.30 0.00 4.20
assign ( resid 19 and name hn ) ( resid 16 and name ha ) 2.30 0.00 4.20 
assign ( resid 19 and name hn ) ( resid 16 and name hg11 ) 2.30 0.00 3.70
assign ( resid 19 and name hn ) ( resid 16 and name hg12 ) 2.30 0.00 3.70
assign ( resid 19 and name hn ) ( resid 22 and name hn ) 2.30 0.00 3.70
assign ( resid 20 and name hn ) ( resid 19 and name hb* ) 2.30 0.00 4.20
assign ( resid 21 and name hn ) ( resid 19 and name hb* ) 2.30 0.00 4.20
assign ( resid 21 and name hn ) ( resid 20 and name hb1 ) 2.30 0.00 3.70
assign ( resid 21 and name hn ) ( resid 20 and name hg2 ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 20 and name ha ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 23 and name hn ) ( resid 24 and name hg ) 2.30 0.00 4.70
assign ( resid 23 and name hn ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 23 and name he21 ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 23 and name he22 ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 24 and name hn ) ( resid 23 and name hb1 ) 1.80 0.00 3.20
assign ( resid 26 and name hn ) ( resid 25 and name hb ) 2.30 0.00 3.70
assign ( resid 26 and name hn ) ( resid 25 and name hg2* ) 2.30 0.00 4.20
assign ( resid 27 and name hn ) ( resid 26 and name hd1* ) 2.30 0.00 4.20
assign ( resid 27 and name hn ) ( resid 26 and name hg ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 26 and name hb1 ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 26 and name hb2 ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 25 and name ha ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 25 and name hb ) 1.80 0.00 3.20
assign ( resid 28 and name hn ) ( resid 27 and name hb* ) 1.80 0.00 2.30
assign ( resid 28 and name hn ) ( resid 26 and name ha ) 2.30 0.00 3.70
assign ( resid 28 and name hn ) ( resid 29 and name hg2* ) 1.80 0.00 3.70
assign ( resid 28 and name hn ) ( resid 29 and name hd1* ) 2.30 0.00 4.20
assign ( resid 28 and name hn ) ( resid 29 and name hg12 ) 2.30 0.00 4.20
assign ( resid 28 and name hn ) ( resid 29 and name hb ) 1.80 0.00 3.20
assign ( resid 29 and name hn ) ( resid 32 and name hb1 ) 1.80 0.00 3.20
assign ( resid 29 and name hn ) ( resid 32 and name hb2 ) 1.80 0.00 3.20
assign ( resid 29 and name hn ) ( resid 26 and name ha ) 2.30 0.00 3.70
assign ( resid 30 and name hn ) ( resid 29 and name hb ) 1.80 0.00 1.80
assign ( resid 30 and name hn ) ( resid 29 and name hd1* ) 2.30 0.00 4.20
assign ( resid 30 and name hn ) ( resid 29 and name hg2* ) 1.80 0.00 2.30
assign ( resid 30 and name he* ) ( resid 29 and name ha ) 2.30 0.00 4.20
assign ( resid 30 and name he* ) ( resid 27 and name ha ) 2.30 0.00 4.20
assign ( resid 30 and name he* ) ( resid 26 and name hg ) 2.30 0.00 4.70
assign ( resid 30 and name he* ) ( resid 26 and name hd1* ) 2.30 0.00 4.70
assign ( resid 30 and name he* ) ( resid 26 and name hd2* ) 2.30 0.00 4.70
assign ( resid 30 and name hd* ) ( resid 29 and name hn ) 1.80 0.00 3.70
assign ( resid 30 and name hd* ) ( resid 29 and name ha ) 2.30 0.00 4.20
assign ( resid 30 and name hd* ) ( resid 29 and name hb ) 1.80 0.00 3.70
assign ( resid 30 and name hd* ) ( resid 29 and name hd1* ) 2.30 0.00 4.70
assign ( resid 30 and name hd* ) ( resid 27 and name ha ) 2.30 0.00 4.20
assign ( resid 30 and name hd* ) ( resid 27 and name hb* ) 1.80 0.00 4.20
assign ( resid 31 and name hn ) ( resid 30 and name hb1 ) 1.80 0.00 1.80
assign ( resid 31 and name hn ) ( resid 30 and name hb2 ) 1.80 0.00 1.80
assign ( resid 31 and name hn ) ( resid 30 and name hd* ) 1.80 0.00 3.70 
assign ( resid 32 and name hn ) ( resid 31 and name hb* ) 1.80 0.00 2.30
assign ( resid 32 and name hn ) ( resid 29 and name ha ) 2.30 0.00 3.70
assign ( resid 32 and name hd2) ( resid 33 and name ha ) 1.80 0.00 1.00
assign ( resid 32 and name hd2) ( resid 33 and name hb ) 1.80 0.00 3.20
assign ( resid 32 and name hd2) ( resid 33 and name hd1* ) 2.30 0.00 4.20
assign ( resid 32 and name hd2) ( resid 33 and name hg2* ) 1.80 0.00 3.70
assign ( resid 32 and name hd2) ( resid 33 and name hn ) 1.80 0.00 3.20
assign ( resid 32 and name hd2) ( resid 36 and name hd2 ) 2.30 0.00 3.70
assign ( resid 33 and name hn) ( resid 32 and name hb1 ) 1.80 0.00 1.80
assign ( resid 33 and name hn) ( resid 32 and name hb2 ) 1.80 0.00 1.80
assign ( resid 33 and name hn) ( resid 29 and name ha ) 2.30 0.00 3.70
assign ( resid 34 and name hn) ( resid 33 and name hd1* ) 1.80 0.00 3.70
assign ( resid 34 and name hn) ( resid 33 and name hg2* ) 1.80 0.00 3.70
assign ( resid 34 and name hn) ( resid 33 and name hg1* ) 2.30 0.00 4.20
assign ( resid 34 and name hn) ( resid 33 and name hb ) 1.80 0.00 1.80
assign ( resid 35 and name hn) ( resid 34 and name hb ) 1.80 0.00 3.20
assign ( resid 35 and name hn) ( resid 34 and name hg2* ) 1.80 0.00 3.70
assign ( resid 35 and name hn) ( resid 33 and name ha ) 1.80 0.00 3.20
assign ( resid 36 and name hn) ( resid 35 and name hb1 ) 1.80 0.00 1.80
assign ( resid 36 and name hn) ( resid 35 and name hb2 ) 1.80 0.00 3.20
assign ( resid 36 and name hn) ( resid 35 and name hg* ) 2.30 0.00 4.20
assign ( resid 36 and name hn) ( resid 35 and name hd* ) 2.30 0.00 4.20
assign ( resid 36 and name hn) ( resid 33 and name ha ) 2.30 0.00 3.70
assign ( resid 36 and name hd2) ( resid 35 and name hn ) 2.30 0.00 3.70
assign ( resid 36 and name hd2) ( resid 35 and name hb2 ) 2.30 0.00 3.70
assign ( resid 36 and name hd2) ( resid 35 and name hb1 ) 1.80 0.00 3.20
assign ( resid 36 and name hd2) ( resid 35 and name hg* ) 2.30 0.00 4.20
assign ( resid 36 and name hd2) ( resid 35 and name hd* ) 2.30 0.00 4.20
assign ( resid 36 and name hd2) ( resid 32 and name hd2 ) 2.30 0.00 3.70
assign ( resid 36 and name hd2) ( resid 32 and name ha ) 1.80 0.00 3.70
assign ( resid 36 and name hd2 ) ( resid 32 and name he* ) 2.30 0.00 4.20
assign ( resid 37 and name hn) ( resid 36 and name hb* ) 1.80 0.00 3.70
assign ( resid 37 and name hn) ( resid 33 and name hd1* ) 2.30 0.00 4.20
assign ( resid 37 and name he*) ( resid 36 and name hb* ) 2.30 0.00 4.70
assign ( resid 37 and name he*) ( resid 33 and name ha ) 2.30 0.00 4.20
assign ( resid 37 and name hd*) ( resid 40 and name he* ) 2.30 0.00 4.70
assign ( resid 37 and name hd*) ( resid 40 and name hd* ) 1.80 0.00 4.20
assign ( resid 37 and name hd*) ( resid 33 and name ha ) 1.80 0.00 3.70
assign ( resid 37 and name hd*) ( resid 33 and name hd1* ) 1.80 0.00 4.20
assign ( resid 38 and name hd2 ) ( resid 37 and name ha ) 1.80 0.00 3.20
assign ( resid 39 and name he*) ( resid 40 and name he* ) 2.30 0.00 4.70
assign ( resid 39 and name he*) ( resid 43 and name hb* ) 2.30 0.00 4.70
assign ( resid 39 and name hd* ) ( resid 40 and name ha ) 2.30 0.00 4.20
assign ( resid 39 and name hd* ) ( resid 37 and name hb1 ) 2.30 0.00 4.20
!assign ( resid 39 and name hd* ) ( resid 43 and name hb* ) 2.30 0.00 4.70
assign ( resid 39 and name he* ) ( resid 40 and name hd* ) 2.30 0.00 4.70
assign ( resid 39 and name he* ) ( resid 40 and name ha ) 2.30 0.00 4.20
!assign ( resid 39 and name hn ) ( resid 38 and name hd2 ) 2.30 0.00 3.70
assign ( resid 40 and name hn) ( resid 39 and name hb1 ) 2.30 0.00 3.70
assign ( resid 40 and name hn) ( resid 39 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 40 and name hn) ( resid 39 and name he* ) 2.30 0.00 4.70
assign ( resid 40 and name hn) ( resid 39 and name hd* ) 2.30 0.00 4.20
assign ( resid 40 and name hn) ( resid 37 and name hb1 ) 2.30 0.00 3.70
assign ( resid 40 and name hd*) ( resid 39 and name hb1 ) 2.30 0.00 4.70
assign ( resid 40 and name hd*) ( resid 39 and name hd* ) 2.30 0.00 4.70
assign ( resid 40 and name hd*) ( resid 39 and name ha ) 2.30 0.00 4.20
assign ( resid 40 and name hd*) ( resid 37 and name hn ) 2.30 0.00 4.70
assign ( resid 40 and name hd*) ( resid 37 and name hb1 ) 1.80 0.00 3.70
assign ( resid 40 and name hd*) ( resid 37 and name hb2 ) 1.80 0.00 3.70
assign ( resid 40 and name hd*) ( resid 43 and name hb* ) 2.30 0.00 4.70
assign ( resid 40 and name he*) ( resid 39 and name hd* ) 2.30 0.00 4.70
assign ( resid 40 and name he*) ( resid 37 and name hb1 ) 2.30 0.00 4.20
!assign ( resid 40 and name he*) ( resid 43 and name hb* ) 2.30 0.00 4.70
assign ( resid 41 and name hn) ( resid 40 and name hd* ) 2.30 0.00 4.20
assign ( resid 45 and name hn) ( resid 44 and name hb1 ) 2.30 0.00 3.70
assign ( resid 45 and name hn) ( resid 44 and name hb2 ) 2.30 0.00 3.70
assign ( resid 45 and name hn) ( resid 47 and name hd1 ) 2.30 0.00 3.70
assign ( resid 46 and name hn) ( resid 45 and name hb* ) 2.30 0.00 4.20
assign ( resid 47 and name hn) ( resid 44 and name hb2 ) 2.30 0.00 3.70
assign ( resid 47 and name he1) ( resid 45 and name ha ) 2.30 0.00 3.70 
assign ( resid 47 and name he1) ( resid 44 and name hb2 ) 2.30 0.00 3.70
assign ( resid 47 and name hd1) ( resid 48 and name ha ) 1.80 0.00 3.20
assign ( resid 47 and name hd1) ( resid 48 and name hb2 ) 2.30 0.00 4.70
assign ( resid 47 and name hd1) ( resid 48 and name hb1 ) 2.30 0.00 3.70
assign ( resid 47 and name hd1) ( resid 45 and name ha ) 2.30 0.00 3.70
assign ( resid 47 and name he3) ( resid 48 and name ha ) 1.80 0.00 3.20
assign ( resid 47 and name he3) ( resid 51 and name hg12 ) 1.80 0.00 1.80
assign ( resid 47 and name he3) ( resid 51 and name hd1* ) 1.80 0.00 2.30
assign ( resid 47 and name he3) ( resid 51 and name hg2* ) 1.80 0.00 3.70
assign ( resid 47 and name he3) ( resid 51 and name hb ) 2.30 0.00 3.70
assign ( resid 48 and name he22) ( resid 51 and name hb ) 2.30 0.00 3.70
assign ( resid 48 and name he22) ( resid 47 and name hd1 ) 1.80 0.00 3.20
assign ( resid 49 and name hn ) ( resid 50 and name hb1 ) 2.30 0.00 3.70
assign ( resid 50 and name hn ) ( resid 49 and name hb1 ) 1.80 0.00 3.20
assign ( resid 50 and name hn ) ( resid 49 and name hb2 ) 1.80 0.00 3.20
assign ( resid 51 and name hn ) ( resid 50 and name hb1 ) 1.80 0.00 3.20
assign ( resid 51 and name hn ) ( resid 50 and name hb2 ) 1.80 0.00 3.20
assign ( resid 51 and name hn ) ( resid 49 and name ha ) 2.30 0.00 3.70
assign ( resid 51 and name hn ) ( resid 47 and name he3 ) 2.30 0.00 3.70
assign ( resid 52 and name hn ) ( resid 51 and name hb ) 1.80 0.00 1.80
assign ( resid 52 and name hn ) ( resid 51 and name hg2* ) 1.80 0.00 3.70
assign ( resid 52 and name hn ) ( resid 51 and name hd1* ) 2.30 0.00 4.20
assign ( resid 52 and name hn ) ( resid 51 and name hg11 ) 1.80 0.00 3.20
assign ( resid 52 and name hn ) ( resid 51 and name hg12 ) 2.30 0.00 3.70
assign ( resid 53 and name hn ) ( resid 52 and name hb* ) 1.80 0.00 2.30
assign ( resid 53 and name hn ) ( resid 50 and name ha ) 2.30 0.00 3.70
assign ( resid 54 and name hn ) ( resid 53 and name hb* ) 1.80 0.00 3.70
assign ( resid 54 and name hn ) ( resid 51 and name ha ) 2.30 0.00 3.70
assign ( resid 54 and name hd21 ) ( resid 53 and name hb* ) 1.80 0.00 3.70
assign ( resid 54 and name hd21 ) ( resid 51 and name ha ) 1.80 0.00 3.20
assign ( resid 54 and name hd22 ) ( resid 53 and name hb* ) 2.30 0.00 4.20
assign ( resid 55 and name hn ) ( resid 54 and name hb1 ) 1.80 0.00 3.20
assign ( resid 55 and name hn ) ( resid 54 and name hb2 ) 1.80 0.00 3.20
assign ( resid 55 and name hn ) ( resid 56 and name hb* ) 2.30 0.00 4.20
assign ( resid 55 and name hn ) ( resid 52 and name ha ) 2.30 0.00 3.70
assign ( resid 56 and name hn ) ( resid 55 and name hb1 ) 2.30 0.00 3.70
assign ( resid 56 and name hn ) ( resid 55 and name hb2 ) 2.30 0.00 3.70
assign ( resid 56 and name hn ) ( resid 55 and name hg* ) 2.30 0.00 4.20
assign ( resid 56 and name hn ) ( resid 57 and name hd* ) 1.80 0.00 3.70
assign ( resid 56 and name hn ) ( resid 57 and name hb2 ) 2.30 0.00 3.70
assign ( resid 57 and name hn ) ( resid 56 and name hb* ) 1.80 0.00 3.70
assign ( resid 58 and name hn ) ( resid 57 and name hb1 ) 1.80 0.00 3.20
assign ( resid 58 and name hn ) ( resid 57 and name hb2 ) 1.80 0.00 3.20
assign ( resid 58 and name hn ) ( resid 57 and name hg ) 1.80 0.00 3.20
assign ( resid 58 and name hn ) ( resid 57 and name hd* ) 2.30 0.00 4.20
assign ( resid 58 and name hd21 ) ( resid 57 and name hd* ) 2.30 0.00 4.20
assign ( resid 58 and name hd21 ) ( resid 57 and name hb1 ) 2.30 0.00 3.70
assign ( resid 58 and name hd21 ) ( resid 54 and name ha ) 2.30 0.00 4.20
assign ( resid 58 and name hd22 ) ( resid 57 and name hd* ) 2.30 0.00 4.20
assign ( resid 58 and name hd22 ) ( resid 54 and name ha ) 1.80 0.00 3.20
assign ( resid 58 and name hd22 ) ( resid 54 and name hb2 ) 2.30 0.00 3.70
assign ( resid 58 and name hd22 ) ( resid 54 and name hb1 ) 1.80 0.00 3.20
assign ( resid 59 and name hn ) ( resid 58 and name hb1 ) 1.80 0.00 3.20
assign ( resid 59 and name hn ) ( resid 58 and name hb2 ) 1.80 0.00 3.20
assign ( resid 60 and name hn ) ( resid 59 and name hb1 ) 2.30 0.00 3.70
assign ( resid 60 and name hn ) ( resid 59 and name hb2 ) 2.30 0.00 3.70
assign ( resid 60 and name hn ) ( resid 59 and name hg* ) 1.80 0.00 2.30
assign ( resid 60 and name he* ) ( resid 61 and name hz ) 1.80 0.00 3.70
assign ( resid 60 and name he* ) ( resid 58 and name hb1 ) 2.30 0.00 4.20
assign ( resid 60 and name hd* ) ( resid 61 and name he* ) 1.80 0.00 2.80
assign ( resid 60 and name hd* ) ( resid 61 and name hz ) 1.80 0.00 3.70
assign ( resid 61 and name hn ) ( resid 60 and name hb1 ) 2.30 0.00 3.70
assign ( resid 61 and name hn ) ( resid 60 and name hb2 ) 2.30 0.00 3.70
assign ( resid 61 and name hn ) ( resid 60 and name hd* ) 2.30 0.00 4.20
assign ( resid 61 and name hn ) ( resid 59 and name ha ) 2.30 0.00 3.70
assign ( resid 61 and name he* ) ( resid 60 and name he* ) 1.80 0.00 4.20
assign ( resid 61 and name he* ) ( resid 58 and name hb1 ) 2.30 0.00 4.20
assign ( resid 61 and name he* ) ( resid 58 and name hb2 ) 1.80 0.00 3.70
assign ( resid 61 and name hd* ) ( resid 60 and name hd* ) 2.30 0.00 4.70
assign ( resid 61 and name hd* ) ( resid 60 and name he* ) 2.30 0.00 4.70
assign ( resid 61 and name hd* ) ( resid 58 and name hb2 ) 1.80 0.00 2.30
assign ( resid 61 and name hd* ) ( resid 58 and name hb1 ) 2.30 0.00 4.20
assign ( resid 62 and name hn ) ( resid 61 and name hb1 ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 61 and name hb2 ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 61 and name hd* ) 1.80 0.00 3.70
assign ( resid 62 and name hn ) ( resid 61 and name he* ) 2.30 0.00 4.20
assign ( resid 63 and name hn ) ( resid 62 and name hg2* ) 1.80 0.00 3.70
assign ( resid 63 and name hn ) ( resid 62 and name hb ) 2.30 0.00 3.70
assign ( resid 64 and name hn ) ( resid 63 and name hg1 ) 2.30 0.00 3.70
assign ( resid 64 and name hn ) ( resid 63 and name hg2 ) 2.30 0.00 3.70
assign ( resid 66 and name hn ) ( resid 65 and name hb1 ) 1.80 0.00 1.80
assign ( resid 66 and name hn ) ( resid 65 and name hb2 ) 1.80 0.00 3.20
assign ( resid 67 and name hn ) ( resid 66 and name hb2 ) 2.30 0.00 3.70
assign ( resid 68 and name hn ) ( resid 67 and name hb1) 2.30 0.00 3.70
assign ( resid 68 and name hn ) ( resid 67 and name hb2) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 68 and name hb1) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 68 and name hb2) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 68 and name hg*) 2.30 0.00 4.20
assign ( resid 70 and name hn ) ( resid 71 and name hd*) 1.80 0.00 3.70
assign ( resid 72 and name hn ) ( resid 71 and name hb1) 1.80 0.00 3.20
assign ( resid 72 and name hn ) ( resid 71 and name hb2 ) 2.30 0.00 3.70
assign ( resid 72 and name hn ) ( resid 71 and name hd*) 2.30 0.00 4.20
assign ( resid 74 and name hn ) ( resid 73 and name hb*) 1.80 0.00 3.70
assign ( resid 76 and name hn ) ( resid 75 and name hb1) 2.30 0.00 3.70
assign ( resid 76 and name hn ) ( resid 75 and name hb2) 2.30 0.00 3.70
assign ( resid 77 and name hn ) ( resid 76 and name hb*) 1.80 0.00 3.70
assign ( resid 77 and name hn ) ( resid 76 and name hd*) 1.80 0.00 3.70
assign ( resid 78 and name hn ) ( resid 77 and name hb*) 2.30 0.00 4.20
assign ( resid 78 and name hn ) ( resid 77 and name hh2) 2.30 0.00 4.70
assign ( resid 78 and name nh ) ( resid 79 and name hn) 2.30 0.00 3.70
assign ( resid 79 and name hn ) ( resid 78 and name hb1) 1.80 0.00 1.80
assign ( resid 79 and name hn ) ( resid 78 and name hb2) 1.80 0.00 3.20
assign ( resid 79 and name hn ) ( resid 78 and name hd1) 2.30 0.00 3.70
assign ( resid 79 and name hn ) ( resid 78 and name hd2) 2.30 0.00 3.70
assign ( resid 80 and name hn ) ( resid 79 and name hb ) 2.30 0.00 3.70 
assign ( resid 80 and name hn ) ( resid 79 and name hg1* ) 1.80 0.00 2.30
assign ( resid 80 and name hn ) ( resid 79 and name hg2* ) 1.80 0.00 3.70
assign ( resid 80 and name hn ) ( resid 81 and name hd* ) 2.30 0.00 4.70
assign ( resid 82 and name hn ) ( resid 81 and name hb* ) 1.80 0.00 3.70
assign ( resid 82 and name hn ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 82 and name hn ) ( resid 81 and name hg* ) 1.80 0.00 3.70
assign ( resid 82 and name hn ) ( resid 84 and name hn ) 2.30 0.00 3.70
assign ( resid 83 and name hn ) ( resid 82 and name hb* ) 1.80 0.00 2.30
assign ( resid 83 and name hn ) ( resid 87 and name hd1* ) 2.30 0.00 4.20
assign ( resid 83 and name hn ) ( resid 79 and name hg1* ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 79 and name hg1* ) 2.30 0.00 3.70
assign ( resid 83 and name hn ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 84 and name hn ) ( resid 83 and name hb1 ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 83 and name hb2 ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 88 and name hg1* ) 2.30 0.00 4.20
assign ( resid 84 and name hn ) ( resid 86 and name hn ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 81 and name ha) 1.80 0.00 3.35
assign ( resid 85 and name hn ) ( resid 84 and name hb1 ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 84 and name hb2 ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 88 and name hg1* ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 88 and name hg2* ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 83 and name ha ) 2.30 0.00 3.70 
assign ( resid 85 and name hn ) ( resid 82 and name ha ) 1.80 0.00 2.70
assign ( resid 86 and name hn ) ( resid 84 and name ha ) 2.30 0.00 3.70
assign ( resid 86 and name hn ) ( resid 88 and name hn ) 2.30 0.00 3.70
assign ( resid 87 and name hn ) ( resid 86 and name hb1 ) 1.80 0.00 3.20
assign ( resid 87 and name hn ) ( resid 86 and name hb2 ) 1.80 0.00 3.20
assign ( resid 87 and name hn ) ( resid 85 and name hn ) 2.30 0.00 3.70
assign ( resid 87 and name hn ) ( resid 84 and name ha ) 1.80 0.00 1.60
assign ( resid 88 and name hn ) ( resid 87 and name hd1* ) 2.30 0.00 4.20
assign ( resid 88 and name hn ) ( resid 87 and name hd2* ) 2.30 0.00 4.20
assign ( resid 88 and name hn ) ( resid 87 and name hb1 ) 1.80 0.00 3.20
assign ( resid 88 and name hn ) ( resid 87 and name hg ) 1.80 0.00 3.20
assign ( resid 88 and name hn ) ( resid 84 and name ha ) 1.80 0.00 3.70
assign ( resid 88 and name hn ) ( resid 90 and name hn ) 2.30 0.00 3.70
assign ( resid 88 and name hn ) ( resid 85 and name ha ) 1.80 0.00 3.20
assign ( resid 88 and name hn ) ( resid 86 and name ha ) 2.30 0.00 3.70
assign ( resid 89 and name hn ) ( resid 88 and name hg1* ) 1.80 0.00 3.70
assign ( resid 89 and name hn ) ( resid 88 and name hg2* ) 1.80 0.00 3.70
assign ( resid 89 and name hn ) ( resid 88 and name hb ) 1.80 0.00 1.80
assign ( resid 89 and name hn ) ( resid 87 and name ha ) 1.80 0.00 3.20
assign ( resid 89 and name hn ) ( resid 86 and name ha ) 1.80 0.00 2.70
assign ( resid 89 and name hn ) ( resid 85 and name ha ) 1.80 0.00 3.70
assign ( resid 90 and name hn ) ( resid 88 and name ha ) 1.80 0.00 3.20
assign ( resid 90 and name hn ) ( resid 87 and name ha ) 1.80 0.00 2.70
assign ( resid 90 and name hn ) ( resid 86 and name ha ) 1.80 0.00 3.70
assign ( resid 91 and name hn ) ( resid 90 and name hb1 ) 1.80 0.00 3.20
assign ( resid 91 and name hn ) ( resid 90 and name hb2 ) 1.80 0.00 3.20
assign ( resid 91 and name hn ) ( resid 88 and name ha ) 1.80 0.00 2.70
assign ( resid 91 and name hn ) ( resid 87 and name ha ) 1.80 0.00 3.20
assign ( resid 91 and name hn ) ( resid 88 and name hg1* ) 2.30 0.00 4.20
assign ( resid 91 and name hn ) ( resid 88 and name hg2*) 2.30 0.00 4.20
assign ( resid 92 and name hn ) ( resid 91 and name hb* ) 1.80 0.00 2.30
assign ( resid 92 and name hd* ) ( resid 91 and name hb* ) 2.30 0.00 4.20
assign ( resid 92 and name hd* ) ( resid 88 and name hb ) 2.30 0.00 4.20
assign ( resid 92 and name hd* ) ( resid 88 and name hg1* ) 2.30 0.00 4.70
assign ( resid 92 and name he* ) ( resid 88 and name hg1*) 1.80 0.00 4.20
assign ( resid 92 and name he* ) ( resid 91 and name hb* ) 1.80 0.00 4.20
assign ( resid 92 and name he* ) ( resid 89 and name ha ) 2.30 0.00 4.20
assign ( resid 92 and name he* ) ( resid 88 and name hb) 2.30 0.00 4.20
assign ( resid 93 and name hn ) ( resid 92 and name hb1 ) 2.30 0.00 3.70
assign ( resid 93 and name hn ) ( resid 92 and name hd* ) 2.30 0.00 4.20
assign ( resid 93 and name hn ) ( resid 91 and name hb* ) 2.30 0.00 4.20
assign ( resid 93 and name hn ) ( resid 91 and name ha ) 2.30 0.00 3.70
assign ( resid 94 and name hn ) ( resid 93 and name hb* ) 2.30 0.00 4.20
assign ( resid 94 and name hn ) ( resid 93 and name hd1 ) 2.30 0.00 3.70
assign ( resid 95 and name hn ) ( resid 94 and name hb* ) 2.30 0.00 4.20
assign ( resid 95 and name hn ) ( resid 94 and name hg* ) 2.30 0.00 4.20
assign ( resid 96 and name hn ) ( resid 95 and name hb2 ) 2.30 0.00 3.70
assign ( resid 96 and name hn ) ( resid 95 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 97 and name hn ) ( resid 96 and name hb* ) 2.30 0.00 4.20
!assign ( resid 98 and name hn ) ( resid 97 and name hb1 ) 2.30 0.00 3.70
assign ( resid 99 and name hn ) ( resid 98 and name hb2 ) 2.30 0.00 3.70
assign ( resid 101 and name hn ) ( resid 100 and name hb ) 2.30 0.00 3.70
assign ( resid 2 and name ha ) ( resid 1 and name hb1 ) 2.30 0.00 3.70
assign ( resid 3 and name ha ) ( resid 4 and name hd1 ) 1.80 0.00 1.80
assign ( resid 3 and name ha ) ( resid 4 and name hd2 ) 1.80 0.00 1.80
assign ( resid 4 and name hd2 ) ( resid 3 and name hg1 ) 2.30 0.00 3.70
assign ( resid 4 and name hd2 ) ( resid 3 and name hg2 ) 2.30 0.00 3.70
assign ( resid 6 and name ha ) ( resid 10 and name hb1 ) 2.30 0.00 3.70
assign ( resid 6 and name ha ) ( resid 10 and name hb2 ) 2.30 0.00 3.70
assign ( resid 8 and name ha ) ( resid 11 and name hd1* ) 2.30 0.00 4.20
assign ( resid 8 and name ha ) ( resid 11 and name hd2* ) 1.80 0.00 3.70
assign ( resid 8 and name ha ) ( resid 11 and name hg ) 2.30 0.00 3.70
assign ( resid 8 and name ha ) ( resid 11 and name hb2 ) 2.30 0.00 4.70
assign ( resid 9 and name ha ) ( resid 12 and name hg2* ) 2.30 0.00 4.20
assign ( resid 9 and name ha ) ( resid 12 and name hg11 ) 1.80 0.00 1.80
assign ( resid 9 and name ha ) ( resid 12 and name hb ) 1.80 0.00 3.20
assign ( resid 9 and name hb* ) ( resid 12 and name hg11 ) 1.80 0.00 3.70
assign ( resid 9 and name hb* ) ( resid 12 and name hg12 ) 2.30 0.00 4.20
assign ( resid 10 and name ha ) ( resid 13 and name hg1* ) 2.30 0.00 4.20
assign ( resid 11 and name ha ) ( resid 14 and name hb1 ) 2.30 0.00 3.70
assign ( resid 11 and name ha ) ( resid 14 and name hb2 ) 1.80 0.00 3.20
assign ( resid 11 and name hd2* ) ( resid 12 and name hg2* ) 2.30 0.00 4.70
assign ( resid 12 and name ha ) ( resid 11 and name hd1* ) 2.30 0.00 4.20
assign ( resid 12 and name ha ) ( resid 11 and name hd2* ) 2.30 0.00 4.20
assign ( resid 12 and name ha ) ( resid 16 and name hg2* ) 2.30 0.00 4.20
assign ( resid 12 and name ha ) ( resid 15 and name hb* ) 1.80 0.00 2.30
assign ( resid 13 and name ha ) ( resid 12 and name hg2* ) 2.30 0.00 4.20
assign ( resid 13 and name ha ) ( resid 16 and name hb ) 2.30 0.00 3.70
assign ( resid 13 and name hg2* ) ( resid 12 and name hg2* ) 1.80 0.00 4.20
assign ( resid 15 and name ha ) ( resid 14 and name ha ) 2.30 0.00 3.70
assign ( resid 15 and name ha ) ( resid 18 and name hb1 ) 2.30 0.00 3.70
assign ( resid 15 and name ha ) ( resid 18 and name hb2 ) 2.30 0.00 3.70
assign ( resid 15 and name hb* ) ( resid 12 and name hg11 ) 2.30 0.00 4.20
assign ( resid 15 and name hb* ) ( resid 11 and name hd2* ) 2.30 0.00 4.70
assign ( resid 16 and name ha ) ( resid 15 and name hb* ) 2.30 0.00 4.20
assign ( resid 16 and name ha ) ( resid 19 and name hb* ) 1.80 0.00 2.30
assign ( resid 16 and name hg11 ) ( resid 12 and name hg2* ) 1.80 0.00 2.30
assign ( resid 16 and name hg2* ) ( resid 12 and name hg2* ) 2.30 0.00 4.70
assign ( resid 17 and name ha ) ( resid 16 and name hg2* ) 2.30 0.00 4.20
assign ( resid 21 and name hb* ) ( resid 23 and name hg2 ) 2.30 0.00 4.20
assign ( resid 21 and name hb* ) ( resid 23 and name hg1 ) 2.30 0.00 4.20
assign ( resid 21 and name hb* ) ( resid 20 and name hg2 ) 2.30 0.00 4.20
assign ( resid 23 and name ha ) ( resid 24 and name hb1 ) 2.30 0.00 3.70
assign ( resid 23 and name ha ) ( resid 24 and name hg ) 2.30 0.00 3.70
assign ( resid 23 and name ha ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 24 and name ha ) ( resid 23 and name hb2 ) 2.30 0.00 3.70
assign ( resid 26 and name ha ) ( resid 29 and name hb ) 2.30 0.00 3.70
assign ( resid 28 and name ha* ) ( resid 31 and name hb* ) 2.30 0.00 4.70
assign ( resid 29 and name ha ) ( resid 32 and name hb1 ) 1.80 0.00 2.30
assign ( resid 29 and name ha ) ( resid 32 and name hb2 ) 1.80 0.00 2.30
assign ( resid 30 and name ha ) ( resid 33 and name hb ) 2.30 0.00 3.70 
assign ( resid 30 and name ha ) ( resid 33 and name hg2* ) 2.30 0.00 4.20
assign ( resid 31 and name ha ) ( resid 34 and name hb ) 1.80 0.00 3.20 
assign ( resid 32 and name ha ) ( resid 31 and name hb* ) 1.80 0.00 3.70
assign ( resid 32 and name ha ) ( resid 35 and name hb1 ) 1.80 0.00 3.20 
assign ( resid 33 and name ha ) ( resid 32 and name hd2 ) 1.80 0.00 3.20
assign ( resid 34 and name ha ) ( resid 33 and name hd1* ) 2.30 0.00 4.20
assign ( resid 37 and name ha ) ( resid 38 and name hd1 ) 1.80 0.00 1.80
assign ( resid 37 and name ha ) ( resid 38 and name hd2 ) 1.80 0.00 1.80
assign ( resid 37 and name hb1 ) ( resid 33 and name hd1* ) 2.30 0.00 4.20
assign ( resid 37 and name hb2 ) ( resid 33 and name hd1* ) 1.80 0.00 3.70
assign ( resid 38 and name hd1 ) ( resid 36 and name hb* ) 2.30 0.00 4.20
assign ( resid 39 and name ha ) ( resid 38 and name hd2 ) 2.30 0.00 3.70
!assign ( resid 40 and name ha ) ( resid 43 and name hb* ) 2.30 0.00 4.70
assign ( resid 41 and name ha ) ( resid 42 and name hg2* ) 2.30 0.00 4.20
assign ( resid 47 and name ha ) ( resid 50 and name hb2 ) 1.80 0.00 1.80
assign ( resid 47 and name ha ) ( resid 50 and name hb1 ) 1.80 0.00 3.20
assign ( resid 48 and name ha ) ( resid 51 and name hb ) 2.30 0.00 3.70
assign ( resid 48 and name ha ) ( resid 51 and name hg2* ) 2.30 0.00 4.20
assign ( resid 49 and name ha ) ( resid 53 and name hb* ) 1.80 0.00 3.70
assign ( resid 49 and name ha ) ( resid 52 and name hb* ) 1.80 0.00 3.70
assign ( resid 50 and name ha ) ( resid 53 and name hb* ) 1.80 0.00 2.30
assign ( resid 51 and name ha ) ( resid 54 and name hb1 ) 2.30 0.00 3.70
assign ( resid 51 and name ha ) ( resid 54 and name hb2 ) 1.80 0.00 3.20
assign ( resid 51 and name hg2* ) ( resid 55 and name hd* ) 1.80 0.00 4.20
assign ( resid 51 and name hg2* ) ( resid 55 and name hg ) 1.80 0.00 3.70
assign ( resid 51 and name hg12 ) ( resid 55 and name hd* ) 2.30 0.00 4.20
assign ( resid 51 and name hd1* ) ( resid 55 and name hg ) 2.30 0.00 4.20
assign ( resid 52 and name ha ) ( resid 51 and name hg2* ) 2.30 0.00 4.20
assign ( resid 52 and name ha ) ( resid 55 and name hd* ) 2.30 0.00 4.20
assign ( resid 52 and name ha ) ( resid 55 and name hb1 ) 2.30 0.00 3.70
assign ( resid 52 and name ha ) ( resid 55 and name hg ) 1.80 0.00 3.20
assign ( resid 53 and name ha ) ( resid 56 and name hb* ) 2.30 0.00 4.20
assign ( resid 54 and name hb2 ) ( resid 51 and name hg11 ) 2.30 0.00 3.70
assign ( resid 54 and name hb1 ) ( resid 51 and name hg11 ) 2.30 0.00 4.70
assign ( resid 54 and name ha ) ( resid 57 and name hb1 ) 2.30 0.00 3.70
assign ( resid 54 and name ha ) ( resid 57 and name hb2 ) 2.30 0.00 3.70
assign ( resid 60 and name ha ) ( resid 62 and name hg2* ) 2.30 0.00 4.20
assign ( resid 61 and name ha ) ( resid 62 and name hg11 ) 2.30 0.00 3.70
assign ( resid 61 and name ha ) ( resid 62 and name hg2* ) 2.30 0.00 4.20
assign ( resid 63 and name ha ) ( resid 64 and name hg2* ) 2.30 0.00 4.20
assign ( resid 64 and name ha ) ( resid 65 and name hd1 ) 1.80 0.00 1.80
assign ( resid 64 and name ha ) ( resid 65 and name hd2 ) 1.80 0.00 1.80
assign ( resid 65 and name hd1 ) ( resid 64 and name hg1* ) 1.80 0.00 3.70
assign ( resid 65 and name hd1 ) ( resid 64 and name hg2* ) 1.80 0.00 3.70
assign ( resid 65 and name hd2 ) ( resid 64 and name hg1* ) 2.30 0.00 4.20
assign ( resid 65 and name hd2 ) ( resid 64 and name hg2* ) 1.80 0.00 3.70
assign ( resid 70 and name ha ) ( resid 71 and name hd* ) 1.80 0.00 3.20
assign ( resid 80 and name ha ) ( resid 81 and name hg* ) 2.30 0.00 4.20
assign ( resid 80 and name ha ) ( resid 81 and name hb* ) 2.30 0.00 4.20
assign ( resid 80 and name ha ) ( resid 81 and name hd2 ) 1.80 0.00 1.80
assign ( resid 81 and name hd2 ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 81 and name hd1 ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 83 and name ha ) ( resid 82 and name hb* ) 2.30 0.00 4.20
assign ( resid 83 and name ha ) ( resid 87 and name hd2* ) 1.80 0.00 2.70
assign ( resid 83 and name hb2 ) ( resid 87 and name hd2* ) 1.80 0.00 3.70
assign ( resid 83 and name hb2 ) ( resid 87 and name hd1* ) 2.30 0.00 4.20
assign ( resid 83 and name hb2 ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 83 and name hb1 ) ( resid 80 and name hb* ) 2.30 0.00 3.70
assign ( resid 83 and name hb1 ) ( resid 87 and name hg ) 2.30 0.00 3.70
assign ( resid 83 and name hb1 ) ( resid 87 and name hd2* ) 1.80 0.00 3.70
assign ( resid 83 and name hb1 ) ( resid 87 and name hd1* ) 2.30 0.00 4.20
assign ( resid 84 and name ha ) ( resid 87 and name hb1 ) 2.30 0.00 3.70
assign ( resid 84 and name ha ) ( resid 87 and name hd1* ) 2.30 0.00 3.70
assign ( resid 84 and name ha ) ( resid 87 and name hd2* ) 2.30 0.00 4.20
assign ( resid 84 and name ha ) ( resid 88 and name hg1* ) 2.30 0.00 4.20
assign ( resid 84 and name ha ) ( resid 88 and name hg2* ) 2.30 0.00 4.20
assign ( resid 85 and name ha ) ( resid 88 and name hb ) 1.80 0.00 2.70
assign ( resid 85 and name ha ) ( resid 88 and name hg2* ) 1.80 0.00 3.70
assign ( resid 85 and name ha ) ( resid 88 and name hg1* ) 1.80 0.00 3.70
assign ( resid 85 and name hb* ) ( resid 84 and name hb1 ) 2.30 0.00 4.20
assign ( resid 87 and name ha ) ( resid 88 and name hg2* ) 1.80 0.00 3.70
assign ( resid 87 and name hb2 ) ( resid 88 and name hg1* ) 2.30 0.00 4.20
assign ( resid 87 and name hb2 ) ( resid 88 and name hg2* ) 2.30 0.00 4.20
assign ( resid 87 and name hb2 ) ( resid 86 and name he* ) 2.30 0.00 4.20
assign ( resid 88 and name hb ) ( resid 87 and name hb1 ) 2.30 0.00 4.70
assign ( resid 88 and name hg2* ) ( resid 87 and name hd2* ) 2.30 0.00 4.70
assign ( resid 88 and name hg2* ) ( resid 87 and name hd1* ) 1.80 0.00 4.20
assign ( resid 88 and name hg1* ) ( resid 87 and name hd1* ) 1.80 0.00 3.70
assign ( resid 88 and name hg1* ) ( resid 87 and name hd2* ) 2.30 0.00 4.70
assign ( resid 88 and name ha ) ( resid 91 and name hb* ) 1.80 0.00 3.20
assign ( resid 89 and name ha ) ( resid 88 and name hg1* ) 2.30 0.00 4.20
assign ( resid 90 and name ha ) ( resid 93 and name hd2 ) 2.30 0.00 4.70
assign ( resid 91 and name ha ) ( resid 88 and name hb ) 2.30 0.00 3.70
assign ( resid 91 and name ha ) ( resid 88 and name ha ) 1.80 0.00 3.70
assign ( resid 91 and name hb* ) ( resid 88 and name hg2* ) 1.80 0.00 4.20
assign ( resid 91 and name hb* ) ( resid 88 and name hg1* ) 2.30 0.00 4.70
assign ( resid 92 and name ha ) ( resid 91 and name hb* ) 2.30 0.00 4.20
!assign ( resid 99 and name ha* ) ( resid 97 and name hb1 ) 2.30 0.00 4.20
 
!intra-residue NOEs
 
assign ( resid 2 and name hn ) ( resid 2 and name ha ) 2.30 0.00 3.70
assign ( resid 2 and name hn ) ( resid 2 and name hb* ) 2.30 0.00 4.20
assign ( resid 3 and name hn ) ( resid 3 and name ha ) 1.80 0.00 3.20
assign ( resid 3 and name hn ) ( resid 3 and name hb1 ) 1.80 0.00 3.20
assign ( resid 3 and name hn ) ( resid 3 and name hb2 ) 1.80 0.00 1.80
assign ( resid 6 and name hn ) ( resid 6 and name ha ) 2.30 0.00 3.70
assign ( resid 6 and name hn ) ( resid 6 and name hb1 ) 1.80 0.00 3.20
assign ( resid 6 and name hn ) ( resid 6 and name hb2 ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 7 and name ha ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 7 and name hb1 ) 2.30 0.00 3.70
assign ( resid 7 and name hn ) ( resid 7 and name hb2 ) 2.30 0.00 3.70
assign ( resid 8 and name hn ) ( resid 8 and name hb1 ) 2.30 0.00 3.70
assign ( resid 8 and name hn ) ( resid 8 and name hb2 ) 2.30 0.00 3.70
assign ( resid 8 and name hn ) ( resid 8 and name ha ) 1.80 0.00 3.20
assign ( resid 9 and name hn ) ( resid 9 and name hb* ) 1.80 0.00 2.30
assign ( resid 9 and name hn ) ( resid 9 and name ha ) 1.80 0.00 3.20
assign ( resid 10 and name hn ) ( resid 10 and name ha ) 2.30 0.00 3.70
assign ( resid 10 and name hn ) ( resid 10 and name hb1 ) 2.30 0.00 3.70
assign ( resid 10 and name hn ) ( resid 10 and name hb2 ) 1.80 0.00 3.20
assign ( resid 11 and name hn ) ( resid 11 and name ha ) 1.80 0.00 3.20
assign ( resid 11 and name hn ) ( resid 11 and name hb1 ) 2.30 0.00 3.70
assign ( resid 11 and name hn ) ( resid 11 and name hb2 ) 2.30 0.00 3.70 
assign ( resid 12 and name hn ) ( resid 12 and name ha ) 1.80 0.00 3.20
assign ( resid 12 and name hn ) ( resid 12 and name hb ) 1.80 0.00 3.20
assign ( resid 13 and name hn ) ( resid 13 and name ha ) 1.80 0.00 3.20
assign ( resid 13 and name hn ) ( resid 13 and name hb ) 1.80 0.00 3.20
assign ( resid 14 and name hn ) ( resid 14 and name hb1 ) 1.80 0.00 3.20
assign ( resid 14 and name hn ) ( resid 14 and name hb2 ) 1.80 0.00 1.80
assign ( resid 14 and name hn ) ( resid 14 and name ha ) 1.80 0.00 3.20
assign ( resid 15 and name hn ) ( resid 15 and name ha ) 1.80 0.00 3.20
assign ( resid 15 and name hn ) ( resid 15 and name hb* ) 1.80 0.00 2.30
assign ( resid 16 and name hn ) ( resid 16 and name hb ) 1.80 0.00 3.20
assign ( resid 16 and name hn ) ( resid 16 and name ha ) 1.80 0.00 3.20 
assign ( resid 17 and name hn ) ( resid 17 and name ha ) 1.80 0.00 3.20
assign ( resid 17 and name hn ) ( resid 17 and name hb1 ) 1.80 0.00 3.20
assign ( resid 17 and name hn ) ( resid 17 and name hb2 ) 2.30 0.00 3.70
assign ( resid 18 and name hn ) ( resid 18 and name ha ) 1.80 0.00 3.20
assign ( resid 18 and name hn ) ( resid 18 and name hb1 ) 1.80 0.00 3.20
assign ( resid 18 and name hn ) ( resid 18 and name hb2 ) 2.30 0.00 3.70
assign ( resid 19 and name hn ) ( resid 19 and name ha ) 1.80 0.00 1.80
assign ( resid 19 and name hn ) ( resid 19 and name hb* ) 1.80 0.00 2.30
!assign ( resid 20 and name hn ) ( resid 20 and name ha ) 2.30 0.00 3.70
!assign ( resid 20 and name hn ) ( resid 20 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 20 and name hn ) ( resid 20 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 21 and name hn ) ( resid 21 and name hb* ) 2.30 0.00 4.20
!assign ( resid 21 and name hn ) ( resid 21 and name ha ) 2.30 0.00 3.70
assign ( resid 22 and name hn ) ( resid 22 and name ha ) 1.80 0.00 3.20
assign ( resid 22 and name hn ) ( resid 22 and name hb* ) 1.80 0.00 2.30
assign ( resid 23 and name hn ) ( resid 23 and name ha ) 2.30 0.00 3.70
assign ( resid 23 and name hn ) ( resid 23 and name hb1 ) 1.80 0.00 1.80
assign ( resid 23 and name hn ) ( resid 23 and name hb2 ) 2.30 0.00 3.70
assign ( resid 24 and name hn ) ( resid 24 and name ha ) 2.30 0.00 3.70
assign ( resid 24 and name hn ) ( resid 24 and name hb1 ) 1.80 0.00 1.80
assign ( resid 24 and name hn ) ( resid 24 and name hb2 ) 1.80 0.00 3.20
assign ( resid 25 and name hn ) ( resid 25 and name hb ) 1.80 0.00 3.20
assign ( resid 25 and name hn ) ( resid 25 and name ha ) 2.30 0.00 3.70
assign ( resid 26 and name hn ) ( resid 26 and name hb1 ) 2.30 0.00 3.70
assign ( resid 26 and name hn ) ( resid 26 and name hb2 ) 2.30 0.00 3.70
assign ( resid 26 and name hn ) ( resid 26 and name ha ) 2.30 0.00 3.70
assign ( resid 27 and name hn ) ( resid 27 and name hb* ) 1.80 0.00 2.30
assign ( resid 27 and name hn ) ( resid 27 and name ha ) 1.80 0.00 3.20
assign ( resid 28 and name hn ) ( resid 28 and name ha* ) 1.80 0.00 3.70
assign ( resid 29 and name hn ) ( resid 29 and name hb ) 1.80 0.00 3.20
assign ( resid 29 and name hn ) ( resid 29 and name ha ) 1.80 0.00 3.20
assign ( resid 30 and name hn ) ( resid 30 and name ha ) 2.30 0.00 3.70
assign ( resid 30 and name hn ) ( resid 30 and name hb1 ) 2.30 0.00 3.70
assign ( resid 30 and name hn ) ( resid 30 and name hb2 ) 2.30 0.00 3.70
assign ( resid 31 and name hn ) ( resid 31 and name ha ) 1.80 0.00 3.20
assign ( resid 31 and name hn ) ( resid 31 and name hb* ) 1.80 0.00 3.70
assign ( resid 32 and name hn ) ( resid 32 and name ha ) 1.80 0.00 1.80
assign ( resid 32 and name hn ) ( resid 32 and name hb1 ) 1.80 0.00 3.20
assign ( resid 32 and name hn ) ( resid 32 and name hb2 ) 1.80 0.00 3.20
assign ( resid 33 and name hn ) ( resid 33 and name hb ) 1.80 0.00 3.20
assign ( resid 33 and name hn ) ( resid 33 and name ha ) 2.30 0.00 3.70
assign ( resid 34 and name hn ) ( resid 34 and name ha ) 1.80 0.00 3.20
assign ( resid 34 and name hn ) ( resid 34 and name hb ) 1.80 0.00 3.20
assign ( resid 35 and name hn ) ( resid 35 and name ha ) 1.80 0.00 3.20
assign ( resid 35 and name hn ) ( resid 35 and name hb1 ) 1.80 0.00 3.20
assign ( resid 35 and name hn ) ( resid 35 and name hb2 ) 1.80 0.00 3.20
assign ( resid 36 and name hn ) ( resid 36 and name ha ) 1.80 0.00 3.20
assign ( resid 36 and name hn ) ( resid 36 and name hb* ) 1.80 0.00 2.30
assign ( resid 37 and name hn ) ( resid 37 and name ha ) 2.30 0.00 3.70
assign ( resid 37 and name hn ) ( resid 37 and name hb1 ) 2.30 0.00 3.70
assign ( resid 37 and name hn ) ( resid 37 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 39 and name hn ) ( resid 39 and name ha ) 2.30 0.00 3.70
!assign ( resid 39 and name hn ) ( resid 39 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 39 and name hn ) ( resid 39 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 40 and name hn ) ( resid 40 and name ha ) 1.80 0.00 3.20
!assign ( resid 40 and name hn ) ( resid 40 and name hb* ) 1.80 0.00 3.70
!assign ( resid 41 and name hn ) ( resid 41 and name ha ) 2.30 0.00 3.70
!assign ( resid 41 and name hn ) ( resid 41 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 41 and name hn ) ( resid 41 and name hb2 ) 2.30 0.00 3.70
assign ( resid 45 and name hn ) ( resid 45 and name hb* ) 2.30 0.00 4.20
assign ( resid 45 and name hn ) ( resid 45 and name ha ) 2.30 0.00 3.70
assign ( resid 46 and name hn ) ( resid 46 and name ha1 ) 1.80 0.00 3.20
assign ( resid 46 and name hn ) ( resid 46 and name ha2 ) 1.80 0.00 3.20
assign ( resid 47 and name hn ) ( resid 47 and name hb1 ) 2.30 0.00 3.70
assign ( resid 47 and name hn ) ( resid 47 and name hb2 ) 1.80 0.00 3.20
assign ( resid 47 and name hn ) ( resid 47 and name ha ) 1.80 0.00 3.20
assign ( resid 49 and name hn ) ( resid 49 and name ha ) 2.30 0.00 3.70
assign ( resid 49 and name hn ) ( resid 49 and name hb1 ) 2.30 0.00 3.70
assign ( resid 49 and name hn ) ( resid 49 and name hb2 ) 1.80 0.00 3.20
assign ( resid 50 and name hn ) ( resid 50 and name ha ) 2.30 0.00 3.70
assign ( resid 50 and name hn ) ( resid 50 and name hb1 ) 2.30 0.00 3.70
assign ( resid 50 and name hn ) ( resid 50 and name hb2 ) 1.80 0.00 3.20
assign ( resid 51 and name hn ) ( resid 51 and name ha ) 1.80 0.00 3.20
assign ( resid 51 and name hn ) ( resid 51 and name hb ) 1.80 0.00 3.20
assign ( resid 52 and name hn ) ( resid 52 and name ha ) 1.80 0.00 3.20
assign ( resid 52 and name hn ) ( resid 52 and name hb* ) 1.80 0.00 2.30
assign ( resid 53 and name hn ) ( resid 53 and name ha ) 1.80 0.00 3.20
assign ( resid 53 and name hn ) ( resid 53 and name hb* ) 1.80 0.00 2.30
assign ( resid 54 and name hn ) ( resid 54 and name ha ) 2.30 0.00 3.70
assign ( resid 54 and name hn ) ( resid 54 and name hb1 ) 1.80 0.00 3.20
assign ( resid 54 and name hn ) ( resid 54 and name hb2 ) 1.80 0.00 3.20
assign ( resid 55 and name hn ) ( resid 55 and name hb1 ) 2.30 0.00 3.70
assign ( resid 55 and name hn ) ( resid 55 and name hb2 ) 2.30 0.00 3.70
assign ( resid 55 and name hn ) ( resid 55 and name ha ) 2.30 0.00 3.70
assign ( resid 56 and name hn ) ( resid 56 and name ha ) 1.80 0.00 3.20
assign ( resid 56 and name hn ) ( resid 56 and name hb* ) 1.80 0.00 3.70
assign ( resid 57 and name hn ) ( resid 57 and name ha ) 2.30 0.00 3.70
assign ( resid 57 and name hn ) ( resid 57 and name hb1 ) 1.80 0.00 3.20
assign ( resid 57 and name hn ) ( resid 57 and name hb2 ) 1.80 0.00 1.80
assign ( resid 58 and name hn ) ( resid 58 and name ha ) 1.80 0.00 3.20
assign ( resid 58 and name hn ) ( resid 58 and name hb1 ) 2.30 0.00 3.70
assign ( resid 58 and name hn ) ( resid 58 and name hb2 ) 2.30 0.00 3.70
assign ( resid 59 and name hn ) ( resid 59 and name hb1 ) 1.80 0.00 3.20
assign ( resid 59 and name hn ) ( resid 59 and name hb2 ) 2.30 0.00 3.70
assign ( resid 59 and name hn ) ( resid 59 and name ha ) 1.80 0.00 1.80
assign ( resid 60 and name hn ) ( resid 60 and name ha ) 1.80 0.00 3.20
assign ( resid 60 and name hn ) ( resid 60 and name hb1 ) 2.30 0.00 3.70
assign ( resid 60 and name hn ) ( resid 60 and name hb2 ) 2.30 0.00 3.70
assign ( resid 61 and name hn ) ( resid 61 and name ha ) 2.30 0.00 3.70
assign ( resid 61 and name hn ) ( resid 61 and name hb1 ) 2.30 0.00 3.70
assign ( resid 61 and name hn ) ( resid 61 and name hb2 ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 62 and name hb ) 2.30 0.00 3.70
assign ( resid 62 and name hn ) ( resid 62 and name ha ) 2.30 0.00 3.70
assign ( resid 63 and name hn ) ( resid 63 and name ha ) 1.80 0.00 1.80
assign ( resid 63 and name hn ) ( resid 63 and name hb1 ) 1.80 0.00 3.20
assign ( resid 63 and name hn ) ( resid 63 and name hb2 ) 2.30 0.00 3.70
assign ( resid 64 and name hn ) ( resid 64 and name hb ) 1.80 0.00 3.20
assign ( resid 64 and name hn ) ( resid 64 and name ha ) 2.30 0.00 3.70
assign ( resid 66 and name hn ) ( resid 66 and name ha ) 1.80 0.00 3.20
assign ( resid 66 and name hn ) ( resid 66 and name hb1 ) 1.80 0.00 3.20
assign ( resid 66 and name hn ) ( resid 66 and name hb2 ) 1.80 0.00 3.20
assign ( resid 67 and name hn ) ( resid 67 and name hb1 ) 2.30 0.00 3.70
assign ( resid 67 and name hn ) ( resid 67 and name hb2 ) 2.30 0.00 3.70
assign ( resid 67 and name hn ) ( resid 67 and name ha ) 1.80 0.00 1.80
assign ( resid 68 and name hn ) ( resid 68 and name hb1 ) 2.30 0.00 3.70
assign ( resid 68 and name hn ) ( resid 68 and name hb2 ) 2.30 0.00 3.70
assign ( resid 68 and name hn ) ( resid 68 and name ha ) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 69 and name ha ) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 69 and name hb1 ) 2.30 0.00 3.70
assign ( resid 69 and name hn ) ( resid 69 and name hb2 ) 2.30 0.00 3.70
assign ( resid 70 and name hn ) ( resid 70 and name hb1 ) 1.80 0.00 3.20
assign ( resid 70 and name hn ) ( resid 70 and name hb2 ) 1.80 0.00 3.20
assign ( resid 70 and name hn ) ( resid 70 and name ha ) 1.80 0.00 3.20
assign ( resid 72 and name hn ) ( resid 72 and name ha1 ) 1.80 0.00 3.20
assign ( resid 72 and name hn ) ( resid 72 and name ha2 ) 1.80 0.00 3.20
assign ( resid 73 and name hn ) ( resid 73 and name ha ) 1.80 0.00 3.20
assign ( resid 73 and name hn ) ( resid 73 and name hb* ) 1.80 0.00 3.70
assign ( resid 74 and name hn ) ( resid 74 and name ha1 ) 2.30 0.00 3.70
assign ( resid 74 and name hn ) ( resid 74 and name ha2 ) 1.80 0.00 3.20
assign ( resid 75 and name hn ) ( resid 75 and name ha ) 1.80 0.00 3.20
assign ( resid 75 and name hn ) ( resid 75 and name hb1 ) 2.30 0.00 3.70
assign ( resid 75 and name hn ) ( resid 75 and name hb2 ) 2.30 0.00 3.70
assign ( resid 76 and name hn ) ( resid 76 and name hb* ) 2.30 0.00 4.20
assign ( resid 76 and name hn ) ( resid 76 and name ha ) 1.80 0.00 3.20
assign ( resid 77 and name hn ) ( resid 77 and name hb* ) 2.30 0.00 4.20
assign ( resid 77 and name hn ) ( resid 77 and name ha ) 2.30 0.00 3.70
assign ( resid 78 and name hn ) ( resid 78 and name ha ) 1.80 0.00 3.20
assign ( resid 78 and name hn ) ( resid 78 and name hb1 ) 1.80 0.00 3.20
assign ( resid 78 and name hn ) ( resid 78 and name hb2 ) 2.30 0.00 3.70
assign ( resid 79 and name hn ) ( resid 79 and name hb ) 1.80 0.00 3.20
assign ( resid 79 and name hn ) ( resid 79 and name ha ) 2.30 0.00 3.70
assign ( resid 80 and name hn ) ( resid 80 and name ha ) 2.30 0.00 3.70
assign ( resid 80 and name hn ) ( resid 80 and name hb* ) 1.80 0.00 3.70
assign ( resid 82 and name hn ) ( resid 82 and name ha ) 1.80 0.00 3.20
assign ( resid 82 and name hn ) ( resid 82 and name hb* ) 1.80 0.00 2.30
assign ( resid 83 and name hn ) ( resid 83 and name ha ) 1.80 0.00 3.20
assign ( resid 83 and name hn ) ( resid 83 and name hb1 ) 1.80 0.00 3.20
assign ( resid 83 and name hn ) ( resid 83 and name hb2 ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 84 and name ha ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 84 and name hb1 ) 2.30 0.00 3.70
assign ( resid 84 and name hn ) ( resid 84 and name hb2 ) 2.30 0.00 3.70
assign ( resid 85 and name hn ) ( resid 85 and name hb* ) 1.80 0.00 2.30
assign ( resid 85 and name hn ) ( resid 85 and name ha ) 1.80 0.00 1.80
assign ( resid 86 and name hn ) ( resid 86 and name ha ) 1.80 0.00 3.20
assign ( resid 86 and name hn ) ( resid 86 and name hb1 ) 1.80 0.00 3.20
assign ( resid 86 and name hn ) ( resid 86 and name hb2 ) 1.80 0.00 1.80
assign ( resid 87 and name hn ) ( resid 87 and name ha ) 1.80 0.00 3.20
assign ( resid 87 and name hn ) ( resid 87 and name hb1 ) 1.80 0.00 3.20
assign ( resid 87 and name hn ) ( resid 87 and name hb2 ) 1.80 0.00 3.20
assign ( resid 88 and name hn ) ( resid 88 and name ha ) 1.80 0.00 3.20
assign ( resid 88 and name hn ) ( resid 88 and name hb ) 1.80 0.00 3.20
assign ( resid 89 and name hn ) ( resid 89 and name ha ) 1.80 0.00 1.80
assign ( resid 89 and name hn ) ( resid 89 and name hb* ) 1.80 0.00 3.70
assign ( resid 90 and name hn ) ( resid 90 and name ha ) 1.80 0.00 3.20
assign ( resid 90 and name hn ) ( resid 90 and name hb1 ) 1.80 0.00 3.20
assign ( resid 90 and name hn ) ( resid 90 and name hb2 ) 1.80 0.00 3.20
assign ( resid 91 and name hn ) ( resid 91 and name ha ) 1.80 0.00 3.20
assign ( resid 91 and name hn ) ( resid 91 and name hb* ) 1.80 0.00 2.30
assign ( resid 92 and name hn ) ( resid 92 and name hb1 ) 2.30 0.00 3.70
assign ( resid 92 and name hn ) ( resid 92 and name hb2 ) 2.30 0.00 3.70
assign ( resid 92 and name hn ) ( resid 92 and name ha ) 1.80 0.00 3.20
assign ( resid 93 and name hn ) ( resid 93 and name ha ) 1.80 0.00 1.80
assign ( resid 93 and name hn ) ( resid 93 and name hb* ) 1.80 0.00 2.30
assign ( resid 94 and name hn ) ( resid 94 and name ha ) 1.80 0.00 3.20
assign ( resid 94 and name hn ) ( resid 94 and name hb* ) 1.80 0.00 2.30
assign ( resid 95 and name hn ) ( resid 95 and name ha ) 2.30 0.00 3.70
assign ( resid 95 and name hn ) ( resid 95 and name hb1 ) 1.80 0.00 3.20
assign ( resid 95 and name hn ) ( resid 95 and name hb2 ) 1.80 0.00 3.20
assign ( resid 96 and name hn ) ( resid 96 and name ha ) 1.80 0.00 1.80
assign ( resid 96 and name hn ) ( resid 96 and name hb* ) 2.30 0.00 4.20
assign ( resid 97 and name hn ) ( resid 97 and name ha ) 1.80 0.00 1.80
assign ( resid 97 and name hn ) ( resid 97 and name hb1 ) 2.30 0.00 3.70
assign ( resid 97 and name hn ) ( resid 97 and name hb2 ) 2.30 0.00 3.70
assign ( resid 98 and name hn ) ( resid 98 and name ha ) 1.80 0.00 1.80
assign ( resid 98 and name hn ) ( resid 98 and name hb1 ) 2.30 0.00 3.70
assign ( resid 98 and name hn ) ( resid 98 and name hb2 ) 2.30 0.00 3.70
assign ( resid 99 and name hn ) ( resid 99 and name ha* ) 1.80 0.00 3.70
assign ( resid 100 and name hn ) ( resid 100 and name ha ) 2.30 0.00 3.70
assign ( resid 100 and name hn ) ( resid 100 and name hb ) 2.30 0.00 3.70
assign ( resid 101 and name hn ) ( resid 101 and name ha ) 1.80 0.00 3.20
assign ( resid 101 and name hn ) ( resid 101 and name hb* ) 2.30 0.00 4.20
assign ( resid 1 and name ha ) ( resid 1 and name hb1 ) 1.80 0.00 1.80
assign ( resid 1 and name ha ) ( resid 1 and name hb2 ) 1.80 0.00 1.80
assign ( resid 2 and name ha ) ( resid 2 and name hb* ) 1.80 0.00 3.70
assign ( resid 3 and name ha ) ( resid 3 and name hb1 ) 1.80 0.00 3.20
assign ( resid 3 and name ha ) ( resid 3 and name hb2 ) 2.30 0.00 3.70
assign ( resid 5 and name ha ) ( resid 5 and name hb1 ) 1.80 0.00 1.80
assign ( resid 5 and name ha ) ( resid 5 and name hb2 ) 1.80 0.00 3.20
assign ( resid 6 and name ha ) ( resid 6 and name hb1 ) 2.30 0.00 3.70
assign ( resid 6 and name ha ) ( resid 6 and name hb2 ) 2.30 0.00 3.70
assign ( resid 7 and name ha ) ( resid 7 and name hb1 ) 1.80 0.00 3.20
assign ( resid 8 and name ha ) ( resid 8 and name hb1 ) 2.30 0.00 3.70
assign ( resid 8 and name ha ) ( resid 8 and name hb2 ) 2.30 0.00 3.70
assign ( resid 9 and name ha ) ( resid 9 and name hb* ) 1.80 0.00 2.30
assign ( resid 10 and name ha ) ( resid 10 and name hb2 ) 2.30 0.00 3.70
assign ( resid 11 and name ha ) ( resid 11 and name hb1 ) 2.30 0.00 3.70
assign ( resid 11 and name ha ) ( resid 11 and name hb2 ) 2.30 0.00 3.70
assign ( resid 12 and name ha ) ( resid 12 and name hb ) 1.80 0.00 3.20
assign ( resid 13 and name ha ) ( resid 13 and name hb ) 1.80 0.00 3.20
assign ( resid 14 and name ha ) ( resid 14 and name hb1 ) 1.80 0.00 3.20
assign ( resid 14 and name ha ) ( resid 14 and name hb2 ) 1.80 0.00 3.20
assign ( resid 15 and name ha ) ( resid 15 and name hb* ) 1.80 0.00 2.30
assign ( resid 16 and name ha ) ( resid 16 and name hb ) 1.80 0.00 3.20
assign ( resid 17 and name ha ) ( resid 17 and name hb1 ) 1.80 0.00 1.80
assign ( resid 17 and name ha ) ( resid 17 and name hb2 ) 1.80 0.00 1.80
assign ( resid 18 and name ha ) ( resid 18 and name hb1 ) 1.80 0.00 3.20
assign ( resid 18 and name ha ) ( resid 18 and name hb2 ) 1.80 0.00 3.20
assign ( resid 19 and name ha ) ( resid 19 and name hb* ) 1.80 0.00 2.30
!assign ( resid 20 and name ha ) ( resid 20 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 20 and name ha ) ( resid 20 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 21 and name ha ) ( resid 21 and name hb* ) 2.30 0.00 4.20
assign ( resid 22 and name ha ) ( resid 22 and name hb* ) 2.30 0.00 4.20
assign ( resid 23 and name ha ) ( resid 23 and name hb1 ) 1.80 0.00 3.20
assign ( resid 23 and name ha ) ( resid 23 and name hb2 ) 1.80 0.00 3.20
assign ( resid 24 and name ha ) ( resid 24 and name hb1 ) 2.30 0.00 3.70
assign ( resid 24 and name ha ) ( resid 24 and name hb2 ) 1.80 0.00 3.20
assign ( resid 25 and name ha ) ( resid 25 and name hb ) 1.80 0.00 3.20
assign ( resid 26 and name ha ) ( resid 26 and name hb1 ) 2.30 0.00 3.70
assign ( resid 26 and name ha ) ( resid 26 and name hb2 ) 2.30 0.00 3.70
assign ( resid 27 and name ha ) ( resid 27 and name hb* ) 1.80 0.00 2.30
assign ( resid 29 and name ha ) ( resid 29 and name hb ) 1.80 0.00 3.20
assign ( resid 31 and name ha ) ( resid 31 and name hb* ) 2.30 0.00 4.20
assign ( resid 32 and name ha ) ( resid 32 and name hb1 ) 1.80 0.00 3.20
assign ( resid 32 and name ha ) ( resid 32 and name hb2 ) 2.30 0.00 3.70
assign ( resid 33 and name ha ) ( resid 33 and name hb ) 1.80 0.00 3.20
assign ( resid 34 and name ha ) ( resid 34 and name hb ) 1.80 0.00 3.20
assign ( resid 35 and name ha ) ( resid 35 and name hb1 ) 1.80 0.00 3.20
assign ( resid 35 and name ha ) ( resid 35 and name hb2 ) 1.80 0.00 1.80
assign ( resid 36 and name ha ) ( resid 36 and name hb* ) 1.80 0.00 3.70
assign ( resid 37 and name ha ) ( resid 37 and name hb1 ) 2.30 0.00 3.70
assign ( resid 37 and name ha ) ( resid 37 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 39 and name ha ) ( resid 39 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 39 and name ha ) ( resid 39 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 40 and name ha ) ( resid 40 and name hb* ) 2.30 0.00 4.20
!assign ( resid 41 and name ha ) ( resid 41 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 41 and name ha ) ( resid 41 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 42 and name ha ) ( resid 42 and name hb ) 2.30 0.00 3.70
!assign ( resid 43 and name ha ) ( resid 43 and name hb* ) 2.30 0.00 4.20
!assign ( resid 44 and name ha ) ( resid 44 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 44 and name ha ) ( resid 44 and name hb2 ) 2.30 0.00 3.70
assign ( resid 45 and name ha ) ( resid 45 and name hb* ) 2.30 0.00 4.20 
assign ( resid 46 and name ha2 ) ( resid 46 and name ha1 ) 1.80 0.00 1.80
assign ( resid 47 and name ha ) ( resid 47 and name hb1 ) 1.80 0.00 3.20
assign ( resid 47 and name ha ) ( resid 47 and name hb2 ) 1.80 0.00 3.20
assign ( resid 48 and name ha ) ( resid 48 and name hb1 ) 2.30 0.00 3.70
assign ( resid 48 and name ha ) ( resid 48 and name hb2 ) 2.30 0.00 3.70
assign ( resid 49 and name ha ) ( resid 49 and name hb1 ) 1.80 0.00 1.80
assign ( resid 49 and name ha ) ( resid 49 and name hb2 ) 1.80 0.00 3.20
assign ( resid 50 and name ha ) ( resid 50 and name hb1 ) 1.80 0.00 3.20
assign ( resid 50 and name ha ) ( resid 50 and name hb2 ) 2.30 0.00 3.70
assign ( resid 51 and name ha ) ( resid 51 and name hb ) 2.30 0.00 3.70
assign ( resid 52 and name ha ) ( resid 52 and name hb* ) 1.80 0.00 3.70
assign ( resid 53 and name ha ) ( resid 53 and name hb* ) 1.80 0.00 3.70
assign ( resid 54 and name ha ) ( resid 54 and name hb1 ) 1.80 0.00 3.20
assign ( resid 54 and name ha ) ( resid 54 and name hb2 ) 1.80 0.00 3.20
assign ( resid 55 and name ha ) ( resid 55 and name hb1 ) 2.30 0.00 3.70
assign ( resid 55 and name ha ) ( resid 55 and name hb2 ) 1.80 0.00 3.20
assign ( resid 56 and name ha ) ( resid 56 and name hb* ) 1.80 0.00 3.70
assign ( resid 57 and name ha ) ( resid 57 and name hb1 ) 1.80 0.00 1.80
assign ( resid 57 and name ha ) ( resid 57 and name hb2 ) 1.80 0.00 3.20
assign ( resid 58 and name ha ) ( resid 58 and name hb2 ) 1.80 0.00 3.20
assign ( resid 58 and name ha ) ( resid 58 and name hb1 ) 1.80 0.00 3.20
assign ( resid 59 and name ha ) ( resid 59 and name hb1 ) 1.80 0.00 3.20
assign ( resid 59 and name ha ) ( resid 59 and name hb2 ) 1.80 0.00 3.20
assign ( resid 60 and name ha ) ( resid 60 and name hb1 ) 1.80 0.00 3.20
assign ( resid 60 and name ha ) ( resid 60 and name hb2 ) 1.80 0.00 3.20
assign ( resid 61 and name ha ) ( resid 61 and name hb1 ) 2.30 0.00 3.70
assign ( resid 61 and name ha ) ( resid 61 and name hb2 ) 2.30 0.00 3.70
assign ( resid 62 and name ha ) ( resid 62 and name hb ) 2.30 0.00 3.70
assign ( resid 63 and name ha ) ( resid 63 and name hb1 ) 2.30 0.00 3.70
assign ( resid 63 and name ha ) ( resid 63 and name hb2 ) 2.30 0.00 3.70
assign ( resid 64 and name ha ) ( resid 64 and name hb ) 2.30 0.00 3.70
assign ( resid 67 and name ha ) ( resid 67 and name hb1 ) 1.80 0.00 3.20
assign ( resid 67 and name ha ) ( resid 67 and name hb2 ) 1.80 0.00 1.80
assign ( resid 68 and name ha ) ( resid 68 and name hb1 ) 2.30 0.00 3.70
assign ( resid 68 and name ha ) ( resid 68 and name hb2 ) 2.30 0.00 3.70
assign ( resid 69 and name ha ) ( resid 69 and name hb1 ) 2.30 0.00 3.70
assign ( resid 69 and name ha ) ( resid 69 and name hb2 ) 2.30 0.00 3.70
assign ( resid 70 and name ha ) ( resid 70 and name hb2 ) 2.30 0.00 3.70
assign ( resid 72 and name ha2 ) ( resid 72 and name ha1 ) 1.80 0.00 1.80
assign ( resid 73 and name ha ) ( resid 73 and name hb* ) 1.80 0.00 3.70
assign ( resid 75 and name ha ) ( resid 75 and name hb2 ) 1.80 0.00 3.20
assign ( resid 75 and name ha ) ( resid 75 and name hb1 ) 2.30 0.00 3.70
assign ( resid 76 and name ha ) ( resid 76 and name hb* ) 1.80 0.00 3.70  
assign ( resid 77 and name ha ) ( resid 77 and name hb* ) 2.30 0.00 4.20
assign ( resid 78 and name ha ) ( resid 78 and name hb1 ) 1.80 0.00 1.80
assign ( resid 78 and name ha ) ( resid 78 and name hb2 ) 2.30 0.00 3.70
assign ( resid 79 and name ha ) ( resid 79 and name hb ) 2.30 0.00 3.70
assign ( resid 80 and name ha ) ( resid 80 and name hb* ) 2.30 0.00 4.20
assign ( resid 81 and name ha ) ( resid 81 and name hb* ) 1.80 0.00 2.30
assign ( resid 82 and name ha ) ( resid 82 and name hb* ) 1.80 0.00 2.30
assign ( resid 83 and name ha ) ( resid 83 and name hb1 ) 2.30 0.00 3.70
assign ( resid 83 and name ha ) ( resid 83 and name hb2 ) 1.80 0.00 3.20
assign ( resid 84 and name ha ) ( resid 84 and name hb1 ) 2.30 0.00 3.70
assign ( resid 84 and name ha ) ( resid 84 and name hb2 ) 2.30 0.00 3.70
assign ( resid 85 and name ha ) ( resid 85 and name hb* ) 1.80 0.00 2.30
assign ( resid 86 and name ha ) ( resid 86 and name hb1 ) 1.80 0.00 3.20
assign ( resid 86 and name ha ) ( resid 86 and name hb2 ) 1.80 0.00 1.80
assign ( resid 87 and name ha ) ( resid 87 and name hb1 ) 1.80 0.00 3.20
assign ( resid 87 and name ha ) ( resid 87 and name hb2 ) 1.80 0.00 3.20
assign ( resid 88 and name ha ) ( resid 88 and name hb ) 1.80 0.00 3.20
assign ( resid 89 and name ha ) ( resid 89 and name hb* ) 1.80 0.00 2.30
assign ( resid 90 and name ha ) ( resid 90 and name hb1 ) 1.80 0.00 3.20
assign ( resid 90 and name ha ) ( resid 90 and name hb2 ) 1.80 0.00 3.20
assign ( resid 91 and name ha ) ( resid 91 and name hb* ) 1.80 0.00 2.30
assign ( resid 92 and name ha ) ( resid 92 and name hb1 ) 2.30 0.00 3.70
assign ( resid 92 and name ha ) ( resid 92 and name hb2 ) 2.30 0.00 3.70
assign ( resid 93 and name ha ) ( resid 93 and name hb* ) 1.80 0.00 2.30
assign ( resid 94 and name ha ) ( resid 94 and name hb* ) 1.80 0.00 3.70
assign ( resid 95 and name ha ) ( resid 95 and name hb1 ) 1.80 0.00 1.80
assign ( resid 95 and name ha ) ( resid 95 and name hb2 ) 1.80 0.00 3.20
assign ( resid 96 and name ha ) ( resid 96 and name hb* ) 2.30 0.00 4.20
!assign ( resid 97 and name ha ) ( resid 97 and name hb1 ) 2.30 0.00 3.70
!assign ( resid 97 and name ha ) ( resid 97 and name hb2 ) 2.30 0.00 3.70
!assign ( resid 98 and name ha ) ( resid 98 and name hb1 ) 1.80 0.00 3.20
!assign ( resid 98 and name ha ) ( resid 98 and name hb2 ) 1.80 0.00 1.80
assign ( resid 100 and name ha ) ( resid 100 and name hb ) 2.30 0.00 3.70
assign ( resid 101 and name ha ) ( resid 101 and name hb* ) 2.30 0.00 4.20

!H-bond
assign ( resid 62 and name hn ) ( resid 78 and name o ) 2.0 0.5 0.5
assign ( resid 80 and name hn ) ( resid 60 and name o ) 2.0 0.5 0.5
assign ( resid 77 and name hn ) ( resid 24 and name o ) 2.0 0.5 0.5
assign ( resid 24 and name hn ) ( resid 77 and name o ) 2.0 0.5 0.5

assign ( resid 79 and name hn ) ( resid 22 and name o ) 2.0 0.5 0.5
assign ( resid 78 and name hn ) ( resid 62 and name o ) 2.0 0.5 0.5
assign ( resid 64 and name hn ) ( resid 76 and name o ) 2.0 0.5 0.5
 
 
 
 
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLU   1          1HT       GLU   1   6.365  16.639  -6.244
    2   2H    GLU   1          2HT       GLU   1   5.497  15.763  -5.075
    3   3H    GLU   1          3HT       GLU   1   4.671  16.582  -6.312
    4    HA   GLU   1           HA       GLU   1   4.606  14.503  -7.187
    5   1HB   GLU   1          2HB       GLU   1   6.326  16.209  -8.409
    6   2HB   GLU   1          1HB       GLU   1   7.413  14.858  -8.089
    7   1HG   GLU   1          2HG       GLU   1   6.180  13.378  -9.411
    8   2HG   GLU   1          1HG       GLU   1   4.701  14.327  -9.267
    9    H    SER   2           H        SER   2   7.313  15.018  -5.048
   10    HA   SER   2           HA       SER   2   8.462  13.500  -3.674
   11   1HB   SER   2          2HB       SER   2   7.221  11.757  -2.863
   12   2HB   SER   2          1HB       SER   2   5.921  12.531  -3.763
   13    HG   SER   2           HG       SER   2   5.864  10.638  -4.710
   14    H    LYS   3           H        LYS   3   9.017  10.770  -4.101
   15    HA   LYS   3           HA       LYS   3  10.108  10.639  -6.865
   16   1HB   LYS   3          2HB       LYS   3  11.949  11.545  -5.590
   17   2HB   LYS   3          1HB       LYS   3  11.714  10.354  -4.312
   18   1HG   LYS   3          2HG       LYS   3  12.561   8.602  -5.598
   19   2HG   LYS   3          1HG       LYS   3  12.217   9.421  -7.121
   20   1HD   LYS   3          2HD       LYS   3  14.186  10.646  -5.215
   21   2HD   LYS   3          1HD       LYS   3  14.696   9.296  -6.229
   22   1HE   LYS   3          2HE       LYS   3  13.299  10.963  -7.977
   23   2HE   LYS   3          1HE       LYS   3  14.220  12.076  -6.966
   24   1HZ   LYS   3          1HZ       LYS   3  15.518   9.679  -8.078
   25   2HZ   LYS   3          2HZ       LYS   3  16.214  11.156  -7.607
   26   3HZ   LYS   3          3HZ       LYS   3  15.320  11.056  -9.048
   27    HA   PRO   4           HA       PRO   4   8.251   6.672  -5.655
   28   1HB   PRO   4          2HB       PRO   4   7.323   6.128  -8.185
   29   2HB   PRO   4          1HB       PRO   4   6.432   7.090  -6.993
   30   1HG   PRO   4          2HG       PRO   4   7.929   8.007  -9.408
   31   2HG   PRO   4          1HG       PRO   4   6.544   8.755  -8.595
   32   1HD   PRO   4          2HD       PRO   4   9.230   9.583  -8.350
   33   2HD   PRO   4          1HD       PRO   4   7.897  10.051  -7.272
   34    HA   PRO   5           HA       PRO   5  11.962   4.725  -7.373
   35   1HB   PRO   5          2HB       PRO   5  12.117   2.823  -5.393
   36   2HB   PRO   5          1HB       PRO   5  12.760   4.465  -5.212
   37   1HG   PRO   5          2HG       PRO   5  10.311   3.269  -4.010
   38   2HG   PRO   5          1HG       PRO   5  11.299   4.622  -3.435
   39   1HD   PRO   5          2HD       PRO   5   8.810   4.823  -4.786
   40   2HD   PRO   5          1HD       PRO   5   9.938   6.153  -4.453
   41    H    TYR   6           H        TYR   6   8.891   3.411  -6.376
   42    HA   TYR   6           HA       TYR   6   9.234   1.114  -8.252
   43   1HB   TYR   6          2HB       TYR   6   7.330   1.394  -5.913
   44   2HB   TYR   6          1HB       TYR   6   7.482  -0.020  -6.955
   45    HD1  TYR   6           HD1      TYR   6  10.620   0.422  -7.206
   46    HD2  TYR   6           HD2      TYR   6   7.883   0.061  -3.917
   47    HE1  TYR   6           HE1      TYR   6  12.457  -0.422  -5.765
   48    HE2  TYR   6           HE2      TYR   6   9.716  -0.779  -2.477
   49    HH   TYR   6           HH       TYR   6  12.157  -2.081  -3.186
   50    H    SER   7           H        SER   7   7.772   0.956  -9.938
   51    HA   SER   7           HA       SER   7   6.363   3.184 -10.874
   52   1HB   SER   7          2HB       SER   7   6.089   0.230 -11.299
   53   2HB   SER   7          1HB       SER   7   4.817   1.279 -11.919
   54    HG   SER   7           HG       SER   7   7.534   1.876 -12.376
   55    H    TYR   8           H        TYR   8   3.856   3.368 -10.965
   56    HA   TYR   8           HA       TYR   8   2.889   3.095  -8.193
   57   1HB   TYR   8          2HB       TYR   8   1.795   4.476 -10.647
   58   2HB   TYR   8          1HB       TYR   8   0.877   4.347  -9.143
   59    HD1  TYR   8           HD1      TYR   8   2.726   4.662  -7.017
   60    HD2  TYR   8           HD2      TYR   8   2.736   6.618 -10.840
   61    HE1  TYR   8           HE1      TYR   8   4.032   6.529  -6.055
   62    HE2  TYR   8           HE2      TYR   8   4.039   8.488  -9.878
   63    HH   TYR   8           HH       TYR   8   4.861   9.389  -8.011
   64    H    ALA   9           H        ALA   9   3.065   1.017 -10.635
   65    HA   ALA   9           HA       ALA   9   0.393  -0.209 -10.077
   66   1HB   ALA   9          1HB       ALA   9   0.246  -0.780 -12.269
   67   2HB   ALA   9          2HB       ALA   9   1.913  -1.352 -12.305
   68   3HB   ALA   9          3HB       ALA   9   1.563   0.361 -12.535
   69    H    GLN  10           H        GLN  10   3.838  -0.578 -10.091
   70    HA   GLN  10           HA       GLN  10   3.756  -3.421  -9.232
   71   1HB   GLN  10          2HB       GLN  10   5.580  -2.994 -10.698
   72   2HB   GLN  10          1HB       GLN  10   5.929  -1.438  -9.953
   73   1HG   GLN  10          2HG       GLN  10   6.160  -3.408  -7.914
   74   2HG   GLN  10          1HG       GLN  10   7.039  -4.000  -9.320
   75   1HE2  GLN  10          1HE2      GLN  10   8.926  -3.519  -7.683
   76   2HE2  GLN  10          2HE2      GLN  10   9.587  -1.957  -7.746
   77    H    LEU  11           H        LEU  11   4.463  -0.184  -8.122
   78    HA   LEU  11           HA       LEU  11   5.424  -0.738  -5.515
   79   1HB   LEU  11          2HB       LEU  11   5.565   1.489  -6.437
   80   2HB   LEU  11          1HB       LEU  11   3.820   1.565  -6.654
   81    HG   LEU  11           HG       LEU  11   3.970   1.047  -3.982
   82   1HD1  LEU  11          1HD1      LEU  11   6.314   2.829  -4.695
   83   2HD1  LEU  11          2HD1      LEU  11   6.437   1.198  -4.039
   84   3HD1  LEU  11          3HD1      LEU  11   5.734   2.487  -3.065
   85   1HD2  LEU  11          1HD2      LEU  11   4.284   3.895  -4.741
   86   2HD2  LEU  11          2HD2      LEU  11   2.987   3.105  -3.842
   87   3HD2  LEU  11          3HD2      LEU  11   3.023   3.012  -5.604
   88    H    ILE  12           H        ILE  12   2.134  -0.450  -6.805
   89    HA   ILE  12           HA       ILE  12   0.839  -0.657  -4.221
   90    HB   ILE  12           HB       ILE  12  -0.286  -1.393  -6.922
   91   1HG1  ILE  12          2HG1      ILE  12   0.565   1.145  -6.201
   92   2HG1  ILE  12          1HG1      ILE  12  -0.707   0.817  -7.368
   93   1HG2  ILE  12          1HG2      ILE  12  -2.432  -0.862  -5.678
   94   2HG2  ILE  12          2HG2      ILE  12  -1.470  -0.879  -4.206
   95   3HG2  ILE  12          3HG2      ILE  12  -1.601  -2.334  -5.193
   96   1HD1  ILE  12          1HD1      ILE  12  -2.391   1.384  -5.902
   97   2HD1  ILE  12          2HD1      ILE  12  -1.111   2.415  -5.281
   98   3HD1  ILE  12          3HD1      ILE  12  -1.470   0.900  -4.481
   99    H    VAL  13           H        VAL  13   1.687  -3.042  -6.732
  100    HA   VAL  13           HA       VAL  13   0.338  -5.278  -5.764
  101    HB   VAL  13           HB       VAL  13   3.109  -5.070  -6.965
  102   1HG1  VAL  13          1HG1      VAL  13   1.398  -7.558  -6.766
  103   2HG1  VAL  13          2HG1      VAL  13   2.683  -7.193  -5.615
  104   3HG1  VAL  13          3HG1      VAL  13   3.069  -7.437  -7.318
  105   1HG2  VAL  13          1HG2      VAL  13   1.720  -6.044  -8.931
  106   2HG2  VAL  13          2HG2      VAL  13   1.514  -4.339  -8.540
  107   3HG2  VAL  13          3HG2      VAL  13   0.314  -5.514  -8.009
  108    H    GLN  14           H        GLN  14   3.624  -4.217  -4.737
  109    HA   GLN  14           HA       GLN  14   3.932  -6.232  -2.741
  110   1HB   GLN  14          2HB       GLN  14   5.030  -3.408  -2.880
  111   2HB   GLN  14          1HB       GLN  14   5.536  -4.599  -1.680
  112   1HG   GLN  14          2HG       GLN  14   6.787  -5.756  -3.180
  113   2HG   GLN  14          1HG       GLN  14   5.582  -5.582  -4.456
  114   1HE2  GLN  14          1HE2      GLN  14   7.420  -3.113  -2.575
  115   2HE2  GLN  14          2HE2      GLN  14   8.050  -2.329  -3.942
  116    H    ALA  15           H        ALA  15   2.175  -3.212  -2.786
  117    HA   ALA  15           HA       ALA  15   1.739  -2.957   0.044
  118   1HB   ALA  15          1HB       ALA  15  -0.484  -1.942  -1.491
  119   2HB   ALA  15          2HB       ALA  15   1.033  -1.527  -2.290
  120   3HB   ALA  15          3HB       ALA  15   0.757  -1.044  -0.618
  121    H    ILE  16           H        ILE  16  -0.791  -3.705  -2.350
  122    HA   ILE  16           HA       ILE  16  -2.459  -4.977  -0.382
  123    HB   ILE  16           HB       ILE  16  -3.566  -5.947  -2.597
  124   1HG1  ILE  16          2HG1      ILE  16  -1.958  -3.596  -3.645
  125   2HG1  ILE  16          1HG1      ILE  16  -1.622  -5.283  -4.038
  126   1HG2  ILE  16          1HG2      ILE  16  -4.947  -4.036  -2.634
  127   2HG2  ILE  16          2HG2      ILE  16  -3.624  -2.963  -2.182
  128   3HG2  ILE  16          3HG2      ILE  16  -4.307  -4.068  -0.993
  129   1HD1  ILE  16          1HD1      ILE  16  -4.432  -4.602  -4.413
  130   2HD1  ILE  16          2HD1      ILE  16  -3.301  -5.345  -5.539
  131   3HD1  ILE  16          3HD1      ILE  16  -3.368  -3.596  -5.392
  132    H    SER  17           H        SER  17  -0.516  -6.392  -3.029
  133    HA   SER  17           HA       SER  17  -1.100  -9.096  -2.544
  134   1HB   SER  17          2HB       SER  17   1.646  -8.099  -3.312
  135   2HB   SER  17          1HB       SER  17   0.889  -9.627  -3.754
  136    HG   SER  17           HG       SER  17   0.181  -8.587  -5.429
  137    H    SER  18           H        SER  18   1.214  -7.003  -0.844
  138    HA   SER  18           HA       SER  18   2.148  -9.304   0.759
  139   1HB   SER  18          2HB       SER  18   2.881  -6.399   1.138
  140   2HB   SER  18          1HB       SER  18   3.778  -7.815   1.672
  141    HG   SER  18           HG       SER  18   3.745  -8.315  -0.724
  142    H    ALA  19           H        ALA  19  -0.244  -6.837   0.949
  143    HA   ALA  19           HA       ALA  19  -0.377  -6.493   3.781
  144   1HB   ALA  19          1HB       ALA  19  -2.227  -5.247   3.333
  145   2HB   ALA  19          2HB       ALA  19  -2.958  -6.511   2.346
  146   3HB   ALA  19          3HB       ALA  19  -1.735  -5.447   1.651
  147    H    GLN  20           H        GLN  20  -3.119  -7.284   4.294
  148    HA   GLN  20           HA       GLN  20  -2.786  -9.809   5.448
  149   1HB   GLN  20          2HB       GLN  20  -5.396  -9.932   5.122
  150   2HB   GLN  20          1HB       GLN  20  -4.705  -8.698   6.175
  151   1HG   GLN  20          2HG       GLN  20  -4.730  -7.731   3.459
  152   2HG   GLN  20          1HG       GLN  20  -6.341  -8.296   3.897
  153   1HE2  GLN  20          1HE2      GLN  20  -4.581  -5.527   3.888
  154   2HE2  GLN  20          2HE2      GLN  20  -5.234  -4.750   5.248
  155    H    ASP  21           H        ASP  21  -5.364  -9.958   3.112
  156    HA   ASP  21           HA       ASP  21  -4.224 -12.418   2.009
  157   1HB   ASP  21          2HB       ASP  21  -6.746 -10.874   1.322
  158   2HB   ASP  21          1HB       ASP  21  -6.315 -12.441   0.638
  159    H    ARG  22           H        ARG  22  -5.566  -9.557   0.342
  160    HA   ARG  22           HA       ARG  22  -3.162  -8.961  -1.105
  161   1HB   ARG  22          2HB       ARG  22  -4.031  -9.731  -3.370
  162   2HB   ARG  22          1HB       ARG  22  -3.499 -11.020  -2.288
  163   1HG   ARG  22          2HG       ARG  22  -5.996 -11.052  -1.508
  164   2HG   ARG  22          1HG       ARG  22  -6.301 -10.225  -3.036
  165   1HD   ARG  22          2HD       ARG  22  -5.255 -12.040  -4.280
  166   2HD   ARG  22          1HD       ARG  22  -4.800 -12.846  -2.779
  167    HE   ARG  22           HE       ARG  22  -6.989 -13.700  -2.666
  168   1HH1  ARG  22          1HH1      ARG  22  -6.952 -12.746  -5.682
  169   2HH1  ARG  22          2HH1      ARG  22  -8.537 -12.055  -5.769
  170   1HH2  ARG  22          1HH2      ARG  22  -8.999 -12.016  -2.333
  171   2HH2  ARG  22          2HH2      ARG  22  -9.697 -11.640  -3.872
  172    H    GLN  23           H        GLN  23  -5.513  -7.724   0.272
  173    HA   GLN  23           HA       GLN  23  -6.237  -5.820  -1.907
  174   1HB   GLN  23          2HB       GLN  23  -8.518  -5.651  -0.903
  175   2HB   GLN  23          1HB       GLN  23  -8.182  -7.261  -1.541
  176   1HG   GLN  23          2HG       GLN  23  -7.328  -7.748   0.893
  177   2HG   GLN  23          1HG       GLN  23  -8.327  -6.358   1.320
  178   1HE2  GLN  23          1HE2      GLN  23  -9.486  -8.319   2.507
  179   2HE2  GLN  23          2HE2      GLN  23 -10.719  -9.079   1.625
  180    H    LEU  24           H        LEU  24  -6.810  -3.634  -1.024
  181    HA   LEU  24           HA       LEU  24  -6.048  -3.166   1.786
  182   1HB   LEU  24          2HB       LEU  24  -4.512  -2.178  -0.615
  183   2HB   LEU  24          1HB       LEU  24  -4.579  -1.231   0.860
  184    HG   LEU  24           HG       LEU  24  -3.692  -4.123   0.739
  185   1HD1  LEU  24          1HD1      LEU  24  -2.144  -2.451  -0.360
  186   2HD1  LEU  24          2HD1      LEU  24  -1.445  -3.294   1.022
  187   3HD1  LEU  24          3HD1      LEU  24  -2.023  -1.637   1.200
  188   1HD2  LEU  24          1HD2      LEU  24  -2.807  -3.375   3.076
  189   2HD2  LEU  24          2HD2      LEU  24  -4.520  -3.755   2.909
  190   3HD2  LEU  24          3HD2      LEU  24  -3.988  -2.073   2.928
  191    H    THR  25           H        THR  25  -6.615  -0.985   2.471
  192    HA   THR  25           HA       THR  25  -8.978   0.024   1.048
  193    HB   THR  25           HB       THR  25  -9.495   1.092   3.007
  194    HG1  THR  25           HG1      THR  25  -7.505   1.915   4.276
  195   1HG2  THR  25          1HG2      THR  25  -7.231  -0.240   4.418
  196   2HG2  THR  25          2HG2      THR  25  -8.361  -1.273   3.545
  197   3HG2  THR  25          3HG2      THR  25  -8.946  -0.209   4.825
  198    H    LEU  26           H        LEU  26  -8.990   2.502   0.627
  199    HA   LEU  26           HA       LEU  26  -7.041   3.151  -1.289
  200   1HB   LEU  26          2HB       LEU  26  -9.272   4.465  -0.235
  201   2HB   LEU  26          1HB       LEU  26  -7.926   5.531   0.153
  202    HG   LEU  26           HG       LEU  26  -8.247   4.349  -2.601
  203   1HD1  LEU  26          1HD1      LEU  26 -10.137   6.001  -1.426
  204   2HD1  LEU  26          2HD1      LEU  26  -9.860   5.842  -3.161
  205   3HD1  LEU  26          3HD1      LEU  26  -9.083   7.142  -2.258
  206   1HD2  LEU  26          1HD2      LEU  26  -6.364   5.528  -2.986
  207   2HD2  LEU  26          2HD2      LEU  26  -6.322   5.984  -1.283
  208   3HD2  LEU  26          3HD2      LEU  26  -7.160   7.007  -2.450
  209    H    SER  27           H        SER  27  -6.937   3.629   2.209
  210    HA   SER  27           HA       SER  27  -4.269   4.905   1.934
  211   1HB   SER  27          2HB       SER  27  -6.095   4.558   4.308
  212   2HB   SER  27          1HB       SER  27  -4.502   5.302   4.385
  213    HG   SER  27           HG       SER  27  -5.512   6.583   2.485
  214    H    GLY  28           H        GLY  28  -4.205   2.217   1.240
  215   1HA   GLY  28          2HA       GLY  28  -3.175   0.841   3.688
  216   2HA   GLY  28          1HA       GLY  28  -3.606   0.031   2.178
  217    H    ILE  29           H        ILE  29  -2.403   1.233   0.289
  218    HA   ILE  29           HA       ILE  29   0.290   0.500   0.297
  219    HB   ILE  29           HB       ILE  29  -1.345   1.043  -1.604
  220   1HG1  ILE  29          2HG1      ILE  29   1.549   1.933  -1.614
  221   2HG1  ILE  29          1HG1      ILE  29   0.908   0.362  -2.107
  222   1HG2  ILE  29          1HG2      ILE  29  -1.442   3.261  -2.401
  223   2HG2  ILE  29          2HG2      ILE  29  -0.110   3.777  -1.371
  224   3HG2  ILE  29          3HG2      ILE  29  -1.682   3.407  -0.659
  225   1HD1  ILE  29          1HD1      ILE  29   0.666   1.172  -4.182
  226   2HD1  ILE  29          2HD1      ILE  29   1.122   2.790  -3.644
  227   3HD1  ILE  29          3HD1      ILE  29  -0.555   2.261  -3.535
  228    H    TYR  30           H        TYR  30  -1.231   3.509   1.185
  229    HA   TYR  30           HA       TYR  30   1.158   5.100   1.214
  230   1HB   TYR  30          2HB       TYR  30  -1.309   5.456   2.933
  231   2HB   TYR  30          1HB       TYR  30  -0.175   6.704   2.415
  232    HD1  TYR  30           HD1      TYR  30  -3.272   6.478   1.849
  233    HD2  TYR  30           HD2      TYR  30   0.240   5.477  -0.403
  234    HE1  TYR  30           HE1      TYR  30  -4.548   6.703  -0.264
  235    HE2  TYR  30           HE2      TYR  30  -1.030   5.708  -2.514
  236    HH   TYR  30           HH       TYR  30  -4.525   6.242  -2.490
  237    H    ALA  31           H        ALA  31  -0.540   3.231   3.700
  238    HA   ALA  31           HA       ALA  31   1.410   3.771   5.770
  239   1HB   ALA  31          1HB       ALA  31   0.132   2.371   7.088
  240   2HB   ALA  31          2HB       ALA  31  -0.121   1.208   5.786
  241   3HB   ALA  31          3HB       ALA  31  -1.060   2.700   5.831
  242    H    HIS  32           H        HIS  32   1.355   1.783   2.969
  243    HA   HIS  32           HA       HIS  32   3.192  -0.271   3.879
  244   1HB   HIS  32          2HB       HIS  32   1.913  -0.932   2.025
  245   2HB   HIS  32          1HB       HIS  32   2.068   0.626   1.243
  246    HD1  HIS  32           HD1      HIS  32   2.693  -1.149  -0.790
  247    HD2  HIS  32           HD2      HIS  32   5.621  -0.488   2.093
  248    HE1  HIS  32           HE1      HIS  32   4.878  -1.914  -1.797
  249    H    ILE  33           H        ILE  33   3.875   1.789   1.117
  250    HA   ILE  33           HA       ILE  33   6.664   1.758   1.377
  251    HB   ILE  33           HB       ILE  33   5.222   2.514  -0.569
  252   1HG1  ILE  33          2HG1      ILE  33   7.560   4.268   0.237
  253   2HG1  ILE  33          1HG1      ILE  33   7.685   2.701  -0.565
  254   1HG2  ILE  33          1HG2      ILE  33   4.538   4.785  -0.687
  255   2HG2  ILE  33          2HG2      ILE  33   5.409   5.199   0.789
  256   3HG2  ILE  33          3HG2      ILE  33   3.969   4.182   0.866
  257   1HD1  ILE  33          1HD1      ILE  33   7.502   5.147  -1.847
  258   2HD1  ILE  33          2HD1      ILE  33   5.854   4.525  -1.932
  259   3HD1  ILE  33          3HD1      ILE  33   7.189   3.576  -2.585
  260    H    THR  34           H        THR  34   4.399   4.210   2.658
  261    HA   THR  34           HA       THR  34   6.397   5.995   3.629
  262    HB   THR  34           HB       THR  34   4.706   6.924   5.073
  263    HG1  THR  34           HG1      THR  34   4.006   4.961   5.972
  264   1HG2  THR  34          1HG2      THR  34   3.756   5.908   2.411
  265   2HG2  THR  34          2HG2      THR  34   4.165   7.553   2.893
  266   3HG2  THR  34          3HG2      THR  34   2.659   6.822   3.445
  267    H    LYS  35           H        LYS  35   5.275   2.934   4.814
  268    HA   LYS  35           HA       LYS  35   6.500   3.247   7.459
  269   1HB   LYS  35          2HB       LYS  35   4.458   1.843   7.050
  270   2HB   LYS  35          1HB       LYS  35   5.464   0.732   6.121
  271   1HG   LYS  35          2HG       LYS  35   6.859   0.296   8.073
  272   2HG   LYS  35          1HG       LYS  35   5.961   1.488   9.014
  273   1HD   LYS  35          2HD       LYS  35   4.152  -0.425   7.800
  274   2HD   LYS  35          1HD       LYS  35   5.372  -1.250   8.769
  275   1HE   LYS  35          2HE       LYS  35   4.446   1.105  10.159
  276   2HE   LYS  35          1HE       LYS  35   3.074   0.093   9.709
  277   1HZ   LYS  35          1HZ       LYS  35   3.709  -0.860  11.674
  278   2HZ   LYS  35          2HZ       LYS  35   5.360  -0.533  11.442
  279   3HZ   LYS  35          3HZ       LYS  35   4.611  -1.795  10.584
  280    H    HIS  36           H        HIS  36   7.043   0.796   4.893
  281    HA   HIS  36           HA       HIS  36   9.693   0.183   5.879
  282   1HB   HIS  36          2HB       HIS  36   8.411  -0.455   3.204
  283   2HB   HIS  36          1HB       HIS  36   9.889  -1.186   3.830
  284    HD1  HIS  36           HD1      HIS  36   9.665  -2.889   5.768
  285    HD2  HIS  36           HD2      HIS  36   6.015  -1.324   4.502
  286    HE1  HIS  36           HE1      HIS  36   7.866  -4.300   6.857
  287    H    TYR  37           H        TYR  37   8.525   1.934   2.996
  288    HA   TYR  37           HA       TYR  37  11.236   2.714   2.263
  289   1HB   TYR  37          2HB       TYR  37   8.700   2.710   0.977
  290   2HB   TYR  37          1HB       TYR  37   9.266   4.383   0.999
  291    HD1  TYR  37           HD1      TYR  37   9.929   0.968  -0.161
  292    HD2  TYR  37           HD2      TYR  37  11.345   5.021  -0.127
  293    HE1  TYR  37           HE1      TYR  37  11.536   0.415  -1.962
  294    HE2  TYR  37           HE2      TYR  37  12.952   4.471  -1.929
  295    HH   TYR  37           HH       TYR  37  13.591   2.931  -3.418
  296    HA   PRO  38           HA       PRO  38  11.110   6.137   5.133
  297   1HB   PRO  38          2HB       PRO  38  13.735   6.856   4.748
  298   2HB   PRO  38          1HB       PRO  38  13.229   5.520   5.797
  299   1HG   PRO  38          2HG       PRO  38  14.484   5.413   3.096
  300   2HG   PRO  38          1HG       PRO  38  14.528   4.217   4.402
  301   1HD   PRO  38          2HD       PRO  38  12.898   4.093   2.089
  302   2HD   PRO  38          1HD       PRO  38  12.727   3.088   3.543
  303    H    TYR  39           H        TYR  39  12.179   6.264   1.776
  304    HA   TYR  39           HA       TYR  39  12.434   9.108   1.557
  305   1HB   TYR  39          2HB       TYR  39  13.171   7.333  -0.139
  306   2HB   TYR  39          1HB       TYR  39  11.484   7.281  -0.656
  307    HD1  TYR  39           HD1      TYR  39  10.392   9.720  -0.989
  308    HD2  TYR  39           HD2      TYR  39  14.579   8.803  -1.263
  309    HE1  TYR  39           HE1      TYR  39  10.748  11.758  -2.352
  310    HE2  TYR  39           HE2      TYR  39  14.936  10.838  -2.629
  311    HH   TYR  39           HH       TYR  39  13.993  12.594  -3.592
  312    H    TYR  40           H        TYR  40   9.674   6.917   1.144
  313    HA   TYR  40           HA       TYR  40   7.893   9.158   0.475
  314   1HB   TYR  40          2HB       TYR  40   7.696   6.191   0.568
  315   2HB   TYR  40          1HB       TYR  40   6.203   7.094   0.829
  316    HD1  TYR  40           HD1      TYR  40   8.961   8.467  -1.186
  317    HD2  TYR  40           HD2      TYR  40   5.211   6.380  -1.290
  318    HE1  TYR  40           HE1      TYR  40   8.783   8.904  -3.624
  319    HE2  TYR  40           HE2      TYR  40   5.033   6.810  -3.725
  320    HH   TYR  40           HH       TYR  40   7.254   8.952  -5.374
  321    H    ARG  41           H        ARG  41   8.912   9.804   2.873
  322    HA   ARG  41           HA       ARG  41   6.700   9.147   4.777
  323   1HB   ARG  41          2HB       ARG  41   9.007   8.164   5.334
  324   2HB   ARG  41          1HB       ARG  41   9.521   9.827   5.623
  325   1HG   ARG  41          2HG       ARG  41   7.833  10.115   7.339
  326   2HG   ARG  41          1HG       ARG  41   7.136   8.537   6.974
  327   1HD   ARG  41          2HD       ARG  41   8.876   7.379   7.974
  328   2HD   ARG  41          1HD       ARG  41  10.038   8.675   7.691
  329    HE   ARG  41           HE       ARG  41   7.967   8.711   9.845
  330   1HH1  ARG  41          1HH2      ARG  41  11.110   8.402   9.953
  331   2HH1  ARG  41          2HH2      ARG  41  11.516   9.952  10.611
  332   1HH2  ARG  41          1HH1      ARG  41   8.386  11.320  10.015
  333   2HH2  ARG  41          2HH1      ARG  41   9.974  11.604  10.647
  334    H    THR  42           H        THR  42   9.077  11.561   3.705
  335    HA   THR  42           HA       THR  42   7.487  13.655   5.114
  336    HB   THR  42           HB       THR  42   9.412  15.047   5.016
  337    HG1  THR  42           HG1      THR  42  10.855  14.875   3.484
  338   1HG2  THR  42          1HG2      THR  42   9.699  13.331   6.681
  339   2HG2  THR  42          2HG2      THR  42  11.252  13.546   5.873
  340   3HG2  THR  42          3HG2      THR  42  10.229  12.168   5.466
  341    H    ALA  43           H        ALA  43   8.385  12.442   1.985
  342    HA   ALA  43           HA       ALA  43   7.047  14.794   0.712
  343   1HB   ALA  43          1HB       ALA  43   9.245  14.635  -0.181
  344   2HB   ALA  43          2HB       ALA  43   8.214  13.877  -1.394
  345   3HB   ALA  43          3HB       ALA  43   9.159  12.877  -0.291
  346    H    ASP  44           H        ASP  44   4.928  13.870   1.084
  347    HA   ASP  44           HA       ASP  44   4.344  11.591  -0.760
  348   1HB   ASP  44          2HB       ASP  44   2.646  10.802   0.855
  349   2HB   ASP  44          1HB       ASP  44   4.255  10.806   1.579
  350    H    LYS  45           H        LYS  45   4.010  14.749  -0.530
  351    HA   LYS  45           HA       LYS  45   1.097  14.957  -0.919
  352   1HB   LYS  45          2HB       LYS  45   2.662  16.705   0.222
  353   2HB   LYS  45          1HB       LYS  45   3.069  17.176  -1.430
  354   1HG   LYS  45          2HG       LYS  45   0.380  17.086  -1.649
  355   2HG   LYS  45          1HG       LYS  45   0.517  17.507   0.058
  356   1HD   LYS  45          2HD       LYS  45   1.705  19.499  -0.408
  357   2HD   LYS  45          1HD       LYS  45   2.093  18.982  -2.050
  358   1HE   LYS  45          2HE       LYS  45  -0.750  19.434  -1.125
  359   2HE   LYS  45          1HE       LYS  45   0.228  20.716  -1.841
  360   1HZ   LYS  45          1HZ       LYS  45  -0.265  18.093  -3.134
  361   2HZ   LYS  45          2HZ       LYS  45   0.476  19.455  -3.826
  362   3HZ   LYS  45          3HZ       LYS  45  -1.179  19.485  -3.449
  363    H    GLY  46           H        GLY  46   2.107  13.251  -2.814
  364   1HA   GLY  46          2HA       GLY  46   1.529  14.735  -5.283
  365   2HA   GLY  46          1HA       GLY  46   3.148  14.032  -5.204
  366    H    TRP  47           H        TRP  47   3.203  11.630  -4.698
  367    HA   TRP  47           HA       TRP  47   1.536  10.202  -6.526
  368   1HB   TRP  47          2HB       TRP  47   2.597   8.207  -5.714
  369   2HB   TRP  47          1HB       TRP  47   3.818   9.478  -5.713
  370    HD1  TRP  47           HD1      TRP  47   4.006  10.821  -3.230
  371    HE1  TRP  47           HE1      TRP  47   4.086   9.743  -0.893
  372    HE3  TRP  47           HE3      TRP  47   1.910   6.272  -4.276
  373    HZ2  TRP  47           HZ2      TRP  47   3.366   7.285   0.368
  374    HZ3  TRP  47           HZ3      TRP  47   1.630   4.586  -2.483
  375    HH2  TRP  47           HH2      TRP  47   2.354   5.088  -0.166
  376    H    GLN  48           H        GLN  48   0.927  11.292  -3.345
  377    HA   GLN  48           HA       GLN  48  -0.675   9.332  -2.195
  378   1HB   GLN  48          2HB       GLN  48  -0.185  11.855  -1.511
  379   2HB   GLN  48          1HB       GLN  48  -1.757  12.125  -2.263
  380   1HG   GLN  48          2HG       GLN  48  -1.942  11.665   0.180
  381   2HG   GLN  48          1HG       GLN  48  -2.783  10.460  -0.796
  382   1HE2  GLN  48          1HE2      GLN  48   0.718  10.369  -0.767
  383   2HE2  GLN  48          2HE2      GLN  48   0.869   8.999   0.224
  384    H    ASN  49           H        ASN  49  -1.933  11.901  -4.361
  385    HA   ASN  49           HA       ASN  49  -4.424  10.482  -4.815
  386   1HB   ASN  49          2HB       ASN  49  -4.693  12.215  -6.659
  387   2HB   ASN  49          1HB       ASN  49  -4.467  12.870  -5.037
  388   1HD2  ASN  49          1HD2      ASN  49  -2.600  14.153  -4.654
  389   2HD2  ASN  49          2HD2      ASN  49  -1.418  14.459  -5.833
  390    H    SER  50           H        SER  50  -1.265  10.265  -6.179
  391    HA   SER  50           HA       SER  50  -1.970   9.391  -8.817
  392   1HB   SER  50          2HB       SER  50   0.284   8.670  -9.026
  393   2HB   SER  50          1HB       SER  50   0.350  10.063  -7.951
  394    HG   SER  50           HG       SER  50   0.735   7.353  -7.432
  395    H    ILE  51           H        ILE  51  -1.659   7.659  -5.733
  396    HA   ILE  51           HA       ILE  51  -1.969   5.043  -6.921
  397    HB   ILE  51           HB       ILE  51  -2.099   6.156  -4.125
  398   1HG1  ILE  51          2HG1      ILE  51   0.088   5.582  -4.398
  399   2HG1  ILE  51          1HG1      ILE  51  -0.491   3.988  -3.997
  400   1HG2  ILE  51          1HG2      ILE  51  -2.607   3.227  -4.615
  401   2HG2  ILE  51          2HG2      ILE  51  -3.946   4.362  -4.501
  402   3HG2  ILE  51          3HG2      ILE  51  -2.851   4.154  -3.143
  403   1HD1  ILE  51          1HD1      ILE  51   0.801   3.657  -5.939
  404   2HD1  ILE  51          2HD1      ILE  51   0.163   5.108  -6.712
  405   3HD1  ILE  51          3HD1      ILE  51  -0.858   3.682  -6.534
  406    H    ARG  52           H        ARG  52  -4.252   7.114  -5.083
  407    HA   ARG  52           HA       ARG  52  -6.517   5.512  -5.328
  408   1HB   ARG  52          2HB       ARG  52  -6.135   8.003  -4.400
  409   2HB   ARG  52          1HB       ARG  52  -6.890   8.406  -5.943
  410   1HG   ARG  52          2HG       ARG  52  -8.125   6.274  -4.231
  411   2HG   ARG  52          1HG       ARG  52  -8.392   7.970  -3.818
  412   1HD   ARG  52          2HD       ARG  52  -9.275   8.414  -6.049
  413   2HD   ARG  52          1HD       ARG  52  -8.920   6.761  -6.548
  414    HE   ARG  52           HE       ARG  52 -10.850   6.043  -5.377
  415   1HH1  ARG  52          1HH1      ARG  52 -10.956   9.332  -5.670
  416   2HH1  ARG  52          2HH1      ARG  52 -11.945   9.627  -4.280
  417   1HH2  ARG  52          1HH2      ARG  52 -11.691   6.383  -3.082
  418   2HH2  ARG  52          2HH2      ARG  52 -12.360   7.958  -2.814
  419    H    HIS  53           H        HIS  53  -5.278   7.832  -7.750
  420    HA   HIS  53           HA       HIS  53  -7.295   7.069  -9.705
  421   1HB   HIS  53          2HB       HIS  53  -5.702   9.250  -9.412
  422   2HB   HIS  53          1HB       HIS  53  -4.810   8.368 -10.652
  423    HD1  HIS  53           HD1      HIS  53  -8.019  10.182 -10.037
  424    HD2  HIS  53           HD2      HIS  53  -6.249   8.003 -13.119
  425    HE1  HIS  53           HE1      HIS  53  -9.414  10.607 -12.107
  426    H    ASN  54           H        ASN  54  -4.119   5.863  -8.851
  427    HA   ASN  54           HA       ASN  54  -3.536   4.625 -11.394
  428   1HB   ASN  54          2HB       ASN  54  -2.315   4.790  -8.775
  429   2HB   ASN  54          1HB       ASN  54  -2.256   3.133  -9.380
  430   1HD2  ASN  54          1HD2      ASN  54  -0.642   6.108  -9.524
  431   2HD2  ASN  54          2HD2      ASN  54   0.247   5.842 -10.944
  432    H    LEU  55           H        LEU  55  -5.197   3.521  -8.464
  433    HA   LEU  55           HA       LEU  55  -5.420   0.781  -9.370
  434   1HB   LEU  55          2HB       LEU  55  -6.894   2.332  -7.224
  435   2HB   LEU  55          1HB       LEU  55  -7.121   0.613  -7.514
  436    HG   LEU  55           HG       LEU  55  -5.546   0.660  -5.839
  437   1HD1  LEU  55          1HD1      LEU  55  -3.348   0.121  -6.833
  438   2HD1  LEU  55          2HD1      LEU  55  -3.927   0.725  -8.377
  439   3HD1  LEU  55          3HD1      LEU  55  -4.672  -0.693  -7.645
  440   1HD2  LEU  55          1HD2      LEU  55  -5.316   3.200  -6.126
  441   2HD2  LEU  55          2HD2      LEU  55  -3.916   2.798  -7.123
  442   3HD2  LEU  55          3HD2      LEU  55  -3.967   2.304  -5.430
  443    H    SER  56           H        SER  56  -6.790   3.544 -10.545
  444    HA   SER  56           HA       SER  56  -9.425   2.345 -11.130
  445   1HB   SER  56          2HB       SER  56  -9.748   4.617 -10.794
  446   2HB   SER  56          1HB       SER  56  -8.172   5.044 -11.454
  447    HG   SER  56           HG       SER  56 -10.430   4.109 -12.907
  448    H    LEU  57           H        LEU  57  -6.636   3.636 -12.969
  449    HA   LEU  57           HA       LEU  57  -7.619   2.216 -15.364
  450   1HB   LEU  57          2HB       LEU  57  -5.445   3.328 -16.345
  451   2HB   LEU  57          1HB       LEU  57  -6.880   4.305 -16.042
  452    HG   LEU  57           HG       LEU  57  -5.965   5.045 -13.897
  453   1HD1  LEU  57          1HD1      LEU  57  -3.535   4.408 -13.419
  454   2HD1  LEU  57          2HD1      LEU  57  -3.734   3.134 -14.621
  455   3HD1  LEU  57          3HD1      LEU  57  -4.726   3.134 -13.163
  456   1HD2  LEU  57          1HD2      LEU  57  -4.261   6.474 -14.746
  457   2HD2  LEU  57          2HD2      LEU  57  -5.304   6.132 -16.126
  458   3HD2  LEU  57          3HD2      LEU  57  -3.765   5.289 -15.956
  459    H    ASN  58           H        ASN  58  -5.659   1.379 -12.758
  460    HA   ASN  58           HA       ASN  58  -3.487   0.080 -14.091
  461   1HB   ASN  58          2HB       ASN  58  -4.598  -0.018 -11.377
  462   2HB   ASN  58          1HB       ASN  58  -4.013  -1.584 -11.927
  463   1HD2  ASN  58          1HD2      ASN  58  -2.846   1.786 -12.506
  464   2HD2  ASN  58          2HD2      ASN  58  -1.250   1.466 -12.024
  465    H    ARG  59           H        ARG  59  -3.233  -2.167 -14.657
  466    HA   ARG  59           HA       ARG  59  -5.722  -3.290 -15.769
  467   1HB   ARG  59          2HB       ARG  59  -3.809  -3.195 -17.250
  468   2HB   ARG  59          1HB       ARG  59  -2.810  -4.063 -16.084
  469   1HG   ARG  59          2HG       ARG  59  -3.453  -5.983 -17.062
  470   2HG   ARG  59          1HG       ARG  59  -5.087  -5.675 -16.476
  471   1HD   ARG  59          2HD       ARG  59  -5.599  -4.396 -18.508
  472   2HD   ARG  59          1HD       ARG  59  -3.952  -4.639 -19.089
  473    HE   ARG  59           HE       ARG  59  -4.625  -6.769 -19.818
  474   1HH1  ARG  59          1HH1      ARG  59  -7.501  -5.791 -19.582
  475   2HH1  ARG  59          2HH1      ARG  59  -8.209  -7.056 -18.635
  476   1HH2  ARG  59          1HH2      ARG  59  -5.161  -8.345 -17.597
  477   2HH2  ARG  59          2HH2      ARG  59  -6.884  -8.504 -17.512
  478    H    TYR  60           H        TYR  60  -3.425  -3.999 -13.193
  479    HA   TYR  60           HA       TYR  60  -4.674  -6.666 -12.816
  480   1HB   TYR  60          2HB       TYR  60  -2.855  -6.198 -10.709
  481   2HB   TYR  60          1HB       TYR  60  -2.629  -7.248 -12.102
  482    HD1  TYR  60           HD1      TYR  60  -1.658  -4.153 -10.487
  483    HD2  TYR  60           HD2      TYR  60  -1.616  -6.297 -14.208
  484    HE1  TYR  60           HE1      TYR  60   0.144  -2.670 -11.323
  485    HE2  TYR  60           HE2      TYR  60   0.183  -4.814 -15.047
  486    HH   TYR  60           HH       TYR  60   0.885  -2.156 -14.271
  487    H    PHE  61           H        PHE  61  -4.338  -3.562 -11.094
  488    HA   PHE  61           HA       PHE  61  -5.803  -4.575  -8.796
  489   1HB   PHE  61          2HB       PHE  61  -5.313  -1.686  -9.544
  490   2HB   PHE  61          1HB       PHE  61  -5.703  -2.319  -7.940
  491    HD1  PHE  61           HD1      PHE  61  -4.090  -4.352  -7.192
  492    HD2  PHE  61           HD2      PHE  61  -3.095  -1.237  -9.957
  493    HE1  PHE  61           HE1      PHE  61  -1.697  -4.750  -6.777
  494    HE2  PHE  61           HE2      PHE  61  -0.701  -1.623  -9.549
  495    HZ   PHE  61           HZ       PHE  61   0.019  -3.388  -7.952
  496    H    ILE  62           H        ILE  62  -7.862  -3.949  -8.150
  497    HA   ILE  62           HA       ILE  62  -9.669  -2.629 -10.074
  498    HB   ILE  62           HB       ILE  62 -11.214  -4.569 -10.150
  499   1HG1  ILE  62          2HG1      ILE  62  -9.012  -6.291  -9.039
  500   2HG1  ILE  62          1HG1      ILE  62 -10.115  -5.471  -7.929
  501   1HG2  ILE  62          1HG2      ILE  62 -10.022  -5.807 -11.786
  502   2HG2  ILE  62          2HG2      ILE  62  -8.474  -5.522 -10.991
  503   3HG2  ILE  62          3HG2      ILE  62  -9.289  -4.204 -11.832
  504   1HD1  ILE  62          1HD1      ILE  62 -10.596  -7.902  -9.198
  505   2HD1  ILE  62          2HD1      ILE  62 -11.527  -6.744 -10.150
  506   3HD1  ILE  62          3HD1      ILE  62 -11.810  -6.888  -8.416
  507    H    LYS  63           H        LYS  63 -11.777  -2.145  -9.030
  508    HA   LYS  63           HA       LYS  63 -11.436  -1.654  -6.191
  509   1HB   LYS  63          2HB       LYS  63 -13.559  -1.066  -8.196
  510   2HB   LYS  63          1HB       LYS  63 -14.067  -1.184  -6.509
  511   1HG   LYS  63          2HG       LYS  63 -11.860   0.332  -6.190
  512   2HG   LYS  63          1HG       LYS  63 -12.319   0.832  -7.818
  513   1HD   LYS  63          2HD       LYS  63 -13.414   2.290  -6.196
  514   2HD   LYS  63          1HD       LYS  63 -14.629   1.286  -6.988
  515   1HE   LYS  63          2HE       LYS  63 -15.294   0.808  -4.863
  516   2HE   LYS  63          1HE       LYS  63 -13.922  -0.299  -4.868
  517   1HZ   LYS  63          1HZ       LYS  63 -12.543   1.482  -3.972
  518   2HZ   LYS  63          2HZ       LYS  63 -13.854   1.145  -2.945
  519   3HZ   LYS  63          3HZ       LYS  63 -13.882   2.522  -3.940
  520    H    VAL  64           H        VAL  64 -13.476  -2.275  -4.752
  521    HA   VAL  64           HA       VAL  64 -13.603  -5.237  -4.886
  522    HB   VAL  64           HB       VAL  64 -14.039  -3.166  -2.757
  523   1HG1  VAL  64          1HG1      VAL  64 -14.925  -6.047  -2.518
  524   2HG1  VAL  64          2HG1      VAL  64 -16.021  -4.675  -2.687
  525   3HG1  VAL  64          3HG1      VAL  64 -14.995  -4.815  -1.260
  526   1HG2  VAL  64          1HG2      VAL  64 -11.821  -4.318  -3.225
  527   2HG2  VAL  64          2HG2      VAL  64 -12.583  -5.822  -2.710
  528   3HG2  VAL  64          3HG2      VAL  64 -12.408  -4.488  -1.572
  529    HA   PRO  65           HA       PRO  65 -17.723  -4.971  -6.457
  530   1HB   PRO  65          2HB       PRO  65 -18.377  -7.618  -6.109
  531   2HB   PRO  65          1HB       PRO  65 -17.352  -7.023  -7.424
  532   1HG   PRO  65          2HG       PRO  65 -16.565  -8.492  -4.950
  533   2HG   PRO  65          1HG       PRO  65 -15.763  -8.444  -6.528
  534   1HD   PRO  65          2HD       PRO  65 -14.965  -7.003  -4.232
  535   2HD   PRO  65          1HD       PRO  65 -14.412  -6.702  -5.894
  536    H    ARG  66           H        ARG  66 -19.946  -5.198  -5.680
  537    HA   ARG  66           HA       ARG  66 -20.466  -6.108  -2.960
  538   1HB   ARG  66          2HB       ARG  66 -19.382  -3.833  -2.655
  539   2HB   ARG  66          1HB       ARG  66 -20.761  -3.145  -3.513
  540   1HG   ARG  66          2HG       ARG  66 -22.286  -4.158  -1.830
  541   2HG   ARG  66          1HG       ARG  66 -20.880  -4.757  -0.948
  542   1HD   ARG  66          2HD       ARG  66 -21.160  -2.768   0.176
  543   2HD   ARG  66          1HD       ARG  66 -20.156  -2.184  -1.151
  544    HE   ARG  66           HE       ARG  66 -22.949  -2.075  -1.866
  545   1HH1  ARG  66          1HH2      ARG  66 -20.247  -0.449  -0.511
  546   2HH1  ARG  66          2HH2      ARG  66 -21.071   1.063  -0.328
  547   1HH2  ARG  66          1HH1      ARG  66 -24.125  -0.164  -1.410
  548   2HH2  ARG  66          2HH1      ARG  66 -23.263   1.224  -0.837
  549    H    SER  67           H        SER  67 -21.613  -6.919  -5.329
  550    HA   SER  67           HA       SER  67 -24.070  -5.407  -5.835
  551   1HB   SER  67          2HB       SER  67 -24.398  -6.845  -7.617
  552   2HB   SER  67          1HB       SER  67 -22.654  -7.002  -7.432
  553    HG   SER  67           HG       SER  67 -23.011  -9.024  -7.040
  554    H    GLN  68           H        GLN  68 -23.187  -8.460  -4.227
  555    HA   GLN  68           HA       GLN  68 -25.728  -8.285  -2.704
  556   1HB   GLN  68          2HB       GLN  68 -25.089 -10.293  -4.739
  557   2HB   GLN  68          1HB       GLN  68 -25.492 -11.006  -3.176
  558   1HG   GLN  68          2HG       GLN  68 -27.529  -9.492  -3.131
  559   2HG   GLN  68          1HG       GLN  68 -27.169  -9.088  -4.810
  560   1HE2  GLN  68          1HE2      GLN  68 -26.596 -11.359  -6.093
  561   2HE2  GLN  68          2HE2      GLN  68 -27.789 -12.550  -5.890
  562    H    GLU  69           H        GLU  69 -23.202 -10.793  -3.062
  563    HA   GLU  69           HA       GLU  69 -22.817 -10.670  -0.115
  564   1HB   GLU  69          2HB       GLU  69 -21.863 -12.704  -2.155
  565   2HB   GLU  69          1HB       GLU  69 -21.633 -12.823  -0.410
  566   1HG   GLU  69          2HG       GLU  69 -24.418 -12.317  -1.224
  567   2HG   GLU  69          1HG       GLU  69 -23.779 -13.869  -1.764
  568    H    GLU  70           H        GLU  70 -20.238 -11.579   0.145
  569    HA   GLU  70           HA       GLU  70 -18.556  -9.656  -1.394
  570   1HB   GLU  70          2HB       GLU  70 -19.029  -9.755   1.544
  571   2HB   GLU  70          1HB       GLU  70 -17.366  -9.493   1.020
  572   1HG   GLU  70          2HG       GLU  70 -18.635  -7.774  -0.636
  573   2HG   GLU  70          1HG       GLU  70 -19.737  -7.728   0.740
  574    HA   PRO  71           HA       PRO  71 -15.706 -12.993  -1.534
  575   1HB   PRO  71          2HB       PRO  71 -13.342 -11.596  -1.688
  576   2HB   PRO  71          1HB       PRO  71 -14.486 -11.733  -3.034
  577   1HG   PRO  71          2HG       PRO  71 -13.949  -9.400  -1.259
  578   2HG   PRO  71          1HG       PRO  71 -14.565  -9.427  -2.918
  579   1HD   PRO  71          2HD       PRO  71 -16.115  -9.046  -0.578
  580   2HD   PRO  71          1HD       PRO  71 -16.742  -9.396  -2.203
  581    H    GLY  72           H        GLY  72 -15.372 -10.576   0.974
  582   1HA   GLY  72          2HA       GLY  72 -14.566 -12.569   2.921
  583   2HA   GLY  72          1HA       GLY  72 -13.238 -11.479   2.510
  584    H    LYS  73           H        LYS  73 -13.084  -9.846   3.969
  585    HA   LYS  73           HA       LYS  73 -15.600  -8.518   4.854
  586   1HB   LYS  73          2HB       LYS  73 -14.878 -10.097   6.638
  587   2HB   LYS  73          1HB       LYS  73 -13.318  -9.277   6.705
  588   1HG   LYS  73          2HG       LYS  73 -14.490  -7.150   7.256
  589   2HG   LYS  73          1HG       LYS  73 -16.022  -8.025   7.271
  590   1HD   LYS  73          2HD       LYS  73 -14.296  -9.524   8.912
  591   2HD   LYS  73          1HD       LYS  73 -14.014  -7.837   9.349
  592   1HE   LYS  73          2HE       LYS  73 -16.737  -7.871   9.145
  593   2HE   LYS  73          1HE       LYS  73 -16.424  -9.503   9.735
  594   1HZ   LYS  73          1HZ       LYS  73 -15.505  -6.965  10.969
  595   2HZ   LYS  73          2HZ       LYS  73 -15.046  -8.513  11.500
  596   3HZ   LYS  73          3HZ       LYS  73 -16.672  -8.029  11.587
  597    H    GLY  74           H        GLY  74 -14.657  -7.084   3.072
  598   1HA   GLY  74          2HA       GLY  74 -13.164  -4.907   4.350
  599   2HA   GLY  74          1HA       GLY  74 -12.306  -5.691   3.023
  600    H    SER  75           H        SER  75 -12.998  -3.015   2.766
  601    HA   SER  75           HA       SER  75 -14.978  -3.175   0.556
  602   1HB   SER  75          2HB       SER  75 -15.080  -1.112   2.775
  603   2HB   SER  75          1HB       SER  75 -16.090  -1.110   1.332
  604    HG   SER  75           HG       SER  75 -17.076  -2.096   3.197
  605    H    PHE  76           H        PHE  76 -13.043  -2.948  -0.774
  606    HA   PHE  76           HA       PHE  76 -12.464  -0.231  -1.444
  607   1HB   PHE  76          2HB       PHE  76  -9.951  -0.487  -0.871
  608   2HB   PHE  76          1HB       PHE  76 -11.082  -0.002   0.377
  609    HD1  PHE  76           HD1      PHE  76 -10.536  -3.405  -1.076
  610    HD2  PHE  76           HD2      PHE  76 -10.180  -0.866   2.370
  611    HE1  PHE  76           HE1      PHE  76  -9.907  -5.364   0.302
  612    HE2  PHE  76           HE2      PHE  76  -9.548  -2.827   3.748
  613    HZ   PHE  76           HZ       PHE  76  -9.414  -5.077   2.713
  614    H    TRP  77           H        TRP  77  -9.534  -1.519  -2.104
  615    HA   TRP  77           HA       TRP  77 -10.586  -3.084  -4.407
  616   1HB   TRP  77          2HB       TRP  77  -8.839  -1.922  -5.825
  617   2HB   TRP  77          1HB       TRP  77 -10.163  -0.890  -5.297
  618    HD1  TRP  77           HD1      TRP  77  -9.648   0.835  -3.274
  619    HE1  TRP  77           HE1      TRP  77  -7.430   1.936  -2.591
  620    HE3  TRP  77           HE3      TRP  77  -6.407  -2.267  -5.647
  621    HZ2  TRP  77           HZ2      TRP  77  -4.633   1.557  -3.013
  622    HZ3  TRP  77           HZ3      TRP  77  -3.961  -1.874  -5.510
  623    HH2  TRP  77           HH2      TRP  77  -3.101   0.049  -4.213
  624    H    ARG  78           H        ARG  78  -8.467  -4.001  -5.619
  625    HA   ARG  78           HA       ARG  78  -6.305  -4.752  -3.796
  626   1HB   ARG  78          2HB       ARG  78  -6.811  -7.168  -3.884
  627   2HB   ARG  78          1HB       ARG  78  -8.132  -6.287  -3.118
  628   1HG   ARG  78          2HG       ARG  78  -8.906  -6.167  -5.724
  629   2HG   ARG  78          1HG       ARG  78  -8.072  -7.721  -5.708
  630   1HD   ARG  78          2HD       ARG  78  -9.498  -7.959  -3.426
  631   2HD   ARG  78          1HD       ARG  78 -10.578  -6.903  -4.338
  632    HE   ARG  78           HE       ARG  78  -9.586  -9.364  -5.671
  633   1HH1  ARG  78          1HH2      ARG  78 -11.935  -8.508  -3.441
  634   2HH1  ARG  78          2HH2      ARG  78 -13.282  -9.055  -4.380
  635   1HH2  ARG  78          1HH1      ARG  78 -11.396  -9.658  -7.227
  636   2HH2  ARG  78          2HH1      ARG  78 -12.978  -9.707  -6.523
  637    H    ILE  79           H        ILE  79  -5.501  -7.061  -5.214
  638    HA   ILE  79           HA       ILE  79  -4.850  -5.869  -7.876
  639    HB   ILE  79           HB       ILE  79  -2.763  -6.301  -7.033
  640   1HG1  ILE  79          2HG1      ILE  79  -3.640  -9.036  -7.984
  641   2HG1  ILE  79          1HG1      ILE  79  -2.809  -7.796  -8.923
  642   1HG2  ILE  79          1HG2      ILE  79  -3.673  -7.016  -4.844
  643   2HG2  ILE  79          2HG2      ILE  79  -2.266  -7.959  -5.333
  644   3HG2  ILE  79          3HG2      ILE  79  -3.885  -8.641  -5.491
  645   1HD1  ILE  79          1HD1      ILE  79  -0.888  -7.953  -7.330
  646   2HD1  ILE  79          2HD1      ILE  79  -1.190  -9.461  -8.188
  647   3HD1  ILE  79          3HD1      ILE  79  -1.712  -9.281  -6.519
  648    H    ASP  80           H        ASP  80  -4.692  -7.536  -9.671
  649    HA   ASP  80           HA       ASP  80  -7.166  -8.972  -9.832
  650   1HB   ASP  80          2HB       ASP  80  -4.868  -8.473 -11.563
  651   2HB   ASP  80          1HB       ASP  80  -5.521 -10.100 -11.762
  652    HA   PRO  81           HA       PRO  81  -6.093 -12.799  -8.034
  653   1HB   PRO  81          2HB       PRO  81  -7.735 -14.465  -9.480
  654   2HB   PRO  81          1HB       PRO  81  -8.314 -13.364  -8.218
  655   1HG   PRO  81          2HG       PRO  81  -8.568 -13.122 -11.178
  656   2HG   PRO  81          1HG       PRO  81  -9.589 -12.434  -9.904
  657   1HD   PRO  81          2HD       PRO  81  -7.606 -11.051 -11.391
  658   2HD   PRO  81          1HD       PRO  81  -8.426 -10.455  -9.931
  659    H    ALA  82           H        ALA  82  -6.483 -13.327 -11.567
  660    HA   ALA  82           HA       ALA  82  -4.229 -15.236 -11.495
  661   1HB   ALA  82          1HB       ALA  82  -5.354 -14.595 -14.118
  662   2HB   ALA  82          2HB       ALA  82  -6.574 -15.115 -12.957
  663   3HB   ALA  82          3HB       ALA  82  -5.196 -16.156 -13.316
  664    H    SER  83           H        SER  83  -3.915 -12.175 -11.266
  665    HA   SER  83           HA       SER  83  -1.960 -11.972 -13.513
  666   1HB   SER  83          2HB       SER  83  -3.025  -9.522 -12.161
  667   2HB   SER  83          1HB       SER  83  -2.433  -9.715 -13.806
  668    HG   SER  83           HG       SER  83  -4.411 -11.243 -13.861
  669    H    GLU  84           H        GLU  84  -2.413 -12.251 -10.194
  670    HA   GLU  84           HA       GLU  84  -0.295 -10.549  -9.263
  671   1HB   GLU  84          2HB       GLU  84  -2.016 -11.325  -7.720
  672   2HB   GLU  84          1HB       GLU  84  -1.556 -13.003  -8.008
  673   1HG   GLU  84          2HG       GLU  84   0.563 -12.706  -6.952
  674   2HG   GLU  84          1HG       GLU  84   0.396 -10.950  -6.951
  675    H    ALA  85           H        ALA  85  -0.074 -13.226 -11.215
  676    HA   ALA  85           HA       ALA  85   2.449 -14.162  -9.953
  677   1HB   ALA  85          1HB       ALA  85   1.341 -16.028 -10.813
  678   2HB   ALA  85          2HB       ALA  85   2.393 -15.621 -12.168
  679   3HB   ALA  85          3HB       ALA  85   0.697 -15.138 -12.192
  680    H    LYS  86           H        LYS  86   1.294 -12.390 -12.788
  681    HA   LYS  86           HA       LYS  86   4.066 -12.054 -13.770
  682   1HB   LYS  86          2HB       LYS  86   1.794 -12.401 -15.145
  683   2HB   LYS  86          1HB       LYS  86   1.772 -10.640 -15.043
  684   1HG   LYS  86          2HG       LYS  86   4.436 -11.463 -15.688
  685   2HG   LYS  86          1HG       LYS  86   3.324 -12.273 -16.791
  686   1HD   LYS  86          2HD       LYS  86   3.751 -10.215 -17.859
  687   2HD   LYS  86          1HD       LYS  86   2.211  -9.944 -17.043
  688   1HE   LYS  86          2HE       LYS  86   4.573  -9.368 -15.379
  689   2HE   LYS  86          1HE       LYS  86   4.407  -8.319 -16.788
  690   1HZ   LYS  86          1HZ       LYS  86   2.292  -8.849 -14.771
  691   2HZ   LYS  86          2HZ       LYS  86   2.143  -7.830 -16.123
  692   3HZ   LYS  86          3HZ       LYS  86   3.223  -7.435 -14.874
  693    H    LEU  87           H        LEU  87   1.484 -10.138 -12.268
  694    HA   LEU  87           HA       LEU  87   2.838  -7.611 -12.640
  695   1HB   LEU  87          2HB       LEU  87   1.185  -6.742 -10.994
  696   2HB   LEU  87          1HB       LEU  87   0.439  -7.659 -12.285
  697    HG   LEU  87           HG       LEU  87   0.788  -9.664 -10.544
  698   1HD1  LEU  87          1HD1      LEU  87   1.776  -7.897  -8.942
  699   2HD1  LEU  87          2HD1      LEU  87   0.573  -9.010  -8.302
  700   3HD1  LEU  87          3HD1      LEU  87   0.108  -7.364  -8.738
  701   1HD2  LEU  87          1HD2      LEU  87  -1.553  -9.421  -9.987
  702   2HD2  LEU  87          2HD2      LEU  87  -1.357  -8.769 -11.611
  703   3HD2  LEU  87          3HD2      LEU  87  -1.484  -7.677 -10.233
  704    H    VAL  88           H        VAL  88   3.286 -10.210 -10.611
  705    HA   VAL  88           HA       VAL  88   4.469  -8.690  -8.407
  706    HB   VAL  88           HB       VAL  88   5.016 -11.022  -7.642
  707   1HG1  VAL  88          1HG1      VAL  88   2.690 -11.508  -7.014
  708   2HG1  VAL  88          2HG1      VAL  88   2.134 -10.383  -8.253
  709   3HG1  VAL  88          3HG1      VAL  88   3.039  -9.786  -6.862
  710   1HG2  VAL  88          1HG2      VAL  88   4.033 -12.886  -8.803
  711   2HG2  VAL  88          2HG2      VAL  88   4.964 -11.960  -9.978
  712   3HG2  VAL  88          3HG2      VAL  88   3.213 -11.807  -9.924
  713    H    GLU  89           H        GLU  89   5.508 -10.497 -11.240
  714    HA   GLU  89           HA       GLU  89   8.211 -10.958 -10.586
  715   1HB   GLU  89          2HB       GLU  89   6.611 -10.937 -12.981
  716   2HB   GLU  89          1HB       GLU  89   8.147 -10.133 -13.304
  717   1HG   GLU  89          2HG       GLU  89   8.705 -12.364 -13.697
  718   2HG   GLU  89          1HG       GLU  89   9.168 -12.179 -12.004
  719    H    GLN  90           H        GLN  90   6.571  -8.002 -11.517
  720    HA   GLN  90           HA       GLN  90   9.127  -6.526 -11.693
  721   1HB   GLN  90          2HB       GLN  90   6.632  -6.172 -12.871
  722   2HB   GLN  90          1HB       GLN  90   6.672  -4.930 -11.619
  723   1HG   GLN  90          2HG       GLN  90   7.622  -4.025 -13.678
  724   2HG   GLN  90          1HG       GLN  90   8.896  -4.192 -12.470
  725   1HE2  GLN  90          1HE2      GLN  90   7.461  -6.846 -14.404
  726   2HE2  GLN  90          2HE2      GLN  90   8.899  -7.242 -15.216
  727    H    ALA  91           H        ALA  91   6.583  -7.249  -9.456
  728    HA   ALA  91           HA       ALA  91   6.736  -5.106  -7.655
  729   1HB   ALA  91          1HB       ALA  91   6.508  -7.923  -6.674
  730   2HB   ALA  91          2HB       ALA  91   5.215  -7.190  -7.623
  731   3HB   ALA  91          3HB       ALA  91   5.694  -6.473  -6.086
  732    H    PHE  92           H        PHE  92   8.634  -8.143  -7.509
  733    HA   PHE  92           HA       PHE  92  10.444  -6.891  -5.538
  734   1HB   PHE  92          2HB       PHE  92  11.033  -9.548  -6.787
  735   2HB   PHE  92          1HB       PHE  92  11.254  -9.021  -5.119
  736    HD1  PHE  92           HD1      PHE  92   9.556 -11.353  -6.828
  737    HD2  PHE  92           HD2      PHE  92   8.697  -7.990  -4.297
  738    HE1  PHE  92           HE1      PHE  92   7.377 -12.367  -6.219
  739    HE2  PHE  92           HE2      PHE  92   6.518  -9.004  -3.688
  740    HZ   PHE  92           HZ       PHE  92   5.857 -11.193  -4.649
  741    H    ARG  93           H        ARG  93  10.601  -5.418  -7.824
  742    HA   ARG  93           HA       ARG  93  13.290  -6.179  -8.863
  743   1HB   ARG  93          2HB       ARG  93  10.880  -6.211 -10.372
  744   2HB   ARG  93          1HB       ARG  93  11.815  -4.818 -10.916
  745   1HG   ARG  93          2HG       ARG  93  13.410  -6.117 -11.869
  746   2HG   ARG  93          1HG       ARG  93  13.441  -7.230 -10.500
  747   1HD   ARG  93          2HD       ARG  93  12.029  -8.677 -11.514
  748   2HD   ARG  93          1HD       ARG  93  10.946  -7.382 -12.024
  749    HE   ARG  93           HE       ARG  93  13.262  -7.239 -13.651
  750   1HH1  ARG  93          1HH1      ARG  93  10.298  -8.890 -13.170
  751   2HH1  ARG  93          2HH1      ARG  93  10.396  -9.790 -14.646
  752   1HH2  ARG  93          1HH2      ARG  93  13.543  -8.592 -15.479
  753   2HH2  ARG  93          2HH2      ARG  93  12.232  -9.620 -15.954
  754    H    LYS  94           H        LYS  94  14.643  -4.396  -9.298
  755    HA   LYS  94           HA       LYS  94  13.842  -1.893  -7.984
  756   1HB   LYS  94          2HB       LYS  94  16.421  -2.681  -9.378
  757   2HB   LYS  94          1HB       LYS  94  16.181  -1.205  -8.441
  758   1HG   LYS  94          2HG       LYS  94  16.434  -2.294  -6.479
  759   2HG   LYS  94          1HG       LYS  94  15.357  -3.598  -6.978
  760   1HD   LYS  94          2HD       LYS  94  17.081  -4.935  -7.575
  761   2HD   LYS  94          1HD       LYS  94  17.910  -3.624  -8.415
  762   1HE   LYS  94          2HE       LYS  94  19.174  -3.080  -6.593
  763   2HE   LYS  94          1HE       LYS  94  17.861  -3.407  -5.461
  764   1HZ   LYS  94          1HZ       LYS  94  18.954  -5.268  -4.995
  765   2HZ   LYS  94          2HZ       LYS  94  19.974  -5.124  -6.347
  766   3HZ   LYS  94          3HZ       LYS  94  18.444  -5.848  -6.505
  767    H    ARG  95           H        ARG  95  13.851   0.175  -9.076
  768    HA   ARG  95           HA       ARG  95  12.905  -0.018 -11.853
  769   1HB   ARG  95          2HB       ARG  95  11.879   1.492 -10.065
  770   2HB   ARG  95          1HB       ARG  95  13.313   2.505 -10.232
  771   1HG   ARG  95          2HG       ARG  95  11.876   3.509 -11.767
  772   2HG   ARG  95          1HG       ARG  95  12.743   2.374 -12.802
  773   1HD   ARG  95          2HD       ARG  95  10.896   0.708 -12.390
  774   2HD   ARG  95          1HD       ARG  95  10.006   1.984 -11.561
  775    HE   ARG  95           HE       ARG  95  10.027   1.654 -14.355
  776   1HH1  ARG  95          1HH1      ARG  95  10.031   4.007 -11.879
  777   2HH1  ARG  95          2HH1      ARG  95   9.899   5.356 -12.958
  778   1HH2  ARG  95          1HH2      ARG  95  10.155   3.426 -15.827
  779   2HH2  ARG  95          2HH2      ARG  95   9.969   5.027 -15.193
  780    H    ARG  96           H        ARG  96  14.591  -0.323 -13.275
  781    HA   ARG  96           HA       ARG  96  16.451   1.885 -13.672
  782   1HB   ARG  96          2HB       ARG  96  18.494   0.418 -13.473
  783   2HB   ARG  96          1HB       ARG  96  17.705   0.763 -11.934
  784   1HG   ARG  96          2HG       ARG  96  17.466  -1.443 -11.580
  785   2HG   ARG  96          1HG       ARG  96  16.457  -1.553 -13.023
  786   1HD   ARG  96          2HD       ARG  96  18.150  -2.983 -13.661
  787   2HD   ARG  96          1HD       ARG  96  18.842  -1.465 -14.231
  788    HE   ARG  96           HE       ARG  96  20.563  -1.843 -12.681
  789   1HH1  ARG  96          1HH1      ARG  96  19.534  -4.650 -12.149
  790   2HH1  ARG  96          2HH1      ARG  96  19.338  -4.622 -10.429
  791   1HH2  ARG  96          1HH2      ARG  96  19.476  -1.162 -10.207
  792   2HH2  ARG  96          2HH2      ARG  96  19.305  -2.645  -9.328
  793    H    GLN  97           H        GLN  97  18.098   1.108 -15.510
  794    HA   GLN  97           HA       GLN  97  16.508  -0.561 -17.421
  795   1HB   GLN  97          2HB       GLN  97  17.013   2.065 -17.758
  796   2HB   GLN  97          1HB       GLN  97  18.484   1.401 -18.471
  797   1HG   GLN  97          2HG       GLN  97  17.202   1.227 -20.348
  798   2HG   GLN  97          1HG       GLN  97  16.607  -0.242 -19.572
  799   1HE2  GLN  97          1HE2      GLN  97  15.877   3.252 -19.944
  800   2HE2  GLN  97          2HE2      GLN  97  14.213   3.095 -19.650
  801    H    ARG  98           H        ARG  98  19.857   0.698 -17.415
  802    HA   ARG  98           HA       ARG  98  21.113  -1.808 -16.876
  803   1HB   ARG  98          2HB       ARG  98  20.035  -1.578 -19.516
  804   2HB   ARG  98          1HB       ARG  98  21.793  -1.526 -19.636
  805   1HG   ARG  98          2HG       ARG  98  20.445  -3.584 -17.900
  806   2HG   ARG  98          1HG       ARG  98  20.627  -3.854 -19.634
  807   1HD   ARG  98          2HD       ARG  98  23.113  -3.241 -19.267
  808   2HD   ARG  98          1HD       ARG  98  22.784  -3.501 -17.555
  809    HE   ARG  98           HE       ARG  98  23.191  -5.752 -18.172
  810   1HH1  ARG  98          1HH1      ARG  98  23.378  -5.529 -21.089
  811   2HH1  ARG  98          2HH1      ARG  98  21.963  -6.359 -21.644
  812   1HH2  ARG  98          1HH2      ARG  98  20.363  -6.240 -18.571
  813   2HH2  ARG  98          2HH2      ARG  98  20.255  -6.762 -20.218
  814    H    GLY  99           H        GLY  99  21.388   1.093 -16.399
  815   1HA   GLY  99          1HA       GLY  99  24.107   1.517 -17.574
  816   2HA   GLY  99          2HA       GLY  99  23.026   2.835 -17.122
  817    H    VAL 100           H        VAL 100  22.298   1.033 -14.695
  818    HA   VAL 100           HA       VAL 100  24.779   1.499 -13.101
  819    HB   VAL 100           HB       VAL 100  23.224   2.281 -11.232
  820   1HG1  VAL 100          1HG1      VAL 100  24.579   3.917 -12.335
  821   2HG1  VAL 100          2HG1      VAL 100  22.946   4.580 -12.306
  822   3HG1  VAL 100          3HG1      VAL 100  23.580   3.862 -13.787
  823   1HG2  VAL 100          1HG2      VAL 100  21.242   3.199 -13.196
  824   2HG2  VAL 100          2HG2      VAL 100  20.992   2.492 -11.600
  825   3HG2  VAL 100          3HG2      VAL 100  21.260   1.446 -12.994
  826    H    SER 101           HN       SER 101  25.277  -0.648 -12.713
  827    HA   SER 101           HA       SER 101  23.298  -2.697 -12.275
  828   1HB   SER 101          2HB       SER 101  25.644  -3.142 -13.027
  829   2HB   SER 101          1HB       SER 101  26.210  -2.689 -11.423
  830    HG   SER 101           HG       SER 101  24.483  -4.826 -12.137
  Start of MODEL    2
    1   1H    GLU   1          1HT       GLU   1  18.697   9.482  -5.928
    2   2H    GLU   1          2HT       GLU   1  17.476  10.184  -4.978
    3   3H    GLU   1          3HT       GLU   1  19.110  10.420  -4.576
    4    HA   GLU   1           HA       GLU   1  19.293  12.160  -5.914
    5   1HB   GLU   1          2HB       GLU   1  18.675  12.009  -8.298
    6   2HB   GLU   1          1HB       GLU   1  19.571  10.577  -7.790
    7   1HG   GLU   1          2HG       GLU   1  17.318   9.467  -7.365
    8   2HG   GLU   1          1HG       GLU   1  16.585  10.836  -8.203
    9    H    SER   2           H        SER   2  16.074  10.641  -6.211
   10    HA   SER   2           HA       SER   2  14.834  13.108  -5.222
   11   1HB   SER   2          2HB       SER   2  13.327  12.550  -7.542
   12   2HB   SER   2          1HB       SER   2  14.316  13.973  -7.232
   13    HG   SER   2           HG       SER   2  15.656  13.240  -8.660
   14    H    LYS   3           H        LYS   3  13.486  10.511  -7.269
   15    HA   LYS   3           HA       LYS   3  11.967   9.587  -4.860
   16   1HB   LYS   3          2HB       LYS   3  11.051  10.011  -7.702
   17   2HB   LYS   3          1HB       LYS   3  10.190   8.922  -6.615
   18   1HG   LYS   3          2HG       LYS   3   9.755  10.697  -5.052
   19   2HG   LYS   3          1HG       LYS   3  10.826  11.797  -5.918
   20   1HD   LYS   3          2HD       LYS   3   9.336  11.680  -7.893
   21   2HD   LYS   3          1HD       LYS   3   8.249  10.620  -6.996
   22   1HE   LYS   3          2HE       LYS   3   8.803  12.920  -5.381
   23   2HE   LYS   3          1HE       LYS   3   8.312  13.467  -6.985
   24   1HZ   LYS   3          1HZ       LYS   3   6.576  11.474  -6.509
   25   2HZ   LYS   3          2HZ       LYS   3   6.258  13.118  -6.219
   26   3HZ   LYS   3          3HZ       LYS   3   6.779  12.115  -4.951
   27    HA   PRO   4           HA       PRO   4  14.187   5.924  -6.337
   28   1HB   PRO   4          2HB       PRO   4  14.599   4.908  -3.828
   29   2HB   PRO   4          1HB       PRO   4  15.653   6.103  -4.604
   30   1HG   PRO   4          2HG       PRO   4  13.680   6.491  -2.406
   31   2HG   PRO   4          1HG       PRO   4  15.129   7.435  -2.792
   32   1HD   PRO   4          2HD       PRO   4  12.451   8.151  -3.404
   33   2HD   PRO   4          1HD       PRO   4  13.917   8.938  -4.015
   34    HA   PRO   5           HA       PRO   5  10.690   3.319  -4.322
   35   1HB   PRO   5          2HB       PRO   5   8.195   4.434  -4.593
   36   2HB   PRO   5          1HB       PRO   5   9.195   4.598  -3.142
   37   1HG   PRO   5          2HG       PRO   5   8.571   6.617  -5.223
   38   2HG   PRO   5          1HG       PRO   5   9.097   6.861  -3.549
   39   1HD   PRO   5          2HD       PRO   5  10.699   7.041  -5.899
   40   2HD   PRO   5          1HD       PRO   5  11.260   7.129  -4.220
   41    H    TYR   6           H        TYR   6   8.511   2.406  -5.486
   42    HA   TYR   6           HA       TYR   6   9.270   2.146  -8.314
   43   1HB   TYR   6          2HB       TYR   6   6.969   0.723  -7.024
   44   2HB   TYR   6          1HB       TYR   6   8.030   0.167  -8.320
   45    HD1  TYR   6           HD1      TYR   6  10.661   0.309  -7.578
   46    HD2  TYR   6           HD2      TYR   6   7.312  -0.294  -4.961
   47    HE1  TYR   6           HE1      TYR   6  12.161  -0.733  -5.900
   48    HE2  TYR   6           HE2      TYR   6   8.808  -1.333  -3.291
   49    HH   TYR   6           HH       TYR   6  12.317  -1.595  -3.860
   50    H    SER   7           H        SER   7   7.535   2.143  -9.981
   51    HA   SER   7           HA       SER   7   6.215   4.605 -10.165
   52   1HB   SER   7          2HB       SER   7   5.727   1.932 -11.462
   53   2HB   SER   7          1HB       SER   7   4.645   3.284 -11.785
   54    HG   SER   7           HG       SER   7   6.413   3.162 -13.264
   55    H    TYR   8           H        TYR   8   3.601   4.543 -10.467
   56    HA   TYR   8           HA       TYR   8   2.632   3.783  -7.778
   57   1HB   TYR   8          2HB       TYR   8   1.375   5.476  -9.952
   58   2HB   TYR   8          1HB       TYR   8   0.717   5.250  -8.324
   59    HD1  TYR   8           HD1      TYR   8   3.164   5.202  -6.690
   60    HD2  TYR   8           HD2      TYR   8   2.107   7.745  -9.988
   61    HE1  TYR   8           HE1      TYR   8   4.710   6.940  -5.839
   62    HE2  TYR   8           HE2      TYR   8   3.651   9.486  -9.133
   63    HH   TYR   8           HH       TYR   8   5.490   9.775  -7.717
   64    H    ALA   9           H        ALA   9   3.113   1.847  -9.957
   65    HA   ALA   9           HA       ALA   9   0.400   0.602  -9.973
   66   1HB   ALA   9          1HB       ALA   9   2.050  -0.194 -12.243
   67   2HB   ALA   9          2HB       ALA   9   1.719   1.539 -12.253
   68   3HB   ALA   9          3HB       ALA   9   0.385   0.386 -12.224
   69    H    GLN  10           H        GLN  10   3.906   0.216 -10.129
   70    HA   GLN  10           HA       GLN  10   3.775  -2.667  -9.502
   71   1HB   GLN  10          2HB       GLN  10   5.604  -1.859 -10.955
   72   2HB   GLN  10          1HB       GLN  10   6.112  -0.728  -9.703
   73   1HG   GLN  10          2HG       GLN  10   6.288  -2.851  -8.194
   74   2HG   GLN  10          1HG       GLN  10   6.323  -3.728  -9.725
   75   1HE2  GLN  10          1HE2      GLN  10   7.949  -2.574 -11.397
   76   2HE2  GLN  10          2HE2      GLN  10   9.458  -2.159 -10.740
   77    H    LEU  11           H        LEU  11   4.362   0.443  -8.067
   78    HA   LEU  11           HA       LEU  11   5.314  -0.364  -5.499
   79   1HB   LEU  11          2HB       LEU  11   5.356   1.956  -6.414
   80   2HB   LEU  11          1HB       LEU  11   3.600   2.016  -6.295
   81    HG   LEU  11           HG       LEU  11   4.260   1.251  -3.767
   82   1HD1  LEU  11          1HD1      LEU  11   6.653   1.439  -4.165
   83   2HD1  LEU  11          2HD1      LEU  11   6.151   2.774  -3.125
   84   3HD1  LEU  11          3HD1      LEU  11   6.445   3.054  -4.841
   85   1HD2  LEU  11          1HD2      LEU  11   2.742   3.069  -4.386
   86   2HD2  LEU  11          2HD2      LEU  11   4.105   4.050  -4.924
   87   3HD2  LEU  11          3HD2      LEU  11   3.919   3.662  -3.213
   88    H    ILE  12           H        ILE  12   2.103   0.184  -6.854
   89    HA   ILE  12           HA       ILE  12   0.544  -0.370  -4.503
   90    HB   ILE  12           HB       ILE  12  -0.380  -1.191  -7.216
   91   1HG1  ILE  12          2HG1      ILE  12   0.376   0.814  -8.056
   92   2HG1  ILE  12          1HG1      ILE  12  -1.118   1.386  -7.330
   93   1HG2  ILE  12          1HG2      ILE  12  -2.054   0.559  -5.602
   94   2HG2  ILE  12          2HG2      ILE  12  -1.561  -0.905  -4.750
   95   3HG2  ILE  12          3HG2      ILE  12  -2.409  -1.024  -6.292
   96   1HD1  ILE  12          1HD1      ILE  12   0.726   1.492  -5.236
   97   2HD1  ILE  12          2HD1      ILE  12   0.154   2.856  -6.187
   98   3HD1  ILE  12          3HD1      ILE  12   1.641   2.029  -6.639
   99    H    VAL  13           H        VAL  13   1.448  -2.428  -7.261
  100    HA   VAL  13           HA       VAL  13   0.241  -4.801  -6.467
  101    HB   VAL  13           HB       VAL  13   2.849  -4.288  -7.894
  102   1HG1  VAL  13          1HG1      VAL  13   3.053  -6.495  -6.912
  103   2HG1  VAL  13          2HG1      VAL  13   2.660  -6.692  -8.619
  104   3HG1  VAL  13          3HG1      VAL  13   1.409  -6.908  -7.395
  105   1HG2  VAL  13          1HG2      VAL  13   0.852  -3.551  -9.054
  106   2HG2  VAL  13          2HG2      VAL  13   0.043  -5.080  -8.723
  107   3HG2  VAL  13          3HG2      VAL  13   1.415  -5.031  -9.830
  108    H    GLN  14           H        GLN  14   3.416  -3.565  -5.378
  109    HA   GLN  14           HA       GLN  14   3.897  -5.926  -3.743
  110   1HB   GLN  14          2HB       GLN  14   5.425  -3.743  -4.600
  111   2HB   GLN  14          1HB       GLN  14   5.297  -3.536  -2.853
  112   1HG   GLN  14          2HG       GLN  14   5.883  -6.053  -2.714
  113   2HG   GLN  14          1HG       GLN  14   6.421  -5.877  -4.387
  114   1HE2  GLN  14          1HE2      GLN  14   7.195  -2.974  -3.782
  115   2HE2  GLN  14          2HE2      GLN  14   8.668  -3.100  -2.951
  116    H    ALA  15           H        ALA  15   2.324  -2.835  -3.332
  117    HA   ALA  15           HA       ALA  15   2.212  -2.860  -0.447
  118   1HB   ALA  15          1HB       ALA  15   0.615  -1.068  -0.695
  119   2HB   ALA  15          2HB       ALA  15   0.266  -1.540  -2.357
  120   3HB   ALA  15          3HB       ALA  15   1.838  -0.853  -1.948
  121    H    ILE  16           H        ILE  16   0.105  -4.119  -2.993
  122    HA   ILE  16           HA       ILE  16  -1.930  -4.925  -1.036
  123    HB   ILE  16           HB       ILE  16  -2.293  -6.113  -3.661
  124   1HG1  ILE  16          2HG1      ILE  16  -1.433  -3.236  -3.531
  125   2HG1  ILE  16          1HG1      ILE  16  -1.154  -4.426  -4.797
  126   1HG2  ILE  16          1HG2      ILE  16  -4.437  -5.445  -3.264
  127   2HG2  ILE  16          2HG2      ILE  16  -3.944  -3.836  -2.735
  128   3HG2  ILE  16          3HG2      ILE  16  -3.830  -5.203  -1.625
  129   1HD1  ILE  16          1HD1      ILE  16  -2.757  -2.693  -5.529
  130   2HD1  ILE  16          2HD1      ILE  16  -3.819  -3.114  -4.186
  131   3HD1  ILE  16          3HD1      ILE  16  -3.517  -4.283  -5.471
  132    H    SER  17           H        SER  17   0.093  -6.669  -3.420
  133    HA   SER  17           HA       SER  17  -0.503  -9.280  -2.555
  134   1HB   SER  17          2HB       SER  17   1.743  -9.879  -3.507
  135   2HB   SER  17          1HB       SER  17   0.751  -8.909  -4.591
  136    HG   SER  17           HG       SER  17   3.167  -8.373  -3.648
  137    H    SER  18           H        SER  18   1.968  -7.030  -1.305
  138    HA   SER  18           HA       SER  18   2.976  -8.997   0.600
  139   1HB   SER  18          2HB       SER  18   3.389  -5.998   0.457
  140   2HB   SER  18          1HB       SER  18   4.275  -7.095   1.511
  141    HG   SER  18           HG       SER  18   5.462  -6.789  -0.355
  142    H    ALA  19           H        ALA  19   0.399  -6.685   0.544
  143    HA   ALA  19           HA       ALA  19   0.140  -6.182   3.340
  144   1HB   ALA  19          1HB       ALA  19  -1.334  -5.598   0.996
  145   2HB   ALA  19          2HB       ALA  19  -1.625  -4.978   2.621
  146   3HB   ALA  19          3HB       ALA  19  -2.447  -6.440   2.075
  147    H    GLN  20           H        GLN  20  -2.330  -7.127   4.152
  148    HA   GLN  20           HA       GLN  20  -1.831  -9.634   5.236
  149   1HB   GLN  20          2HB       GLN  20  -4.477  -9.879   4.997
  150   2HB   GLN  20          1HB       GLN  20  -3.766  -8.715   6.114
  151   1HG   GLN  20          2HG       GLN  20  -4.453  -6.927   4.887
  152   2HG   GLN  20          1HG       GLN  20  -4.091  -7.721   3.353
  153   1HE2  GLN  20          1HE2      GLN  20  -6.636  -6.911   5.553
  154   2HE2  GLN  20          2HE2      GLN  20  -7.877  -7.763   4.769
  155    H    ASP  21           H        ASP  21  -4.468  -9.715   2.923
  156    HA   ASP  21           HA       ASP  21  -3.324 -12.184   1.771
  157   1HB   ASP  21          2HB       ASP  21  -6.013 -10.836   1.699
  158   2HB   ASP  21          1HB       ASP  21  -5.612 -12.054   0.487
  159    H    ARG  22           H        ARG  22  -4.933  -9.314   0.368
  160    HA   ARG  22           HA       ARG  22  -2.797  -8.571  -1.359
  161   1HB   ARG  22          2HB       ARG  22  -3.962  -9.422  -3.519
  162   2HB   ARG  22          1HB       ARG  22  -3.012 -10.580  -2.587
  163   1HG   ARG  22          2HG       ARG  22  -5.209 -11.144  -1.370
  164   2HG   ARG  22          1HG       ARG  22  -6.015 -10.273  -2.675
  165   1HD   ARG  22          2HD       ARG  22  -5.512 -11.874  -4.242
  166   2HD   ARG  22          1HD       ARG  22  -3.983 -12.297  -3.474
  167    HE   ARG  22           HE       ARG  22  -6.647 -13.214  -2.461
  168   1HH1  ARG  22          1HH1      ARG  22  -4.239 -13.405  -0.635
  169   2HH1  ARG  22          2HH1      ARG  22  -3.711 -15.027  -0.929
  170   1HH2  ARG  22          1HH2      ARG  22  -5.546 -15.378  -3.848
  171   2HH2  ARG  22          2HH2      ARG  22  -4.451 -16.146  -2.748
  172    H    GLN  23           H        GLN  23  -4.836  -7.343   0.264
  173    HA   GLN  23           HA       GLN  23  -6.059  -5.606  -1.808
  174   1HB   GLN  23          2HB       GLN  23  -8.226  -5.646  -0.506
  175   2HB   GLN  23          1HB       GLN  23  -7.842  -7.154  -1.334
  176   1HG   GLN  23          2HG       GLN  23  -6.595  -7.563   1.055
  177   2HG   GLN  23          1HG       GLN  23  -7.968  -6.581   1.565
  178   1HE2  GLN  23          1HE2      GLN  23 -10.115  -7.481   1.327
  179   2HE2  GLN  23          2HE2      GLN  23 -10.366  -9.113   0.932
  180    H    LEU  24           H        LEU  24  -6.547  -3.502  -1.052
  181    HA   LEU  24           HA       LEU  24  -6.139  -2.740   1.729
  182   1HB   LEU  24          2HB       LEU  24  -4.356  -0.977   0.800
  183   2HB   LEU  24          1HB       LEU  24  -3.864  -2.572   1.376
  184    HG   LEU  24           HG       LEU  24  -3.893  -3.439  -0.897
  185   1HD1  LEU  24          1HD1      LEU  24  -4.113  -1.498  -2.696
  186   2HD1  LEU  24          2HD1      LEU  24  -5.101  -0.754  -1.439
  187   3HD1  LEU  24          3HD1      LEU  24  -5.546  -2.330  -2.093
  188   1HD2  LEU  24          1HD2      LEU  24  -1.752  -2.685  -0.633
  189   2HD2  LEU  24          2HD2      LEU  24  -2.278  -1.081  -0.122
  190   3HD2  LEU  24          3HD2      LEU  24  -2.243  -1.493  -1.837
  191    H    THR  25           H        THR  25  -6.912  -0.561   2.077
  192    HA   THR  25           HA       THR  25  -8.736   0.349  -0.025
  193    HB   THR  25           HB       THR  25  -9.708   1.665   1.601
  194    HG1  THR  25           HG1      THR  25  -8.573   3.015   2.783
  195   1HG2  THR  25          1HG2      THR  25  -8.147   0.231   3.688
  196   2HG2  THR  25          2HG2      THR  25  -8.994  -0.766   2.506
  197   3HG2  THR  25          3HG2      THR  25  -9.893   0.385   3.494
  198    H    LEU  26           H        LEU  26  -8.595   3.012  -0.184
  199    HA   LEU  26           HA       LEU  26  -6.223   3.474  -1.736
  200   1HB   LEU  26          2HB       LEU  26  -8.435   5.233  -0.698
  201   2HB   LEU  26          1HB       LEU  26  -7.024   5.948  -1.480
  202    HG   LEU  26           HG       LEU  26  -8.750   3.773  -2.699
  203   1HD1  LEU  26          1HD1      LEU  26  -8.811   6.760  -2.814
  204   2HD1  LEU  26          2HD1      LEU  26 -10.144   5.609  -2.875
  205   3HD1  LEU  26          3HD1      LEU  26  -9.141   5.871  -4.301
  206   1HD2  LEU  26          1HD2      LEU  26  -7.464   4.526  -4.773
  207   2HD2  LEU  26          2HD2      LEU  26  -6.521   3.644  -3.574
  208   3HD2  LEU  26          3HD2      LEU  26  -6.390   5.399  -3.680
  209    H    SER  27           H        SER  27  -7.079   4.068   1.612
  210    HA   SER  27           HA       SER  27  -4.525   5.514   2.053
  211   1HB   SER  27          2HB       SER  27  -7.034   5.857   3.143
  212   2HB   SER  27          1HB       SER  27  -6.207   4.934   4.395
  213    HG   SER  27           HG       SER  27  -4.844   7.049   3.179
  214    H    GLY  28           H        GLY  28  -4.911   2.519   1.479
  215   1HA   GLY  28          2HA       GLY  28  -3.760   1.412   4.000
  216   2HA   GLY  28          1HA       GLY  28  -4.413   0.449   2.670
  217    H    ILE  29           H        ILE  29  -3.231   1.697   0.536
  218    HA   ILE  29           HA       ILE  29  -0.718   0.472   0.306
  219    HB   ILE  29           HB       ILE  29  -2.383   1.545  -1.430
  220   1HG1  ILE  29          2HG1      ILE  29   0.610   1.576  -1.795
  221   2HG1  ILE  29          1HG1      ILE  29  -0.466   0.193  -2.038
  222   1HG2  ILE  29          1HG2      ILE  29  -0.381   3.763  -0.953
  223   2HG2  ILE  29          2HG2      ILE  29  -2.126   3.859  -0.706
  224   3HG2  ILE  29          3HG2      ILE  29  -1.472   3.666  -2.331
  225   1HD1  ILE  29          1HD1      ILE  29   0.042   2.450  -3.793
  226   2HD1  ILE  29          2HD1      ILE  29  -1.678   2.235  -3.465
  227   3HD1  ILE  29          3HD1      ILE  29  -0.737   0.911  -4.143
  228    H    TYR  30           H        TYR  30  -1.601   3.665   1.440
  229    HA   TYR  30           HA       TYR  30   1.047   4.765   1.419
  230   1HB   TYR  30          2HB       TYR  30  -1.220   5.558   3.253
  231   2HB   TYR  30          1HB       TYR  30   0.106   6.573   2.678
  232    HD1  TYR  30           HD1      TYR  30  -3.055   6.848   2.300
  233    HD2  TYR  30           HD2      TYR  30   0.169   5.462  -0.170
  234    HE1  TYR  30           HE1      TYR  30  -4.371   7.381   0.268
  235    HE2  TYR  30           HE2      TYR  30  -1.141   5.999  -2.199
  236    HH   TYR  30           HH       TYR  30  -4.503   6.879  -2.022
  237    H    ALA  31           H        ALA  31  -0.887   3.360   4.074
  238    HA   ALA  31           HA       ALA  31   1.273   3.509   5.977
  239   1HB   ALA  31          1HB       ALA  31  -0.251   2.667   7.438
  240   2HB   ALA  31          2HB       ALA  31  -0.672   1.330   6.366
  241   3HB   ALA  31          3HB       ALA  31  -1.408   2.916   6.130
  242    H    HIS  32           H        HIS  32   0.544   1.341   3.369
  243    HA   HIS  32           HA       HIS  32   2.067  -0.908   4.424
  244   1HB   HIS  32          2HB       HIS  32   0.228  -1.196   2.780
  245   2HB   HIS  32          1HB       HIS  32   1.176  -0.303   1.590
  246    HD1  HIS  32           HD1      HIS  32   0.418  -3.640   2.349
  247    HD2  HIS  32           HD2      HIS  32   4.006  -1.673   1.554
  248    HE1  HIS  32           HE1      HIS  32   2.074  -5.421   1.649
  249    H    ILE  33           H        ILE  33   2.623   0.983   1.464
  250    HA   ILE  33           HA       ILE  33   5.334   0.293   1.145
  251    HB   ILE  33           HB       ILE  33   5.454   2.264  -0.337
  252   1HG1  ILE  33          2HG1      ILE  33   2.953   3.338  -0.441
  253   2HG1  ILE  33          1HG1      ILE  33   3.104   3.033   1.289
  254   1HG2  ILE  33          1HG2      ILE  33   4.042   0.022  -0.740
  255   2HG2  ILE  33          2HG2      ILE  33   4.067   1.326  -1.927
  256   3HG2  ILE  33          3HG2      ILE  33   2.713   1.179  -0.808
  257   1HD1  ILE  33          1HD1      ILE  33   5.447   4.143   1.049
  258   2HD1  ILE  33          2HD1      ILE  33   4.025   5.186   1.052
  259   3HD1  ILE  33          3HD1      ILE  33   4.816   4.778  -0.471
  260    H    THR  34           H        THR  34   3.907   2.981   2.961
  261    HA   THR  34           HA       THR  34   6.271   4.458   3.428
  262    HB   THR  34           HB       THR  34   5.109   5.224   5.536
  263    HG1  THR  34           HG1      THR  34   4.016   3.279   5.959
  264   1HG2  THR  34          1HG2      THR  34   3.647   5.180   2.892
  265   2HG2  THR  34          2HG2      THR  34   4.679   6.456   3.537
  266   3HG2  THR  34          3HG2      THR  34   3.101   6.146   4.263
  267    H    LYS  35           H        LYS  35   5.225   1.418   4.799
  268    HA   LYS  35           HA       LYS  35   7.200   1.554   6.979
  269   1HB   LYS  35          2HB       LYS  35   5.085   0.390   7.393
  270   2HB   LYS  35          1HB       LYS  35   5.402  -0.705   6.047
  271   1HG   LYS  35          2HG       LYS  35   7.701  -0.733   7.734
  272   2HG   LYS  35          1HG       LYS  35   6.282  -0.938   8.763
  273   1HD   LYS  35          2HD       LYS  35   5.829  -2.525   6.465
  274   2HD   LYS  35          1HD       LYS  35   7.492  -2.840   6.966
  275   1HE   LYS  35          2HE       LYS  35   5.566  -2.709   9.193
  276   2HE   LYS  35          1HE       LYS  35   5.285  -4.040   8.072
  277   1HZ   LYS  35          1HZ       LYS  35   7.812  -3.417   9.498
  278   2HZ   LYS  35          2HZ       LYS  35   7.663  -4.610   8.298
  279   3HZ   LYS  35          3HZ       LYS  35   6.801  -4.754   9.755
  280    H    HIS  36           H        HIS  36   6.882   0.108   3.783
  281    HA   HIS  36           HA       HIS  36   9.359  -1.453   4.119
  282   1HB   HIS  36          2HB       HIS  36   7.159  -1.309   2.164
  283   2HB   HIS  36          1HB       HIS  36   8.748  -1.568   1.443
  284    HD1  HIS  36           HD1      HIS  36  10.174  -3.609   2.573
  285    HD2  HIS  36           HD2      HIS  36   6.067  -3.599   3.290
  286    HE1  HIS  36           HE1      HIS  36   9.580  -5.939   3.370
  287    H    TYR  37           H        TYR  37   8.338   0.918   1.628
  288    HA   TYR  37           HA       TYR  37  11.123   1.579   1.067
  289   1HB   TYR  37          2HB       TYR  37   8.892   3.306   0.075
  290   2HB   TYR  37          1HB       TYR  37  10.310   2.720  -0.785
  291    HD1  TYR  37           HD1      TYR  37   7.151   2.618  -1.403
  292    HD2  TYR  37           HD2      TYR  37  10.086  -0.202  -0.036
  293    HE1  TYR  37           HE1      TYR  37   5.792   0.755  -2.319
  294    HE2  TYR  37           HE2      TYR  37   8.729  -2.063  -0.950
  295    HH   TYR  37           HH       TYR  37   6.183  -2.390  -1.470
  296    HA   PRO  38           HA       PRO  38  11.257   4.649   4.261
  297   1HB   PRO  38          2HB       PRO  38  13.782   5.564   3.680
  298   2HB   PRO  38          1HB       PRO  38  13.454   4.060   4.558
  299   1HG   PRO  38          2HG       PRO  38  14.359   4.429   1.741
  300   2HG   PRO  38          1HG       PRO  38  14.614   3.056   2.832
  301   1HD   PRO  38          2HD       PRO  38  12.709   3.179   0.743
  302   2HD   PRO  38          1HD       PRO  38  12.756   1.971   2.044
  303    H    TYR  39           H        TYR  39  11.931   5.458   0.865
  304    HA   TYR  39           HA       TYR  39  12.080   8.281   1.163
  305   1HB   TYR  39          2HB       TYR  39  12.562   6.982  -0.954
  306   2HB   TYR  39          1HB       TYR  39  10.817   6.844  -1.185
  307    HD1  TYR  39           HD1      TYR  39  13.521   9.367  -0.608
  308    HD2  TYR  39           HD2      TYR  39   9.618   8.583  -2.223
  309    HE1  TYR  39           HE1      TYR  39  13.470  11.645  -1.586
  310    HE2  TYR  39           HE2      TYR  39   9.567  10.862  -3.201
  311    HH   TYR  39           HH       TYR  39  10.665  13.088  -2.735
  312    H    TYR  40           H        TYR  40   9.221   6.209   0.549
  313    HA   TYR  40           HA       TYR  40   7.420   8.502   0.764
  314   1HB   TYR  40          2HB       TYR  40   6.976   5.516   0.570
  315   2HB   TYR  40          1HB       TYR  40   5.645   6.653   0.775
  316    HD1  TYR  40           HD1      TYR  40   6.759   8.955  -0.859
  317    HD2  TYR  40           HD2      TYR  40   6.567   4.735  -1.643
  318    HE1  TYR  40           HE1      TYR  40   6.780   9.408  -3.292
  319    HE2  TYR  40           HE2      TYR  40   6.584   5.192  -4.079
  320    HH   TYR  40           HH       TYR  40   6.073   8.293  -5.372
  321    H    ARG  41           H        ARG  41   6.862   9.375   2.727
  322    HA   ARG  41           HA       ARG  41   6.079   7.659   4.938
  323   1HB   ARG  41          2HB       ARG  41   7.900   9.049   6.386
  324   2HB   ARG  41          1HB       ARG  41   8.213   7.441   5.735
  325   1HG   ARG  41          2HG       ARG  41   9.440   8.295   3.901
  326   2HG   ARG  41          1HG       ARG  41   8.801   9.923   4.123
  327   1HD   ARG  41          2HD       ARG  41  10.068  10.225   6.151
  328   2HD   ARG  41          1HD       ARG  41  10.556   8.530   6.160
  329    HE   ARG  41           HE       ARG  41  11.474   9.547   3.722
  330   1HH1  ARG  41          1HH1      ARG  41  12.282   9.333   7.003
  331   2HH1  ARG  41          2HH1      ARG  41  13.690  10.335   6.888
  332   1HH2  ARG  41          1HH2      ARG  41  13.105  11.232   3.588
  333   2HH2  ARG  41          2HH2      ARG  41  14.157  11.412   4.952
  334    H    THR  42           H        THR  42   7.311  10.983   4.344
  335    HA   THR  42           HA       THR  42   4.679  12.084   5.015
  336    HB   THR  42           HB       THR  42   5.652  13.539   6.845
  337    HG1  THR  42           HG1      THR  42   7.629  13.138   7.551
  338   1HG2  THR  42          1HG2      THR  42   5.769  10.563   7.401
  339   2HG2  THR  42          2HG2      THR  42   4.271  11.486   7.268
  340   3HG2  THR  42          3HG2      THR  42   5.417  11.843   8.561
  341    H    ALA  43           H        ALA  43   6.672  12.101   2.783
  342    HA   ALA  43           HA       ALA  43   7.926  14.694   2.679
  343   1HB   ALA  43          1HB       ALA  43   7.644  12.391   0.949
  344   2HB   ALA  43          2HB       ALA  43   8.878  13.649   0.925
  345   3HB   ALA  43          3HB       ALA  43   7.371  13.875   0.038
  346    H    ASP  44           H        ASP  44   5.470  13.725   0.312
  347    HA   ASP  44           HA       ASP  44   3.776  16.031   1.084
  348   1HB   ASP  44          2HB       ASP  44   4.724  15.710  -1.769
  349   2HB   ASP  44          1HB       ASP  44   3.862  17.076  -1.061
  350    H    LYS  45           H        LYS  45   1.807  16.059  -0.545
  351    HA   LYS  45           HA       LYS  45   0.785  13.287  -0.613
  352   1HB   LYS  45          2HB       LYS  45  -0.665  15.847  -1.346
  353   2HB   LYS  45          1HB       LYS  45  -1.385  14.284  -0.954
  354   1HG   LYS  45          2HG       LYS  45  -0.114  14.536   1.310
  355   2HG   LYS  45          1HG       LYS  45  -0.030  16.245   0.881
  356   1HD   LYS  45          2HD       LYS  45  -2.686  15.452   0.355
  357   2HD   LYS  45          1HD       LYS  45  -2.273  14.748   1.918
  358   1HE   LYS  45          2HE       LYS  45  -1.200  17.366   1.925
  359   2HE   LYS  45          1HE       LYS  45  -2.834  17.503   1.274
  360   1HZ   LYS  45          1HZ       LYS  45  -2.652  17.626   3.750
  361   2HZ   LYS  45          2HZ       LYS  45  -2.195  15.990   3.741
  362   3HZ   LYS  45          3HZ       LYS  45  -3.728  16.450   3.171
  363    H    GLY  46           H        GLY  46   2.856  14.175  -2.535
  364   1HA   GLY  46          2HA       GLY  46   1.759  14.740  -5.100
  365   2HA   GLY  46          1HA       GLY  46   3.306  13.934  -4.825
  366    H    TRP  47           H        TRP  47   3.236  11.578  -4.449
  367    HA   TRP  47           HA       TRP  47   1.637  10.210  -6.344
  368   1HB   TRP  47          2HB       TRP  47   2.485   8.162  -5.376
  369   2HB   TRP  47          1HB       TRP  47   3.778   9.354  -5.393
  370    HD1  TRP  47           HD1      TRP  47   3.752  10.893  -2.913
  371    HE1  TRP  47           HE1      TRP  47   3.800   9.874  -0.559
  372    HE3  TRP  47           HE3      TRP  47   1.931   6.220  -3.937
  373    HZ2  TRP  47           HZ2      TRP  47   3.169   7.406   0.730
  374    HZ3  TRP  47           HZ3      TRP  47   1.683   4.559  -2.118
  375    HH2  TRP  47           HH2      TRP  47   2.299   5.148   0.208
  376    H    GLN  48           H        GLN  48   0.776  11.343  -3.231
  377    HA   GLN  48           HA       GLN  48  -1.013   9.425  -2.276
  378   1HB   GLN  48          2HB       GLN  48  -0.464  12.029  -1.632
  379   2HB   GLN  48          1HB       GLN  48  -2.103  12.170  -2.268
  380   1HG   GLN  48          2HG       GLN  48  -2.179  11.730   0.142
  381   2HG   GLN  48          1HG       GLN  48  -2.823  10.346  -0.741
  382   1HE2  GLN  48          1HE2      GLN  48   0.585  10.552  -1.104
  383   2HE2  GLN  48          2HE2      GLN  48   1.007   9.412   0.077
  384    H    ASN  49           H        ASN  49  -1.739  11.995  -4.663
  385    HA   ASN  49           HA       ASN  49  -4.373  10.941  -5.275
  386   1HB   ASN  49          2HB       ASN  49  -2.564  12.959  -6.616
  387   2HB   ASN  49          1HB       ASN  49  -4.129  12.508  -7.292
  388   1HD2  ASN  49          1HD2      ASN  49  -2.554  14.363  -4.783
  389   2HD2  ASN  49          2HD2      ASN  49  -3.967  14.983  -4.077
  390    H    SER  50           H        SER  50  -1.159  10.225  -6.366
  391    HA   SER  50           HA       SER  50  -1.812   9.146  -8.942
  392   1HB   SER  50          2HB       SER  50   0.486   8.926  -7.049
  393   2HB   SER  50          1HB       SER  50   0.358   7.716  -8.323
  394    HG   SER  50           HG       SER  50  -0.076  10.341  -9.095
  395    H    ILE  51           H        ILE  51  -1.309   7.501  -5.803
  396    HA   ILE  51           HA       ILE  51  -1.908   4.888  -6.678
  397    HB   ILE  51           HB       ILE  51  -1.761   6.328  -4.100
  398   1HG1  ILE  51          2HG1      ILE  51  -0.337   4.459  -3.560
  399   2HG1  ILE  51          1HG1      ILE  51  -0.983   3.532  -4.911
  400   1HG2  ILE  51          1HG2      ILE  51  -2.891   4.720  -2.753
  401   2HG2  ILE  51          2HG2      ILE  51  -3.125   3.625  -4.114
  402   3HG2  ILE  51          3HG2      ILE  51  -4.042   5.127  -4.020
  403   1HD1  ILE  51          1HD1      ILE  51   0.230   6.186  -5.525
  404   2HD1  ILE  51          2HD1      ILE  51   0.219   4.707  -6.486
  405   3HD1  ILE  51          3HD1      ILE  51   1.323   4.862  -5.119
  406    H    ARG  52           H        ARG  52  -4.064   7.496  -5.697
  407    HA   ARG  52           HA       ARG  52  -6.462   5.943  -5.548
  408   1HB   ARG  52          2HB       ARG  52  -5.755   8.629  -5.194
  409   2HB   ARG  52          1HB       ARG  52  -6.926   8.640  -6.513
  410   1HG   ARG  52          2HG       ARG  52  -8.524   7.393  -5.169
  411   2HG   ARG  52          1HG       ARG  52  -7.344   7.225  -3.868
  412   1HD   ARG  52          2HD       ARG  52  -8.257   9.120  -3.024
  413   2HD   ARG  52          1HD       ARG  52  -7.378   9.954  -4.305
  414    HE   ARG  52           HE       ARG  52  -9.486   9.714  -5.686
  415   1HH1  ARG  52          1HH1      ARG  52 -10.670   7.919  -3.417
  416   2HH1  ARG  52          2HH1      ARG  52 -11.837   9.016  -2.755
  417   1HH2  ARG  52          1HH2      ARG  52 -10.507  11.801  -4.340
  418   2HH2  ARG  52          2HH2      ARG  52 -11.744  11.216  -3.278
  419    H    HIS  53           H        HIS  53  -5.397   8.119  -8.175
  420    HA   HIS  53           HA       HIS  53  -7.418   7.150 -10.003
  421   1HB   HIS  53          2HB       HIS  53  -6.215   9.434  -9.943
  422   2HB   HIS  53          1HB       HIS  53  -4.904   8.615 -10.791
  423    HD1  HIS  53           HD1      HIS  53  -7.891  10.464 -11.464
  424    HD2  HIS  53           HD2      HIS  53  -6.063   7.162 -13.234
  425    HE1  HIS  53           HE1      HIS  53  -8.852  10.279 -13.801
  426    H    ASN  54           H        ASN  54  -4.290   5.972  -9.171
  427    HA   ASN  54           HA       ASN  54  -3.645   4.773 -11.717
  428   1HB   ASN  54          2HB       ASN  54  -2.533   4.758  -8.986
  429   2HB   ASN  54          1HB       ASN  54  -2.234   3.290  -9.918
  430   1HD2  ASN  54          1HD2      ASN  54  -0.874   6.260  -9.281
  431   2HD2  ASN  54          2HD2      ASN  54  -0.010   6.489 -10.723
  432    H    LEU  55           H        LEU  55  -5.290   3.577  -8.800
  433    HA   LEU  55           HA       LEU  55  -5.393   0.841  -9.695
  434   1HB   LEU  55          2HB       LEU  55  -7.321   2.209  -7.808
  435   2HB   LEU  55          1HB       LEU  55  -6.943   0.490  -7.899
  436    HG   LEU  55           HG       LEU  55  -4.923   2.633  -7.221
  437   1HD1  LEU  55          1HD1      LEU  55  -6.029   0.597  -5.300
  438   2HD1  LEU  55          2HD1      LEU  55  -6.895   2.111  -5.573
  439   3HD1  LEU  55          3HD1      LEU  55  -5.243   2.138  -4.952
  440   1HD2  LEU  55          1HD2      LEU  55  -4.507   0.123  -8.228
  441   2HD2  LEU  55          2HD2      LEU  55  -4.520  -0.207  -6.497
  442   3HD2  LEU  55          3HD2      LEU  55  -3.374   0.956  -7.164
  443    H    SER  56           H        SER  56  -7.005   3.590 -10.835
  444    HA   SER  56           HA       SER  56  -9.445   2.122 -11.612
  445   1HB   SER  56          2HB       SER  56  -8.649   4.881 -12.546
  446   2HB   SER  56          1HB       SER  56 -10.267   4.202 -12.406
  447    HG   SER  56           HG       SER  56  -8.542   5.193 -10.439
  448    H    LEU  57           H        LEU  57  -6.682   3.700 -13.225
  449    HA   LEU  57           HA       LEU  57  -7.441   2.441 -15.780
  450   1HB   LEU  57          2HB       LEU  57  -5.585   3.762 -16.699
  451   2HB   LEU  57          1HB       LEU  57  -6.659   4.784 -15.747
  452    HG   LEU  57           HG       LEU  57  -4.930   3.976 -13.818
  453   1HD1  LEU  57          1HD1      LEU  57  -2.702   3.844 -14.634
  454   2HD1  LEU  57          2HD1      LEU  57  -3.176   4.391 -16.243
  455   3HD1  LEU  57          3HD1      LEU  57  -3.633   2.780 -15.688
  456   1HD2  LEU  57          1HD2      LEU  57  -5.638   6.331 -14.988
  457   2HD2  LEU  57          2HD2      LEU  57  -3.939   6.244 -15.453
  458   3HD2  LEU  57          3HD2      LEU  57  -4.392   6.199 -13.748
  459    H    ASN  58           H        ASN  58  -5.667   1.494 -13.083
  460    HA   ASN  58           HA       ASN  58  -3.370   0.306 -14.321
  461   1HB   ASN  58          2HB       ASN  58  -4.608   0.166 -11.677
  462   2HB   ASN  58          1HB       ASN  58  -3.993  -1.398 -12.201
  463   1HD2  ASN  58          1HD2      ASN  58  -2.794   1.971 -12.729
  464   2HD2  ASN  58          2HD2      ASN  58  -1.230   1.654 -12.152
  465    H    ARG  59           H        ARG  59  -3.023  -2.036 -14.681
  466    HA   ARG  59           HA       ARG  59  -5.339  -3.154 -16.124
  467   1HB   ARG  59          2HB       ARG  59  -3.272  -3.171 -17.338
  468   2HB   ARG  59          1HB       ARG  59  -2.417  -3.922 -15.990
  469   1HG   ARG  59          2HG       ARG  59  -3.058  -5.989 -16.623
  470   2HG   ARG  59          1HG       ARG  59  -4.740  -5.486 -16.794
  471   1HD   ARG  59          2HD       ARG  59  -3.641  -4.250 -18.951
  472   2HD   ARG  59          1HD       ARG  59  -2.611  -5.678 -18.843
  473    HE   ARG  59           HE       ARG  59  -5.571  -5.742 -19.214
  474   1HH1  ARG  59          1HH2      ARG  59  -4.079  -8.091 -17.847
  475   2HH1  ARG  59          2HH2      ARG  59  -3.886  -9.157 -19.198
  476   1HH2  ARG  59          1HH1      ARG  59  -4.625  -6.727 -21.558
  477   2HH2  ARG  59          2HH1      ARG  59  -4.196  -8.385 -21.301
  478    H    TYR  60           H        TYR  60  -3.545  -3.796 -13.160
  479    HA   TYR  60           HA       TYR  60  -5.209  -6.267 -12.868
  480   1HB   TYR  60          2HB       TYR  60  -3.268  -6.865 -11.174
  481   2HB   TYR  60          1HB       TYR  60  -3.101  -7.191 -12.897
  482    HD1  TYR  60           HD1      TYR  60  -0.877  -6.858 -13.464
  483    HD2  TYR  60           HD2      TYR  60  -2.834  -3.980 -10.944
  484    HE1  TYR  60           HE1      TYR  60   1.130  -5.419 -13.564
  485    HE2  TYR  60           HE2      TYR  60  -0.819  -2.538 -11.051
  486    HH   TYR  60           HH       TYR  60   1.134  -2.179 -12.172
  487    H    PHE  61           H        PHE  61  -5.708  -3.393 -11.890
  488    HA   PHE  61           HA       PHE  61  -5.931  -4.172  -9.014
  489   1HB   PHE  61          2HB       PHE  61  -5.448  -1.464 -10.252
  490   2HB   PHE  61          1HB       PHE  61  -6.037  -1.649  -8.595
  491    HD1  PHE  61           HD1      PHE  61  -3.192  -0.864 -10.096
  492    HD2  PHE  61           HD2      PHE  61  -4.663  -4.058  -7.637
  493    HE1  PHE  61           HE1      PHE  61  -0.891  -1.360  -9.372
  494    HE2  PHE  61           HE2      PHE  61  -2.350  -4.543  -6.909
  495    HZ   PHE  61           HZ       PHE  61  -0.469  -3.205  -7.778
  496    H    ILE  62           H        ILE  62  -7.915  -4.961  -8.901
  497    HA   ILE  62           HA       ILE  62 -10.165  -3.604 -10.262
  498    HB   ILE  62           HB       ILE  62 -11.410  -5.570  -9.913
  499   1HG1  ILE  62          2HG1      ILE  62  -9.449  -6.542  -7.819
  500   2HG1  ILE  62          1HG1      ILE  62 -10.871  -5.593  -7.392
  501   1HG2  ILE  62          1HG2      ILE  62 -10.109  -7.158 -10.951
  502   2HG2  ILE  62          2HG2      ILE  62  -8.764  -6.941  -9.832
  503   3HG2  ILE  62          3HG2      ILE  62  -9.025  -5.779 -11.132
  504   1HD1  ILE  62          1HD1      ILE  62 -10.689  -8.406  -8.104
  505   2HD1  ILE  62          2HD1      ILE  62 -11.848  -7.554  -9.126
  506   3HD1  ILE  62          3HD1      ILE  62 -12.029  -7.523  -7.372
  507    H    LYS  63           H        LYS  63 -12.178  -3.198  -8.961
  508    HA   LYS  63           HA       LYS  63 -11.425  -2.017  -6.340
  509   1HB   LYS  63          2HB       LYS  63 -13.085  -1.155  -8.468
  510   2HB   LYS  63          1HB       LYS  63 -14.154  -1.494  -7.107
  511   1HG   LYS  63          2HG       LYS  63 -11.887  -0.177  -6.036
  512   2HG   LYS  63          1HG       LYS  63 -12.362   0.732  -7.470
  513   1HD   LYS  63          2HD       LYS  63 -14.739   0.680  -6.599
  514   2HD   LYS  63          1HD       LYS  63 -14.101   0.015  -5.096
  515   1HE   LYS  63          2HE       LYS  63 -12.447   2.101  -5.310
  516   2HE   LYS  63          1HE       LYS  63 -13.796   2.759  -6.236
  517   1HZ   LYS  63          1HZ       LYS  63 -14.450   3.360  -4.168
  518   2HZ   LYS  63          2HZ       LYS  63 -13.637   2.080  -3.402
  519   3HZ   LYS  63          3HZ       LYS  63 -15.122   1.802  -4.181
  520    H    VAL  64           H        VAL  64 -13.021  -2.274  -4.545
  521    HA   VAL  64           HA       VAL  64 -14.906  -4.500  -4.663
  522    HB   VAL  64           HB       VAL  64 -12.963  -5.867  -4.396
  523   1HG1  VAL  64          1HG1      VAL  64 -12.054  -3.561  -2.769
  524   2HG1  VAL  64          2HG1      VAL  64 -11.129  -4.632  -3.822
  525   3HG1  VAL  64          3HG1      VAL  64 -11.550  -5.150  -2.190
  526   1HG2  VAL  64          1HG2      VAL  64 -14.947  -5.803  -2.510
  527   2HG2  VAL  64          2HG2      VAL  64 -13.513  -5.623  -1.499
  528   3HG2  VAL  64          3HG2      VAL  64 -13.674  -7.023  -2.561
  529    HA   PRO  65           HA       PRO  65 -15.858  -1.289  -1.554
  530   1HB   PRO  65          2HB       PRO  65 -18.498  -1.081  -2.286
  531   2HB   PRO  65          1HB       PRO  65 -17.193  -0.162  -3.057
  532   1HG   PRO  65          2HG       PRO  65 -18.695  -2.521  -4.098
  533   2HG   PRO  65          1HG       PRO  65 -17.888  -1.221  -4.990
  534   1HD   PRO  65          2HD       PRO  65 -16.869  -3.830  -4.585
  535   2HD   PRO  65          1HD       PRO  65 -15.948  -2.429  -5.173
  536    H    ARG  66           H        ARG  66 -17.512  -1.389   0.234
  537    HA   ARG  66           HA       ARG  66 -18.876  -3.977   0.605
  538   1HB   ARG  66          2HB       ARG  66 -17.734  -4.583   2.615
  539   2HB   ARG  66          1HB       ARG  66 -16.471  -4.213   1.443
  540   1HG   ARG  66          2HG       ARG  66 -16.408  -1.868   2.376
  541   2HG   ARG  66          1HG       ARG  66 -17.497  -2.411   3.652
  542   1HD   ARG  66          2HD       ARG  66 -15.364  -4.301   3.454
  543   2HD   ARG  66          1HD       ARG  66 -14.656  -2.688   3.528
  544    HE   ARG  66           HE       ARG  66 -16.694  -3.525   5.543
  545   1HH1  ARG  66          1HH2      ARG  66 -13.386  -3.560   5.047
  546   2HH1  ARG  66          2HH2      ARG  66 -12.979  -2.652   6.463
  547   1HH2  ARG  66          1HH1      ARG  66 -16.266  -1.831   7.206
  548   2HH2  ARG  66          2HH1      ARG  66 -14.609  -1.671   7.686
  549    H    SER  67           H        SER  67 -20.007  -3.892   2.881
  550    HA   SER  67           HA       SER  67 -21.406  -1.309   2.999
  551   1HB   SER  67          2HB       SER  67 -22.500  -3.629   3.200
  552   2HB   SER  67          1HB       SER  67 -21.833  -3.678   4.830
  553    HG   SER  67           HG       SER  67 -24.066  -2.605   4.146
  554    H    GLN  68           H        GLN  68 -19.447  -0.122   3.763
  555    HA   GLN  68           HA       GLN  68 -18.478  -0.731   6.468
  556   1HB   GLN  68          2HB       GLN  68 -17.915   1.629   4.645
  557   2HB   GLN  68          1HB       GLN  68 -17.060   1.266   6.144
  558   1HG   GLN  68          2HG       GLN  68 -16.734  -1.102   4.969
  559   2HG   GLN  68          1HG       GLN  68 -16.940  -0.136   3.506
  560   1HE2  GLN  68          1HE2      GLN  68 -15.176   0.208   6.648
  561   2HE2  GLN  68          2HE2      GLN  68 -13.743   0.783   5.944
  562    H    GLU  69           H        GLU  69 -18.387   1.276   8.017
  563    HA   GLU  69           HA       GLU  69 -21.174   2.186   8.353
  564   1HB   GLU  69          2HB       GLU  69 -20.113   1.373  10.353
  565   2HB   GLU  69          1HB       GLU  69 -18.701   2.396  10.089
  566   1HG   GLU  69          2HG       GLU  69 -20.067   3.466  11.769
  567   2HG   GLU  69          1HG       GLU  69 -20.223   4.402  10.282
  568    H    GLU  70           H        GLU  70 -18.068   3.906   8.797
  569    HA   GLU  70           HA       GLU  70 -19.373   6.348   7.729
  570   1HB   GLU  70          2HB       GLU  70 -17.513   5.856   9.804
  571   2HB   GLU  70          1HB       GLU  70 -16.645   6.756   8.560
  572   1HG   GLU  70          2HG       GLU  70 -17.619   8.614   9.396
  573   2HG   GLU  70          1HG       GLU  70 -19.124   8.022   8.691
  574    HA   PRO  71           HA       PRO  71 -17.123   5.373   3.960
  575   1HB   PRO  71          2HB       PRO  71 -18.501   7.178   2.413
  576   2HB   PRO  71          1HB       PRO  71 -19.114   5.564   2.812
  577   1HG   PRO  71          2HG       PRO  71 -19.949   8.210   3.904
  578   2HG   PRO  71          1HG       PRO  71 -20.879   6.709   3.763
  579   1HD   PRO  71          2HD       PRO  71 -19.682   7.700   6.127
  580   2HD   PRO  71          1HD       PRO  71 -20.321   6.060   5.889
  581    H    GLY  72           H        GLY  72 -15.084   6.254   3.857
  582   1HA   GLY  72          2HA       GLY  72 -14.746   9.166   4.329
  583   2HA   GLY  72          1HA       GLY  72 -13.446   7.969   4.320
  584    H    LYS  73           H        LYS  73 -12.198   7.994   2.512
  585    HA   LYS  73           HA       LYS  73 -13.113   9.506   0.156
  586   1HB   LYS  73          2HB       LYS  73 -10.589   8.843   1.322
  587   2HB   LYS  73          1HB       LYS  73 -10.618   8.192  -0.317
  588   1HG   LYS  73          2HG       LYS  73  -9.909  10.357  -0.749
  589   2HG   LYS  73          1HG       LYS  73 -11.655  10.566  -0.884
  590   1HD   LYS  73          2HD       LYS  73 -11.209  12.281   0.589
  591   2HD   LYS  73          1HD       LYS  73 -11.423  10.970   1.752
  592   1HE   LYS  73          2HE       LYS  73  -8.699  11.090   0.694
  593   2HE   LYS  73          1HE       LYS  73  -9.167  12.574   1.523
  594   1HZ   LYS  73          1HZ       LYS  73 -10.017  11.052   3.341
  595   2HZ   LYS  73          2HZ       LYS  73  -8.329  11.184   3.182
  596   3HZ   LYS  73          3HZ       LYS  73  -9.138   9.815   2.584
  597    H    GLY  74           H        GLY  74 -11.391   6.378   0.300
  598   1HA   GLY  74          2HA       GLY  74 -13.242   5.413  -1.837
  599   2HA   GLY  74          1HA       GLY  74 -11.601   4.813  -1.590
  600    H    SER  75           H        SER  75 -12.697   2.654  -1.519
  601    HA   SER  75           HA       SER  75 -13.795   2.132   1.216
  602   1HB   SER  75          2HB       SER  75 -14.940   1.559  -1.379
  603   2HB   SER  75          1HB       SER  75 -14.667   0.064  -0.491
  604    HG   SER  75           HG       SER  75 -15.624   1.743   1.259
  605    H    PHE  76           H        PHE  76 -12.621   0.138  -1.529
  606    HA   PHE  76           HA       PHE  76 -10.269  -0.696  -0.042
  607   1HB   PHE  76          2HB       PHE  76 -12.567  -2.040   0.664
  608   2HB   PHE  76          1HB       PHE  76 -11.887  -3.087  -0.587
  609    HD1  PHE  76           HD1      PHE  76  -9.587  -3.985  -0.363
  610    HD2  PHE  76           HD2      PHE  76 -11.446  -1.729   2.781
  611    HE1  PHE  76           HE1      PHE  76  -7.865  -4.779   1.227
  612    HE2  PHE  76           HE2      PHE  76  -9.720  -2.528   4.372
  613    HZ   PHE  76           HZ       PHE  76  -7.931  -4.058   3.597
  614    H    TRP  77           H        TRP  77  -8.902  -2.109  -1.324
  615    HA   TRP  77           HA       TRP  77  -9.740  -2.311  -4.186
  616   1HB   TRP  77          2HB       TRP  77  -7.222  -1.203  -2.982
  617   2HB   TRP  77          1HB       TRP  77  -7.165  -1.961  -4.569
  618    HD1  TRP  77           HD1      TRP  77  -8.424   1.108  -2.753
  619    HE1  TRP  77           HE1      TRP  77  -9.317   2.800  -4.480
  620    HE3  TRP  77           HE3      TRP  77  -8.331  -1.794  -6.948
  621    HZ2  TRP  77           HZ2      TRP  77  -9.908   2.906  -7.276
  622    HZ3  TRP  77           HZ3      TRP  77  -9.062  -0.874  -9.130
  623    HH2  TRP  77           HH2      TRP  77  -9.839   1.469  -9.293
  624    H    ARG  78           H        ARG  78  -8.417  -3.930  -5.394
  625    HA   ARG  78           HA       ARG  78  -6.926  -5.936  -3.878
  626   1HB   ARG  78          2HB       ARG  78  -9.627  -6.317  -3.826
  627   2HB   ARG  78          1HB       ARG  78  -9.202  -7.156  -5.318
  628   1HG   ARG  78          2HG       ARG  78  -8.078  -8.806  -4.232
  629   2HG   ARG  78          1HG       ARG  78  -7.403  -7.696  -3.039
  630   1HD   ARG  78          2HD       ARG  78  -8.960  -9.215  -1.928
  631   2HD   ARG  78          1HD       ARG  78  -9.642  -7.588  -1.936
  632    HE   ARG  78           HE       ARG  78 -10.794  -8.559  -4.155
  633   1HH1  ARG  78          1HH1      ARG  78 -10.619  -9.587  -0.895
  634   2HH1  ARG  78          2HH1      ARG  78 -11.792 -10.848  -1.080
  635   1HH2  ARG  78          1HH2      ARG  78 -12.133 -10.395  -4.501
  636   2HH2  ARG  78          2HH2      ARG  78 -12.649 -11.306  -3.121
  637    H    ILE  79           H        ILE  79  -5.510  -6.946  -5.291
  638    HA   ILE  79           HA       ILE  79  -5.759  -6.183  -8.152
  639    HB   ILE  79           HB       ILE  79  -3.608  -5.778  -7.135
  640   1HG1  ILE  79          2HG1      ILE  79  -2.607  -8.071  -8.538
  641   2HG1  ILE  79          1HG1      ILE  79  -3.975  -7.412  -9.418
  642   1HG2  ILE  79          1HG2      ILE  79  -3.162  -7.120  -5.379
  643   2HG2  ILE  79          2HG2      ILE  79  -2.405  -8.147  -6.596
  644   3HG2  ILE  79          3HG2      ILE  79  -4.054  -8.477  -6.064
  645   1HD1  ILE  79          1HD1      ILE  79  -1.664  -5.750  -8.398
  646   2HD1  ILE  79          2HD1      ILE  79  -2.975  -5.201  -9.441
  647   3HD1  ILE  79          3HD1      ILE  79  -1.787  -6.349 -10.045
  648    H    ASP  80           H        ASP  80  -5.666  -7.800  -9.839
  649    HA   ASP  80           HA       ASP  80  -7.294 -10.059  -9.402
  650   1HB   ASP  80          2HB       ASP  80  -5.633  -9.016 -11.582
  651   2HB   ASP  80          1HB       ASP  80  -5.749 -10.775 -11.581
  652    HA   PRO  81           HA       PRO  81  -4.464 -12.824  -7.467
  653   1HB   PRO  81          2HB       PRO  81  -6.014 -15.083  -7.698
  654   2HB   PRO  81          1HB       PRO  81  -6.313 -13.800  -6.511
  655   1HG   PRO  81          2HG       PRO  81  -7.805 -14.426  -9.012
  656   2HG   PRO  81          1HG       PRO  81  -8.365 -13.603  -7.547
  657   1HD   PRO  81          2HD       PRO  81  -7.630 -12.358  -9.991
  658   2HD   PRO  81          1HD       PRO  81  -7.922 -11.538  -8.441
  659    H    ALA  82           H        ALA  82  -6.028 -14.086 -10.448
  660    HA   ALA  82           HA       ALA  82  -3.908 -15.961 -10.986
  661   1HB   ALA  82          1HB       ALA  82  -5.371 -15.011 -13.346
  662   2HB   ALA  82          2HB       ALA  82  -6.434 -15.495 -12.024
  663   3HB   ALA  82          3HB       ALA  82  -5.260 -16.639 -12.675
  664    H    SER  83           H        SER  83  -4.008 -12.586 -11.247
  665    HA   SER  83           HA       SER  83  -1.821 -12.649 -13.282
  666   1HB   SER  83          2HB       SER  83  -4.050 -10.815 -12.812
  667   2HB   SER  83          1HB       SER  83  -2.502  -9.975 -12.863
  668    HG   SER  83           HG       SER  83  -2.124 -11.222 -14.839
  669    H    GLU  84           H        GLU  84  -2.536 -12.318  -9.994
  670    HA   GLU  84           HA       GLU  84  -0.712 -10.348  -9.138
  671   1HB   GLU  84          2HB       GLU  84  -2.324 -11.350  -7.607
  672   2HB   GLU  84          1HB       GLU  84  -1.544 -12.923  -7.778
  673   1HG   GLU  84          2HG       GLU  84   0.605 -11.625  -6.994
  674   2HG   GLU  84          1HG       GLU  84  -0.562 -10.470  -6.350
  675    H    ALA  85           H        ALA  85  -0.138 -13.893  -9.344
  676    HA   ALA  85           HA       ALA  85   2.574 -13.865  -8.632
  677   1HB   ALA  85          1HB       ALA  85   2.008 -16.042  -9.001
  678   2HB   ALA  85          2HB       ALA  85   2.558 -15.732 -10.648
  679   3HB   ALA  85          3HB       ALA  85   0.842 -15.623 -10.256
  680    H    LYS  86           H        LYS  86   1.113 -12.547 -11.491
  681    HA   LYS  86           HA       LYS  86   3.666 -12.455 -12.961
  682   1HB   LYS  86          2HB       LYS  86   1.287 -12.723 -13.981
  683   2HB   LYS  86          1HB       LYS  86   1.163 -10.979 -13.752
  684   1HG   LYS  86          2HG       LYS  86   3.620 -11.139 -14.897
  685   2HG   LYS  86          1HG       LYS  86   2.830 -12.520 -15.658
  686   1HD   LYS  86          2HD       LYS  86   1.728 -11.130 -17.037
  687   2HD   LYS  86          1HD       LYS  86   0.974 -10.351 -15.646
  688   1HE   LYS  86          2HE       LYS  86   2.230  -8.512 -15.960
  689   2HE   LYS  86          1HE       LYS  86   3.704  -9.474 -15.840
  690   1HZ   LYS  86          1HZ       LYS  86   3.916  -9.591 -18.058
  691   2HZ   LYS  86          2HZ       LYS  86   2.944  -8.197 -18.051
  692   3HZ   LYS  86          3HZ       LYS  86   2.247  -9.721 -18.334
  693    H    LEU  87           H        LEU  87   1.314  -9.959 -11.906
  694    HA   LEU  87           HA       LEU  87   2.936  -7.720 -12.298
  695   1HB   LEU  87          2HB       LEU  87   1.630  -6.865 -10.138
  696   2HB   LEU  87          1HB       LEU  87   0.810  -7.081 -11.670
  697    HG   LEU  87           HG       LEU  87   0.855  -9.579 -10.211
  698   1HD1  LEU  87          1HD1      LEU  87  -0.035  -7.107  -8.763
  699   2HD1  LEU  87          2HD1      LEU  87   0.836  -8.510  -8.141
  700   3HD1  LEU  87          3HD1      LEU  87  -0.883  -8.629  -8.505
  701   1HD2  LEU  87          1HD2      LEU  87  -1.602  -9.368 -10.545
  702   2HD2  LEU  87          2HD2      LEU  87  -0.708  -9.042 -12.031
  703   3HD2  LEU  87          3HD2      LEU  87  -1.365  -7.711 -11.092
  704    H    VAL  88           H        VAL  88   2.472  -9.338  -9.183
  705    HA   VAL  88           HA       VAL  88   4.333  -8.103  -7.605
  706    HB   VAL  88           HB       VAL  88   4.711 -10.331  -6.579
  707   1HG1  VAL  88          1HG1      VAL  88   2.591  -8.831  -6.312
  708   2HG1  VAL  88          2HG1      VAL  88   2.527 -10.490  -5.716
  709   3HG1  VAL  88          3HG1      VAL  88   1.799 -10.082  -7.270
  710   1HG2  VAL  88          1HG2      VAL  88   2.941 -11.991  -7.846
  711   2HG2  VAL  88          2HG2      VAL  88   4.687 -12.023  -8.095
  712   3HG2  VAL  88          3HG2      VAL  88   3.654 -11.119  -9.202
  713    H    GLU  89           H        GLU  89   5.015 -10.274 -10.280
  714    HA   GLU  89           HA       GLU  89   7.685 -10.965  -9.749
  715   1HB   GLU  89          2HB       GLU  89   6.415 -11.822 -11.697
  716   2HB   GLU  89          1HB       GLU  89   6.488 -10.223 -12.440
  717   1HG   GLU  89          2HG       GLU  89   9.039 -10.411 -12.216
  718   2HG   GLU  89          1HG       GLU  89   8.769 -12.123 -11.879
  719    H    GLN  90           H        GLN  90   6.533  -8.101 -11.582
  720    HA   GLN  90           HA       GLN  90   9.187  -6.897 -11.531
  721   1HB   GLN  90          2HB       GLN  90   6.640  -6.352 -12.782
  722   2HB   GLN  90          1HB       GLN  90   7.233  -4.894 -11.984
  723   1HG   GLN  90          2HG       GLN  90   8.284  -4.736 -14.059
  724   2HG   GLN  90          1HG       GLN  90   9.520  -5.555 -13.105
  725   1HE2  GLN  90          1HE2      GLN  90  10.105  -6.278 -15.478
  726   2HE2  GLN  90          2HE2      GLN  90   9.373  -7.710 -16.023
  727    H    ALA  91           H        ALA  91   6.608  -7.198  -9.321
  728    HA   ALA  91           HA       ALA  91   6.939  -4.714  -7.892
  729   1HB   ALA  91          1HB       ALA  91   4.907  -6.154  -7.724
  730   2HB   ALA  91          2HB       ALA  91   5.594  -5.732  -6.156
  731   3HB   ALA  91          3HB       ALA  91   5.870  -7.335  -6.836
  732    H    PHE  92           H        PHE  92   8.654  -7.733  -7.918
  733    HA   PHE  92           HA       PHE  92   9.976  -7.158  -5.341
  734   1HB   PHE  92          2HB       PHE  92  10.270  -9.414  -7.341
  735   2HB   PHE  92          1HB       PHE  92  11.227  -9.287  -5.866
  736    HD1  PHE  92           HD1      PHE  92   8.129 -10.394  -7.286
  737    HD2  PHE  92           HD2      PHE  92   9.946  -9.051  -3.633
  738    HE1  PHE  92           HE1      PHE  92   6.276 -11.415  -5.989
  739    HE2  PHE  92           HE2      PHE  92   8.096 -10.072  -2.337
  740    HZ   PHE  92           HZ       PHE  92   6.261 -11.253  -3.514
  741    H    ARG  93           H        ARG  93  10.375  -6.281  -8.572
  742    HA   ARG  93           HA       ARG  93  13.112  -5.323  -7.974
  743   1HB   ARG  93          2HB       ARG  93  13.571  -6.092 -10.505
  744   2HB   ARG  93          1HB       ARG  93  13.911  -7.142  -9.130
  745   1HG   ARG  93          2HG       ARG  93  11.126  -7.270 -10.085
  746   2HG   ARG  93          1HG       ARG  93  12.320  -7.833 -11.256
  747   1HD   ARG  93          2HD       ARG  93  13.260  -9.011  -8.990
  748   2HD   ARG  93          1HD       ARG  93  11.530  -9.005  -8.655
  749    HE   ARG  93           HE       ARG  93  11.247 -10.218 -10.849
  750   1HH1  ARG  93          1HH2      ARG  93  13.057 -11.584  -8.628
  751   2HH1  ARG  93          2HH2      ARG  93  14.213 -12.355  -9.661
  752   1HH2  ARG  93          1HH1      ARG  93  13.280 -10.566 -12.481
  753   2HH2  ARG  93          2HH1      ARG  93  14.339 -11.779 -11.842
  754    H    LYS  94           H        LYS  94  13.416  -3.295  -8.782
  755    HA   LYS  94           HA       LYS  94  11.536  -2.343 -10.900
  756   1HB   LYS  94          2HB       LYS  94  10.740  -1.457  -8.775
  757   2HB   LYS  94          1HB       LYS  94  12.357  -0.879  -8.373
  758   1HG   LYS  94          2HG       LYS  94  11.500   1.073  -9.241
  759   2HG   LYS  94          1HG       LYS  94  12.072   0.349 -10.742
  760   1HD   LYS  94          2HD       LYS  94   9.354  -0.467  -9.887
  761   2HD   LYS  94          1HD       LYS  94   9.524   1.218 -10.382
  762   1HE   LYS  94          2HE       LYS  94  10.878  -0.733 -12.141
  763   2HE   LYS  94          1HE       LYS  94   9.118  -0.845 -12.125
  764   1HZ   LYS  94          1HZ       LYS  94   9.227   0.821 -13.589
  765   2HZ   LYS  94          2HZ       LYS  94  10.823   1.229 -13.176
  766   3HZ   LYS  94          3HZ       LYS  94   9.527   1.812 -12.246
  767    H    ARG  95           H        ARG  95  14.101  -0.641  -9.119
  768    HA   ARG  95           HA       ARG  95  15.443  -0.153 -11.735
  769   1HB   ARG  95          2HB       ARG  95  16.111   1.222  -9.133
  770   2HB   ARG  95          1HB       ARG  95  16.373   1.798 -10.779
  771   1HG   ARG  95          2HG       ARG  95  13.629   1.334  -9.585
  772   2HG   ARG  95          1HG       ARG  95  14.436   2.902  -9.597
  773   1HD   ARG  95          2HD       ARG  95  14.416   1.560 -12.215
  774   2HD   ARG  95          1HD       ARG  95  12.810   1.960 -11.608
  775    HE   ARG  95           HE       ARG  95  14.399   4.257 -11.230
  776   1HH1  ARG  95          1HH2      ARG  95  15.017   2.636 -13.968
  777   2HH1  ARG  95          2HH2      ARG  95  14.232   3.723 -15.066
  778   1HH2  ARG  95          1HH1      ARG  95  12.624   5.507 -12.564
  779   2HH2  ARG  95          2HH1      ARG  95  12.877   5.347 -14.271
  780    H    ARG  96           H        ARG  96  17.893  -0.141 -11.638
  781    HA   ARG  96           HA       ARG  96  19.170  -1.677  -9.508
  782   1HB   ARG  96          2HB       ARG  96  18.338  -2.957 -12.064
  783   2HB   ARG  96          1HB       ARG  96  19.962  -3.331 -11.486
  784   1HG   ARG  96          2HG       ARG  96  18.716  -3.664  -9.174
  785   2HG   ARG  96          1HG       ARG  96  17.317  -3.928 -10.214
  786   1HD   ARG  96          2HD       ARG  96  19.241  -5.433 -11.472
  787   2HD   ARG  96          1HD       ARG  96  19.675  -5.635  -9.774
  788    HE   ARG  96           HE       ARG  96  16.995  -6.321 -10.908
  789   1HH1  ARG  96          1HH1      ARG  96  17.632  -5.766  -7.875
  790   2HH1  ARG  96          2HH1      ARG  96  17.701  -7.396  -7.298
  791   1HH2  ARG  96          1HH2      ARG  96  17.887  -8.793 -10.465
  792   2HH2  ARG  96          2HH2      ARG  96  17.844  -9.109  -8.762
  793    H    GLN  97           H        GLN  97  19.573  -0.861 -12.976
  794    HA   GLN  97           HA       GLN  97  22.418  -0.286 -12.550
  795   1HB   GLN  97          2HB       GLN  97  20.560  -0.248 -14.913
  796   2HB   GLN  97          1HB       GLN  97  22.101   0.602 -15.010
  797   1HG   GLN  97          2HG       GLN  97  22.427  -2.037 -13.833
  798   2HG   GLN  97          1HG       GLN  97  21.692  -2.131 -15.435
  799   1HE2  GLN  97          1HE2      GLN  97  24.633  -2.448 -14.184
  800   2HE2  GLN  97          2HE2      GLN  97  25.584  -1.663 -15.351
  801    H    ARG  98           H        ARG  98  23.025   1.955 -13.847
  802    HA   ARG  98           HA       ARG  98  21.514   4.063 -12.364
  803   1HB   ARG  98          2HB       ARG  98  24.299   4.291 -13.527
  804   2HB   ARG  98          1HB       ARG  98  23.531   5.364 -12.357
  805   1HG   ARG  98          2HG       ARG  98  24.187   4.065 -10.641
  806   2HG   ARG  98          1HG       ARG  98  23.495   2.630 -11.400
  807   1HD   ARG  98          2HD       ARG  98  25.866   2.246 -11.163
  808   2HD   ARG  98          1HD       ARG  98  25.546   2.529 -12.874
  809    HE   ARG  98           HE       ARG  98  26.786   4.520 -11.026
  810   1HH1  ARG  98          1HH1      ARG  98  27.810   2.895 -13.572
  811   2HH1  ARG  98          2HH1      ARG  98  27.985   4.221 -14.673
  812   1HH2  ARG  98          1HH2      ARG  98  26.209   6.444 -12.690
  813   2HH2  ARG  98          2HH2      ARG  98  27.079   6.231 -14.173
  814    H    GLY  99           H        GLY  99  20.575   5.718 -13.525
  815   1HA   GLY  99          2HA       GLY  99  20.597   5.456 -16.468
  816   2HA   GLY  99          1HA       GLY  99  19.506   6.475 -15.531
  817    H    VAL 100           H        VAL 100  20.380   7.901 -17.479
  818    HA   VAL 100           HA       VAL 100  22.369   9.720 -16.288
  819    HB   VAL 100           HB       VAL 100  23.872   8.285 -17.495
  820   1HG1  VAL 100          1HG1      VAL 100  23.103   8.382 -20.174
  821   2HG1  VAL 100          2HG1      VAL 100  21.592   8.102 -19.308
  822   3HG1  VAL 100          3HG1      VAL 100  22.948   6.992 -19.100
  823   1HG2  VAL 100          1HG2      VAL 100  23.622  10.971 -18.031
  824   2HG2  VAL 100          2HG2      VAL 100  23.590  10.278 -19.653
  825   3HG2  VAL 100          3HG2      VAL 100  24.958   9.963 -18.587
  826    H    SER 101           HN       SER 101  21.112  11.543 -16.378
  827    HA   SER 101           HA       SER 101  19.539  12.052 -18.857
  828   1HB   SER 101          2HB       SER 101  19.430  13.553 -16.228
  829   2HB   SER 101          1HB       SER 101  18.277  13.648 -17.556
  830    HG   SER 101           HG       SER 101  17.761  11.470 -17.172
  Start of MODEL    3
    1   1H    GLU   1          1HT       GLU   1  14.694  15.586  -6.932
    2   2H    GLU   1          2HT       GLU   1  14.952  15.920  -8.578
    3   3H    GLU   1          3HT       GLU   1  16.275  15.655  -7.545
    4    HA   GLU   1           HA       GLU   1  14.293  13.687  -8.525
    5   1HB   GLU   1          2HB       GLU   1  17.075  14.385  -9.074
    6   2HB   GLU   1          1HB       GLU   1  16.892  12.684  -8.646
    7   1HG   GLU   1          2HG       GLU   1  14.897  13.827 -10.544
    8   2HG   GLU   1          1HG       GLU   1  16.530  13.561 -11.156
    9    H    SER   2           H        SER   2  13.828  14.039  -5.935
   10    HA   SER   2           HA       SER   2  15.525  12.029  -4.513
   11   1HB   SER   2          2HB       SER   2  15.039  13.128  -2.475
   12   2HB   SER   2          1HB       SER   2  15.309  14.444  -3.614
   13    HG   SER   2           HG       SER   2  12.962  14.365  -3.939
   14    H    LYS   3           H        LYS   3  13.622  10.976  -6.203
   15    HA   LYS   3           HA       LYS   3  11.773   9.735  -4.257
   16   1HB   LYS   3          2HB       LYS   3  10.867  11.801  -5.900
   17   2HB   LYS   3          1HB       LYS   3  10.368  10.336  -6.744
   18   1HG   LYS   3          2HG       LYS   3   9.616   9.585  -4.317
   19   2HG   LYS   3          1HG       LYS   3   9.575  11.325  -4.030
   20   1HD   LYS   3          2HD       LYS   3   8.234  10.098  -6.440
   21   2HD   LYS   3          1HD       LYS   3   7.404  10.222  -4.888
   22   1HE   LYS   3          2HE       LYS   3   8.329  12.739  -5.060
   23   2HE   LYS   3          1HE       LYS   3   8.212  12.375  -6.782
   24   1HZ   LYS   3          1HZ       LYS   3   6.165  13.184  -5.210
   25   2HZ   LYS   3          2HZ       LYS   3   5.934  11.501  -5.262
   26   3HZ   LYS   3          3HZ       LYS   3   5.997  12.398  -6.703
   27    HA   PRO   4           HA       PRO   4  13.361   6.728  -7.329
   28   1HB   PRO   4          2HB       PRO   4  14.802   5.245  -5.550
   29   2HB   PRO   4          1HB       PRO   4  15.434   6.697  -6.344
   30   1HG   PRO   4          2HG       PRO   4  14.660   6.327  -3.512
   31   2HG   PRO   4          1HG       PRO   4  15.669   7.589  -4.236
   32   1HD   PRO   4          2HD       PRO   4  12.867   7.755  -3.484
   33   2HD   PRO   4          1HD       PRO   4  13.903   9.039  -4.146
   34    HA   PRO   5           HA       PRO   5  10.770   3.731  -4.543
   35   1HB   PRO   5          2HB       PRO   5   8.156   4.567  -4.715
   36   2HB   PRO   5          1HB       PRO   5   9.238   4.974  -3.374
   37   1HG   PRO   5          2HG       PRO   5   8.312   6.685  -5.633
   38   2HG   PRO   5          1HG       PRO   5   8.822   7.159  -4.004
   39   1HD   PRO   5          2HD       PRO   5  10.383   7.366  -6.341
   40   2HD   PRO   5          1HD       PRO   5  10.984   7.486  -4.672
   41    H    TYR   6           H        TYR   6   8.643   2.464  -5.399
   42    HA   TYR   6           HA       TYR   6   9.236   1.813  -8.173
   43   1HB   TYR   6          2HB       TYR   6   6.900   0.750  -6.605
   44   2HB   TYR   6          1HB       TYR   6   7.844  -0.058  -7.858
   45    HD1  TYR   6           HD1      TYR   6  10.274  -0.624  -7.383
   46    HD2  TYR   6           HD2      TYR   6   7.530   0.605  -4.315
   47    HE1  TYR   6           HE1      TYR   6  11.778  -1.579  -5.658
   48    HE2  TYR   6           HE2      TYR   6   9.035  -0.350  -2.590
   49    HH   TYR   6           HH       TYR   6  11.280  -2.513  -3.105
   50    H    SER   7           H        SER   7   7.629   1.812  -9.893
   51    HA   SER   7           HA       SER   7   6.294   4.241 -10.292
   52   1HB   SER   7          2HB       SER   7   5.976   1.490 -11.433
   53   2HB   SER   7          1HB       SER   7   4.715   2.671 -11.769
   54    HG   SER   7           HG       SER   7   7.461   2.737 -12.411
   55    H    TYR   8           H        TYR   8   3.752   4.393 -10.445
   56    HA   TYR   8           HA       TYR   8   2.778   3.618  -7.777
   57   1HB   TYR   8          2HB       TYR   8   1.577   5.349  -9.947
   58   2HB   TYR   8          1HB       TYR   8   0.842   5.083  -8.360
   59    HD1  TYR   8           HD1      TYR   8   3.150   4.994  -6.579
   60    HD2  TYR   8           HD2      TYR   8   2.385   7.581  -9.920
   61    HE1  TYR   8           HE1      TYR   8   4.667   6.691  -5.604
   62    HE2  TYR   8           HE2      TYR   8   3.902   9.283  -8.942
   63    HH   TYR   8           HH       TYR   8   5.635   9.529  -7.399
   64    H    ALA   9           H        ALA   9   3.044   1.894 -10.403
   65    HA   ALA   9           HA       ALA   9   0.337   0.633 -10.165
   66   1HB   ALA   9          1HB       ALA   9   0.595  -0.193 -12.416
   67   2HB   ALA   9          2HB       ALA   9   2.282   0.317 -12.471
   68   3HB   ALA   9          3HB       ALA   9   0.996   1.524 -12.461
   69    H    GLN  10           H        GLN  10   3.807   0.222 -10.203
   70    HA   GLN  10           HA       GLN  10   3.638  -2.678  -9.599
   71   1HB   GLN  10          2HB       GLN  10   5.421  -1.758 -11.136
   72   2HB   GLN  10          1HB       GLN  10   6.069  -0.859  -9.764
   73   1HG   GLN  10          2HG       GLN  10   5.707  -3.528  -8.891
   74   2HG   GLN  10          1HG       GLN  10   6.501  -3.614 -10.463
   75   1HE2  GLN  10          1HE2      GLN  10   8.646  -2.676 -10.667
   76   2HE2  GLN  10          2HE2      GLN  10   9.545  -2.196  -9.309
   77    H    LEU  11           H        LEU  11   4.170   0.443  -8.167
   78    HA   LEU  11           HA       LEU  11   5.257  -0.388  -5.647
   79   1HB   LEU  11          2HB       LEU  11   5.337   1.940  -6.353
   80   2HB   LEU  11          1HB       LEU  11   3.580   2.005  -6.466
   81    HG   LEU  11           HG       LEU  11   3.769   1.241  -3.913
   82   1HD1  LEU  11          1HD1      LEU  11   6.455   2.108  -4.721
   83   2HD1  LEU  11          2HD1      LEU  11   5.948   1.213  -3.288
   84   3HD1  LEU  11          3HD1      LEU  11   5.835   2.972  -3.315
   85   1HD2  LEU  11          1HD2      LEU  11   3.092   3.524  -5.270
   86   2HD2  LEU  11          2HD2      LEU  11   4.410   4.104  -4.251
   87   3HD2  LEU  11          3HD2      LEU  11   2.994   3.350  -3.517
   88    H    ILE  12           H        ILE  12   2.013  -0.059  -6.959
   89    HA   ILE  12           HA       ILE  12   0.577  -0.562  -4.501
   90    HB   ILE  12           HB       ILE  12  -0.513  -1.500  -7.101
   91   1HG1  ILE  12          2HG1      ILE  12   0.482   0.486  -7.950
   92   2HG1  ILE  12          1HG1      ILE  12  -1.175   0.924  -7.568
   93   1HG2  ILE  12          1HG2      ILE  12  -2.442  -1.287  -5.996
   94   2HG2  ILE  12          2HG2      ILE  12  -2.076   0.383  -5.559
   95   3HG2  ILE  12          3HG2      ILE  12  -1.487  -0.942  -4.554
   96   1HD1  ILE  12          1HD1      ILE  12   0.839   1.289  -5.414
   97   2HD1  ILE  12          2HD1      ILE  12  -0.578   2.244  -5.823
   98   3HD1  ILE  12          3HD1      ILE  12   0.892   2.408  -6.774
   99    H    VAL  13           H        VAL  13   1.418  -2.620  -7.268
  100    HA   VAL  13           HA       VAL  13   0.346  -5.038  -6.398
  101    HB   VAL  13           HB       VAL  13   2.952  -4.546  -7.862
  102   1HG1  VAL  13          1HG1      VAL  13   3.130  -6.790  -7.280
  103   2HG1  VAL  13          2HG1      VAL  13   2.206  -6.915  -8.776
  104   3HG1  VAL  13          3HG1      VAL  13   1.383  -7.019  -7.221
  105   1HG2  VAL  13          1HG2      VAL  13   0.172  -5.196  -8.884
  106   2HG2  VAL  13          2HG2      VAL  13   1.588  -4.806  -9.859
  107   3HG2  VAL  13          3HG2      VAL  13   0.851  -3.571  -8.838
  108    H    GLN  14           H        GLN  14   3.324  -3.456  -5.336
  109    HA   GLN  14           HA       GLN  14   4.182  -5.767  -3.775
  110   1HB   GLN  14          2HB       GLN  14   5.614  -3.752  -4.661
  111   2HB   GLN  14          1HB       GLN  14   5.057  -2.949  -3.191
  112   1HG   GLN  14          2HG       GLN  14   6.106  -4.513  -1.787
  113   2HG   GLN  14          1HG       GLN  14   6.221  -5.723  -3.065
  114   1HE2  GLN  14          1HE2      GLN  14   7.028  -2.407  -3.854
  115   2HE2  GLN  14          2HE2      GLN  14   8.706  -2.632  -3.938
  116    H    ALA  15           H        ALA  15   2.308  -2.842  -3.255
  117    HA   ALA  15           HA       ALA  15   2.163  -2.915  -0.415
  118   1HB   ALA  15          1HB       ALA  15   0.049  -1.920  -2.350
  119   2HB   ALA  15          2HB       ALA  15   1.448  -0.985  -1.822
  120   3HB   ALA  15          3HB       ALA  15   0.214  -1.462  -0.655
  121    H    ILE  16           H        ILE  16  -0.216  -4.227  -2.806
  122    HA   ILE  16           HA       ILE  16  -1.601  -5.573  -0.585
  123    HB   ILE  16           HB       ILE  16  -2.910  -6.632  -2.600
  124   1HG1  ILE  16          2HG1      ILE  16  -2.968  -5.079  -4.516
  125   2HG1  ILE  16          1HG1      ILE  16  -1.575  -4.230  -3.900
  126   1HG2  ILE  16          1HG2      ILE  16  -4.021  -5.144  -1.145
  127   2HG2  ILE  16          2HG2      ILE  16  -4.221  -4.426  -2.743
  128   3HG2  ILE  16          3HG2      ILE  16  -3.015  -3.782  -1.633
  129   1HD1  ILE  16          1HD1      ILE  16  -1.522  -6.383  -5.629
  130   2HD1  ILE  16          2HD1      ILE  16  -1.212  -7.139  -4.070
  131   3HD1  ILE  16          3HD1      ILE  16  -0.163  -5.845  -4.648
  132    H    SER  17           H        SER  17   0.624  -6.483  -3.161
  133    HA   SER  17           HA       SER  17   0.283  -9.328  -2.849
  134   1HB   SER  17          2HB       SER  17   2.731  -7.768  -3.748
  135   2HB   SER  17          1HB       SER  17   2.498  -9.502  -3.945
  136    HG   SER  17           HG       SER  17   0.838  -9.112  -5.345
  137    H    SER  18           H        SER  18   1.717  -6.832  -1.014
  138    HA   SER  18           HA       SER  18   3.156  -8.816   0.685
  139   1HB   SER  18          2HB       SER  18   3.461  -5.808   0.494
  140   2HB   SER  18          1HB       SER  18   4.363  -6.845   1.594
  141    HG   SER  18           HG       SER  18   4.302  -7.302  -1.194
  142    H    ALA  19           H        ALA  19   0.247  -7.103   0.482
  143    HA   ALA  19           HA       ALA  19   0.113  -6.572   3.395
  144   1HB   ALA  19          1HB       ALA  19  -2.115  -6.358   1.352
  145   2HB   ALA  19          2HB       ALA  19  -0.961  -5.060   1.655
  146   3HB   ALA  19          3HB       ALA  19  -2.041  -5.596   2.941
  147    H    GLN  20           H        GLN  20  -1.005  -7.920   4.842
  148    HA   GLN  20           HA       GLN  20  -1.307 -10.641   4.398
  149   1HB   GLN  20          2HB       GLN  20  -3.386  -9.152   6.007
  150   2HB   GLN  20          1HB       GLN  20  -2.675 -10.734   6.329
  151   1HG   GLN  20          2HG       GLN  20  -1.403  -8.013   6.666
  152   2HG   GLN  20          1HG       GLN  20  -1.631  -9.269   7.883
  153   1HE2  GLN  20          1HE2      GLN  20   0.909  -7.926   6.729
  154   2HE2  GLN  20          2HE2      GLN  20   1.896  -9.238   6.297
  155    H    ASP  21           H        ASP  21  -3.862  -8.186   4.049
  156    HA   ASP  21           HA       ASP  21  -5.469 -10.082   2.445
  157   1HB   ASP  21          2HB       ASP  21  -6.071  -7.223   3.276
  158   2HB   ASP  21          1HB       ASP  21  -7.210  -8.359   2.551
  159    H    ARG  22           H        ARG  22  -5.150 -10.085   0.239
  160    HA   ARG  22           HA       ARG  22  -3.422  -8.315  -1.138
  161   1HB   ARG  22          2HB       ARG  22  -5.704  -9.923  -2.317
  162   2HB   ARG  22          1HB       ARG  22  -4.282  -9.330  -3.176
  163   1HG   ARG  22          2HG       ARG  22  -2.823 -10.731  -1.814
  164   2HG   ARG  22          1HG       ARG  22  -4.193 -11.260  -0.839
  165   1HD   ARG  22          2HD       ARG  22  -5.017 -12.641  -2.491
  166   2HD   ARG  22          1HD       ARG  22  -4.375 -11.640  -3.793
  167    HE   ARG  22           HE       ARG  22  -2.723 -13.350  -3.785
  168   1HH1  ARG  22          1HH1      ARG  22  -3.761 -14.125  -0.888
  169   2HH1  ARG  22          2HH1      ARG  22  -2.255 -14.046  -0.034
  170   1HH2  ARG  22          1HH2      ARG  22  -0.594 -12.375  -2.574
  171   2HH2  ARG  22          2HH2      ARG  22  -0.465 -13.059  -0.988
  172    H    GLN  23           H        GLN  23  -6.453  -7.580   0.111
  173    HA   GLN  23           HA       GLN  23  -6.957  -5.529  -1.985
  174   1HB   GLN  23          2HB       GLN  23  -9.199  -5.395  -0.562
  175   2HB   GLN  23          1HB       GLN  23  -8.987  -6.640  -1.792
  176   1HG   GLN  23          2HG       GLN  23  -8.196  -8.217  -0.063
  177   2HG   GLN  23          1HG       GLN  23  -8.422  -6.975   1.169
  178   1HE2  GLN  23          1HE2      GLN  23  -9.973  -8.819   1.995
  179   2HE2  GLN  23          2HE2      GLN  23 -11.572  -8.759   1.429
  180    H    LEU  24           H        LEU  24  -5.725  -3.794  -1.341
  181    HA   LEU  24           HA       LEU  24  -5.724  -2.997   1.511
  182   1HB   LEU  24          2HB       LEU  24  -4.230  -2.029  -0.939
  183   2HB   LEU  24          1HB       LEU  24  -4.190  -1.152   0.590
  184    HG   LEU  24           HG       LEU  24  -3.424  -4.063   0.260
  185   1HD1  LEU  24          1HD1      LEU  24  -1.829  -1.506   0.385
  186   2HD1  LEU  24          2HD1      LEU  24  -1.694  -2.822  -0.779
  187   3HD1  LEU  24          3HD1      LEU  24  -1.125  -3.045   0.875
  188   1HD2  LEU  24          1HD2      LEU  24  -3.859  -2.246   2.550
  189   2HD2  LEU  24          2HD2      LEU  24  -2.365  -3.180   2.613
  190   3HD2  LEU  24          3HD2      LEU  24  -3.917  -4.007   2.485
  191    H    THR  25           H        THR  25  -6.379  -0.802   2.113
  192    HA   THR  25           HA       THR  25  -8.707   0.096   0.549
  193    HB   THR  25           HB       THR  25  -9.267   1.420   2.426
  194    HG1  THR  25           HG1      THR  25  -7.801   2.275   3.743
  195   1HG2  THR  25          1HG2      THR  25  -9.478  -0.894   3.037
  196   2HG2  THR  25          2HG2      THR  25  -8.776  -0.059   4.421
  197   3HG2  THR  25          3HG2      THR  25  -7.750  -1.026   3.362
  198    H    LEU  26           H        LEU  26  -8.764   2.740   0.532
  199    HA   LEU  26           HA       LEU  26  -6.813   3.520  -1.402
  200   1HB   LEU  26          2HB       LEU  26  -9.127   4.698  -0.356
  201   2HB   LEU  26          1HB       LEU  26  -7.832   5.790   0.136
  202    HG   LEU  26           HG       LEU  26  -8.111   4.747  -2.691
  203   1HD1  LEU  26          1HD1      LEU  26 -10.116   6.007  -2.271
  204   2HD1  LEU  26          2HD1      LEU  26  -9.021   7.078  -3.147
  205   3HD1  LEU  26          3HD1      LEU  26  -9.223   7.254  -1.403
  206   1HD2  LEU  26          1HD2      LEU  26  -6.098   5.745  -2.894
  207   2HD2  LEU  26          2HD2      LEU  26  -6.178   6.335  -1.233
  208   3HD2  LEU  26          3HD2      LEU  26  -6.881   7.286  -2.541
  209    H    SER  27           H        SER  27  -6.953   3.925   2.111
  210    HA   SER  27           HA       SER  27  -4.259   5.174   2.066
  211   1HB   SER  27          2HB       SER  27  -6.578   5.375   3.784
  212   2HB   SER  27          1HB       SER  27  -5.147   4.951   4.719
  213    HG   SER  27           HG       SER  27  -5.583   7.275   4.271
  214    H    GLY  28           H        GLY  28  -4.643   2.310   1.470
  215   1HA   GLY  28          2HA       GLY  28  -3.457   1.044   3.901
  216   2HA   GLY  28          1HA       GLY  28  -4.135   0.164   2.526
  217    H    ILE  29           H        ILE  29  -2.911   1.866   0.577
  218    HA   ILE  29           HA       ILE  29  -0.387   0.545   0.241
  219    HB   ILE  29           HB       ILE  29  -2.129   1.558  -1.468
  220   1HG1  ILE  29          2HG1      ILE  29   0.860   1.701  -1.884
  221   2HG1  ILE  29          1HG1      ILE  29  -0.152   0.268  -2.081
  222   1HG2  ILE  29          1HG2      ILE  29  -1.968   3.878  -0.791
  223   2HG2  ILE  29          2HG2      ILE  29  -1.251   3.712  -2.393
  224   3HG2  ILE  29          3HG2      ILE  29  -0.214   3.854  -0.979
  225   1HD1  ILE  29          1HD1      ILE  29  -1.380   2.382  -3.513
  226   2HD1  ILE  29          2HD1      ILE  29  -0.668   0.903  -4.155
  227   3HD1  ILE  29          3HD1      ILE  29   0.324   2.348  -3.964
  228    H    TYR  30           H        TYR  30  -1.393   3.733   1.328
  229    HA   TYR  30           HA       TYR  30   1.215   4.912   1.332
  230   1HB   TYR  30          2HB       TYR  30  -1.062   5.645   3.176
  231   2HB   TYR  30          1HB       TYR  30   0.205   6.701   2.544
  232    HD1  TYR  30           HD1      TYR  30  -3.022   6.685   2.250
  233    HD2  TYR  30           HD2      TYR  30   0.298   5.673  -0.275
  234    HE1  TYR  30           HE1      TYR  30  -4.413   7.111   0.243
  235    HE2  TYR  30           HE2      TYR  30  -1.087   6.102  -2.280
  236    HH   TYR  30           HH       TYR  30  -3.968   7.767  -2.202
  237    H    ALA  31           H        ALA  31  -0.728   3.468   3.951
  238    HA   ALA  31           HA       ALA  31   1.335   3.646   5.922
  239   1HB   ALA  31          1HB       ALA  31  -1.164   3.041   6.235
  240   2HB   ALA  31          2HB       ALA  31   0.009   2.173   7.226
  241   3HB   ALA  31          3HB       ALA  31  -0.684   1.401   5.799
  242    H    HIS  32           H        HIS  32   0.951   1.635   3.127
  243    HA   HIS  32           HA       HIS  32   2.608  -0.554   4.094
  244   1HB   HIS  32          2HB       HIS  32   0.950  -0.912   2.311
  245   2HB   HIS  32          1HB       HIS  32   1.820   0.217   1.270
  246    HD1  HIS  32           HD1      HIS  32   2.112  -3.193   2.833
  247    HD2  HIS  32           HD2      HIS  32   4.244  -0.793   0.173
  248    HE1  HIS  32           HE1      HIS  32   3.931  -4.654   1.851
  249    H    ILE  33           H        ILE  33   3.238   1.616   1.319
  250    HA   ILE  33           HA       ILE  33   6.025   1.141   1.237
  251    HB   ILE  33           HB       ILE  33   6.129   3.307  -0.024
  252   1HG1  ILE  33          2HG1      ILE  33   3.579   4.050  -0.493
  253   2HG1  ILE  33          1HG1      ILE  33   3.423   3.518   1.183
  254   1HG2  ILE  33          1HG2      ILE  33   5.688   1.555  -1.470
  255   2HG2  ILE  33          2HG2      ILE  33   4.212   2.494  -1.686
  256   3HG2  ILE  33          3HG2      ILE  33   4.214   1.090  -0.620
  257   1HD1  ILE  33          1HD1      ILE  33   5.154   5.705   0.055
  258   2HD1  ILE  33          2HD1      ILE  33   5.585   4.925   1.576
  259   3HD1  ILE  33          3HD1      ILE  33   4.045   5.770   1.424
  260    H    THR  34           H        THR  34   4.192   3.499   3.127
  261    HA   THR  34           HA       THR  34   6.444   5.061   3.966
  262    HB   THR  34           HB       THR  34   4.949   5.722   5.890
  263    HG1  THR  34           HG1      THR  34   3.483   4.309   6.336
  264   1HG2  THR  34          1HG2      THR  34   4.926   6.690   3.488
  265   2HG2  THR  34          2HG2      THR  34   3.553   7.047   4.535
  266   3HG2  THR  34          3HG2      THR  34   3.418   5.797   3.298
  267    H    LYS  35           H        LYS  35   5.178   1.979   5.013
  268    HA   LYS  35           HA       LYS  35   6.696   1.953   7.514
  269   1HB   LYS  35          2HB       LYS  35   4.515   0.554   6.598
  270   2HB   LYS  35          1HB       LYS  35   5.806  -0.635   6.422
  271   1HG   LYS  35          2HG       LYS  35   5.684  -1.029   8.634
  272   2HG   LYS  35          1HG       LYS  35   6.233   0.622   8.918
  273   1HD   LYS  35          2HD       LYS  35   3.914   1.428   8.833
  274   2HD   LYS  35          1HD       LYS  35   3.347  -0.208   8.503
  275   1HE   LYS  35          2HE       LYS  35   3.044   0.014  10.832
  276   2HE   LYS  35          1HE       LYS  35   4.577  -0.848  10.697
  277   1HZ   LYS  35          1HZ       LYS  35   5.464   1.628  10.621
  278   2HZ   LYS  35          2HZ       LYS  35   5.221   0.798  12.084
  279   3HZ   LYS  35          3HZ       LYS  35   4.054   1.899  11.525
  280    H    HIS  36           H        HIS  36   6.862  -0.183   4.629
  281    HA   HIS  36           HA       HIS  36   9.528  -1.082   5.294
  282   1HB   HIS  36          2HB       HIS  36   7.715  -1.359   2.916
  283   2HB   HIS  36          1HB       HIS  36   9.408  -1.830   2.774
  284    HD1  HIS  36           HD1      HIS  36  10.257  -3.687   4.503
  285    HD2  HIS  36           HD2      HIS  36   6.124  -3.176   4.332
  286    HE1  HIS  36           HE1      HIS  36   9.238  -5.711   5.636
  287    H    TYR  37           H        TYR  37   8.263   1.207   2.880
  288    HA   TYR  37           HA       TYR  37  10.947   1.944   2.000
  289   1HB   TYR  37          2HB       TYR  37   8.279   2.369   1.045
  290   2HB   TYR  37          1HB       TYR  37   9.045   3.946   1.254
  291    HD1  TYR  37           HD1      TYR  37  10.000   4.727  -0.717
  292    HD2  TYR  37           HD2      TYR  37  10.208   0.540   0.213
  293    HE1  TYR  37           HE1      TYR  37  11.317   4.331  -2.781
  294    HE2  TYR  37           HE2      TYR  37  11.524   0.143  -1.845
  295    HH   TYR  37           HH       TYR  37  13.157   1.847  -3.338
  296    HA   PRO  38           HA       PRO  38  11.337   4.752   5.464
  297   1HB   PRO  38          2HB       PRO  38  13.958   5.397   4.955
  298   2HB   PRO  38          1HB       PRO  38  13.455   3.911   5.780
  299   1HG   PRO  38          2HG       PRO  38  14.427   4.270   2.979
  300   2HG   PRO  38          1HG       PRO  38  14.551   2.853   4.036
  301   1HD   PRO  38          2HD       PRO  38  12.688   3.175   1.942
  302   2HD   PRO  38          1HD       PRO  38  12.585   1.970   3.243
  303    H    TYR  39           H        TYR  39  12.340   5.524   2.133
  304    HA   TYR  39           HA       TYR  39  12.630   8.334   2.465
  305   1HB   TYR  39          2HB       TYR  39  13.384   7.398   0.403
  306   2HB   TYR  39          1HB       TYR  39  11.821   6.644   0.088
  307    HD1  TYR  39           HD1      TYR  39  13.394  10.008   0.614
  308    HD2  TYR  39           HD2      TYR  39  10.240   7.753  -1.237
  309    HE1  TYR  39           HE1      TYR  39  12.642  12.043  -0.587
  310    HE2  TYR  39           HE2      TYR  39   9.488   9.789  -2.437
  311    HH   TYR  39           HH       TYR  39  11.269  12.857  -2.144
  312    H    TYR  40           H        TYR  40   9.785   6.572   1.177
  313    HA   TYR  40           HA       TYR  40   8.033   8.814   1.233
  314   1HB   TYR  40          2HB       TYR  40   7.731   5.863   1.057
  315   2HB   TYR  40          1HB       TYR  40   6.312   6.761   1.595
  316    HD1  TYR  40           HD1      TYR  40   6.467   9.271   0.173
  317    HD2  TYR  40           HD2      TYR  40   7.414   5.314  -1.209
  318    HE1  TYR  40           HE1      TYR  40   6.021   9.983  -2.167
  319    HE2  TYR  40           HE2      TYR  40   6.966   6.028  -3.549
  320    HH   TYR  40           HH       TYR  40   5.279   8.598  -4.397
  321    H    ARG  41           H        ARG  41   8.022   9.966   3.183
  322    HA   ARG  41           HA       ARG  41   6.813   8.536   5.494
  323   1HB   ARG  41          2HB       ARG  41   9.406   8.777   5.635
  324   2HB   ARG  41          1HB       ARG  41   9.072  10.481   5.939
  325   1HG   ARG  41          2HG       ARG  41   7.334   9.450   7.680
  326   2HG   ARG  41          1HG       ARG  41   8.464   8.097   7.632
  327   1HD   ARG  41          2HD       ARG  41  10.088  10.375   7.788
  328   2HD   ARG  41          1HD       ARG  41   8.765  10.690   8.909
  329    HE   ARG  41           HE       ARG  41   9.393   8.670  10.132
  330   1HH1  ARG  41          1HH2      ARG  41  11.163   8.925   7.229
  331   2HH1  ARG  41          2HH2      ARG  41  12.628   8.276   7.887
  332   1HH2  ARG  41          1HH1      ARG  41  11.412   8.113  11.130
  333   2HH2  ARG  41          2HH1      ARG  41  12.768   7.817  10.096
  334    H    THR  42           H        THR  42   7.927  11.725   4.312
  335    HA   THR  42           HA       THR  42   5.281  12.874   4.658
  336    HB   THR  42           HB       THR  42   7.010  14.508   6.300
  337    HG1  THR  42           HG1      THR  42   8.067  12.783   7.037
  338   1HG2  THR  42          1HG2      THR  42   4.318  13.736   6.110
  339   2HG2  THR  42          2HG2      THR  42   5.014  14.861   7.277
  340   3HG2  THR  42          3HG2      THR  42   4.856  13.153   7.686
  341    H    ALA  43           H        ALA  43   7.128  12.653   2.506
  342    HA   ALA  43           HA       ALA  43   8.542  15.190   2.201
  343   1HB   ALA  43          1HB       ALA  43   8.666  14.296  -0.253
  344   2HB   ALA  43          2HB       ALA  43   8.021  12.809   0.440
  345   3HB   ALA  43          3HB       ALA  43   9.561  13.451   1.009
  346    H    ASP  44           H        ASP  44   6.459  13.979  -0.361
  347    HA   ASP  44           HA       ASP  44   4.809  16.457  -0.103
  348   1HB   ASP  44          2HB       ASP  44   6.403  15.444  -2.395
  349   2HB   ASP  44          1HB       ASP  44   4.797  16.065  -2.781
  350    H    LYS  45           H        LYS  45   2.619  16.233  -0.737
  351    HA   LYS  45           HA       LYS  45   1.644  13.445  -0.705
  352   1HB   LYS  45          2HB       LYS  45   0.114  16.065  -0.684
  353   2HB   LYS  45          1HB       LYS  45  -0.575  14.464  -0.409
  354   1HG   LYS  45          2HG       LYS  45   1.739  15.331   1.283
  355   2HG   LYS  45          1HG       LYS  45   0.141  15.993   1.636
  356   1HD   LYS  45          2HD       LYS  45  -0.753  13.649   1.699
  357   2HD   LYS  45          1HD       LYS  45   0.901  13.061   1.519
  358   1HE   LYS  45          2HE       LYS  45   0.139  13.139   3.905
  359   2HE   LYS  45          1HE       LYS  45   1.563  14.133   3.599
  360   1HZ   LYS  45          1HZ       LYS  45  -0.374  15.136   4.918
  361   2HZ   LYS  45          2HZ       LYS  45  -1.146  15.284   3.411
  362   3HZ   LYS  45          3HZ       LYS  45   0.333  16.073   3.692
  363    H    GLY  46           H        GLY  46   3.000  14.072  -3.084
  364   1HA   GLY  46          2HA       GLY  46   1.035  14.841  -5.122
  365   2HA   GLY  46          1HA       GLY  46   2.698  14.322  -5.424
  366    H    TRP  47           H        TRP  47   2.943  11.864  -4.527
  367    HA   TRP  47           HA       TRP  47   1.413  10.247  -6.320
  368   1HB   TRP  47          2HB       TRP  47   2.537   8.361  -5.343
  369   2HB   TRP  47          1HB       TRP  47   3.695   9.685  -5.417
  370    HD1  TRP  47           HD1      TRP  47   3.714  11.231  -3.018
  371    HE1  TRP  47           HE1      TRP  47   3.856  10.309  -0.623
  372    HE3  TRP  47           HE3      TRP  47   2.005   6.468  -3.799
  373    HZ2  TRP  47           HZ2      TRP  47   3.332   7.886   0.780
  374    HZ3  TRP  47           HZ3      TRP  47   1.853   4.880  -1.905
  375    HH2  TRP  47           HH2      TRP  47   2.516   5.586   0.376
  376    H    GLN  48           H        GLN  48   0.519  11.582  -3.351
  377    HA   GLN  48           HA       GLN  48  -0.945   9.553  -2.082
  378   1HB   GLN  48          2HB       GLN  48  -0.619  12.126  -1.522
  379   2HB   GLN  48          1HB       GLN  48  -2.178  12.270  -2.331
  380   1HG   GLN  48          2HG       GLN  48  -2.410  11.925   0.129
  381   2HG   GLN  48          1HG       GLN  48  -3.163  10.634  -0.807
  382   1HE2  GLN  48          1HE2      GLN  48   0.343  10.771  -0.625
  383   2HE2  GLN  48          2HE2      GLN  48   0.530   9.436   0.406
  384    H    ASN  49           H        ASN  49  -2.473  11.975  -4.242
  385    HA   ASN  49           HA       ASN  49  -4.763  10.262  -4.720
  386   1HB   ASN  49          2HB       ASN  49  -5.421  11.985  -6.359
  387   2HB   ASN  49          1HB       ASN  49  -4.927  12.721  -4.834
  388   1HD2  ASN  49          1HD2      ASN  49  -4.505  14.687  -6.277
  389   2HD2  ASN  49          2HD2      ASN  49  -3.013  14.781  -7.080
  390    H    SER  50           H        SER  50  -1.622  10.324  -6.007
  391    HA   SER  50           HA       SER  50  -2.185   9.521  -8.712
  392   1HB   SER  50          2HB       SER  50   0.036  10.343  -7.997
  393   2HB   SER  50          1HB       SER  50   0.234   8.919  -6.981
  394    HG   SER  50           HG       SER  50   0.663   9.214  -9.621
  395    H    ILE  51           H        ILE  51  -1.433   7.666  -5.765
  396    HA   ILE  51           HA       ILE  51  -1.508   5.060  -6.830
  397    HB   ILE  51           HB       ILE  51  -1.816   6.331  -4.180
  398   1HG1  ILE  51          2HG1      ILE  51  -0.177   4.734  -3.574
  399   2HG1  ILE  51          1HG1      ILE  51  -0.630   3.662  -4.880
  400   1HG2  ILE  51          1HG2      ILE  51  -2.784   4.450  -3.035
  401   2HG2  ILE  51          2HG2      ILE  51  -2.850   3.503  -4.519
  402   3HG2  ILE  51          3HG2      ILE  51  -3.907   4.899  -4.313
  403   1HD1  ILE  51          1HD1      ILE  51   0.340   5.058  -6.535
  404   2HD1  ILE  51          2HD1      ILE  51   1.519   5.015  -5.224
  405   3HD1  ILE  51          3HD1      ILE  51   0.466   6.416  -5.418
  406    H    ARG  52           H        ARG  52  -4.253   6.860  -5.366
  407    HA   ARG  52           HA       ARG  52  -6.261   4.959  -5.855
  408   1HB   ARG  52          2HB       ARG  52  -6.670   6.958  -4.517
  409   2HB   ARG  52          1HB       ARG  52  -6.464   7.982  -5.938
  410   1HG   ARG  52          2HG       ARG  52  -8.399   5.939  -6.528
  411   2HG   ARG  52          1HG       ARG  52  -8.852   6.749  -5.029
  412   1HD   ARG  52          2HD       ARG  52  -9.731   8.356  -6.362
  413   2HD   ARG  52          1HD       ARG  52  -8.061   8.856  -6.628
  414    HE   ARG  52           HE       ARG  52  -8.161   7.183  -8.613
  415   1HH1  ARG  52          1HH1      ARG  52  -9.276   9.836  -9.304
  416   2HH1  ARG  52          2HH1      ARG  52 -10.849   9.443  -9.915
  417   1HH2  ARG  52          1HH2      ARG  52 -10.875   6.256  -8.548
  418   2HH2  ARG  52          2HH2      ARG  52 -11.754   7.416  -9.487
  419    H    HIS  53           H        HIS  53  -5.263   7.640  -7.997
  420    HA   HIS  53           HA       HIS  53  -7.066   6.955 -10.116
  421   1HB   HIS  53          2HB       HIS  53  -6.077   9.159 -10.035
  422   2HB   HIS  53          1HB       HIS  53  -4.450   8.483 -10.108
  423    HD1  HIS  53           HD1      HIS  53  -3.642   9.242 -12.371
  424    HD2  HIS  53           HD2      HIS  53  -7.447   7.547 -12.559
  425    HE1  HIS  53           HE1      HIS  53  -4.231   9.075 -14.828
  426    H    ASN  54           H        ASN  54  -3.960   5.684  -9.181
  427    HA   ASN  54           HA       ASN  54  -3.306   4.485 -11.730
  428   1HB   ASN  54          2HB       ASN  54  -2.277   4.305  -8.939
  429   2HB   ASN  54          1HB       ASN  54  -1.898   2.964 -10.026
  430   1HD2  ASN  54          1HD2      ASN  54  -0.841   6.035  -9.067
  431   2HD2  ASN  54          2HD2      ASN  54   0.130   6.403 -10.409
  432    H    LEU  55           H        LEU  55  -4.996   3.359  -8.829
  433    HA   LEU  55           HA       LEU  55  -5.188   0.620  -9.682
  434   1HB   LEU  55          2HB       LEU  55  -7.170   2.019  -7.890
  435   2HB   LEU  55          1HB       LEU  55  -6.694   0.323  -7.877
  436    HG   LEU  55           HG       LEU  55  -4.925   2.668  -7.138
  437   1HD1  LEU  55          1HD1      LEU  55  -6.717   1.986  -5.497
  438   2HD1  LEU  55          2HD1      LEU  55  -5.072   1.795  -4.890
  439   3HD1  LEU  55          3HD1      LEU  55  -5.978   0.386  -5.444
  440   1HD2  LEU  55          1HD2      LEU  55  -3.213   1.271  -7.589
  441   2HD2  LEU  55          2HD2      LEU  55  -4.334  -0.018  -8.026
  442   3HD2  LEU  55          3HD2      LEU  55  -3.832   0.183  -6.346
  443    H    SER  56           H        SER  56  -6.619   3.391 -10.943
  444    HA   SER  56           HA       SER  56  -9.129   2.041 -11.723
  445   1HB   SER  56          2HB       SER  56  -9.929   4.142 -11.970
  446   2HB   SER  56          1HB       SER  56  -8.413   4.707 -11.275
  447    HG   SER  56           HG       SER  56  -8.433   5.682 -13.197
  448    H    LEU  57           H        LEU  57  -6.334   3.551 -13.338
  449    HA   LEU  57           HA       LEU  57  -7.065   2.215 -15.858
  450   1HB   LEU  57          2HB       LEU  57  -5.489   3.633 -16.891
  451   2HB   LEU  57          1HB       LEU  57  -6.214   4.632 -15.642
  452    HG   LEU  57           HG       LEU  57  -3.679   3.069 -15.128
  453   1HD1  LEU  57          1HD1      LEU  57  -3.439   5.950 -15.704
  454   2HD1  LEU  57          2HD1      LEU  57  -3.838   4.953 -17.104
  455   3HD1  LEU  57          3HD1      LEU  57  -2.383   4.616 -16.168
  456   1HD2  LEU  57          1HD2      LEU  57  -4.507   3.864 -13.092
  457   2HD2  LEU  57          2HD2      LEU  57  -5.211   5.305 -13.829
  458   3HD2  LEU  57          3HD2      LEU  57  -3.467   5.199 -13.588
  459    H    ASN  58           H        ASN  58  -5.387   1.297 -13.138
  460    HA   ASN  58           HA       ASN  58  -3.017   0.133 -14.240
  461   1HB   ASN  58          2HB       ASN  58  -4.600  -0.301 -11.740
  462   2HB   ASN  58          1HB       ASN  58  -3.470  -1.559 -12.229
  463   1HD2  ASN  58          1HD2      ASN  58  -2.631   1.666 -13.237
  464   2HD2  ASN  58          2HD2      ASN  58  -1.419   1.929 -12.080
  465    H    ARG  59           H        ARG  59  -2.632  -2.183 -14.629
  466    HA   ARG  59           HA       ARG  59  -4.886  -3.348 -16.140
  467   1HB   ARG  59          2HB       ARG  59  -2.339  -4.842 -16.018
  468   2HB   ARG  59          1HB       ARG  59  -3.312  -4.387 -17.417
  469   1HG   ARG  59          2HG       ARG  59  -2.465  -1.947 -16.761
  470   2HG   ARG  59          1HG       ARG  59  -1.142  -2.863 -16.038
  471   1HD   ARG  59          2HD       ARG  59  -0.713  -2.199 -18.424
  472   2HD   ARG  59          1HD       ARG  59  -0.652  -3.941 -18.154
  473    HE   ARG  59           HE       ARG  59  -2.736  -4.161 -19.343
  474   1HH1  ARG  59          1HH1      ARG  59  -3.462  -1.263 -18.224
  475   2HH1  ARG  59          2HH1      ARG  59  -3.736  -0.462 -19.736
  476   1HH2  ARG  59          1HH2      ARG  59  -2.303  -2.985 -21.635
  477   2HH2  ARG  59          2HH2      ARG  59  -3.079  -1.436 -21.666
  478    H    TYR  60           H        TYR  60  -3.824  -3.553 -12.978
  479    HA   TYR  60           HA       TYR  60  -5.227  -6.140 -12.675
  480   1HB   TYR  60          2HB       TYR  60  -3.187  -6.765 -11.076
  481   2HB   TYR  60          1HB       TYR  60  -3.181  -7.175 -12.790
  482    HD1  TYR  60           HD1      TYR  60  -2.748  -3.813 -11.226
  483    HD2  TYR  60           HD2      TYR  60  -0.901  -7.037 -13.364
  484    HE1  TYR  60           HE1      TYR  60  -0.724  -2.423 -11.579
  485    HE2  TYR  60           HE2      TYR  60   1.122  -5.655 -13.719
  486    HH   TYR  60           HH       TYR  60   2.205  -3.765 -12.984
  487    H    PHE  61           H        PHE  61  -6.238  -3.752 -11.750
  488    HA   PHE  61           HA       PHE  61  -6.108  -4.254  -8.842
  489   1HB   PHE  61          2HB       PHE  61  -5.435  -1.606 -10.121
  490   2HB   PHE  61          1HB       PHE  61  -6.028  -1.712  -8.462
  491    HD1  PHE  61           HD1      PHE  61  -3.144  -1.732 -10.450
  492    HD2  PHE  61           HD2      PHE  61  -4.805  -3.619  -6.979
  493    HE1  PHE  61           HE1      PHE  61  -0.886  -2.359  -9.736
  494    HE2  PHE  61           HE2      PHE  61  -2.538  -4.243  -6.259
  495    HZ   PHE  61           HZ       PHE  61  -0.567  -3.623  -7.620
  496    H    ILE  62           H        ILE  62  -8.155  -4.854  -8.642
  497    HA   ILE  62           HA       ILE  62 -10.289  -3.209  -9.922
  498    HB   ILE  62           HB       ILE  62 -11.691  -5.130  -9.815
  499   1HG1  ILE  62          2HG1      ILE  62  -9.615  -6.411  -8.007
  500   2HG1  ILE  62          1HG1      ILE  62 -11.122  -5.687  -7.440
  501   1HG2  ILE  62          1HG2      ILE  62 -10.507  -6.035 -11.501
  502   2HG2  ILE  62          2HG2      ILE  62  -9.568  -6.934 -10.311
  503   3HG2  ILE  62          3HG2      ILE  62  -9.012  -5.353 -10.862
  504   1HD1  ILE  62          1HD1      ILE  62 -10.801  -8.086  -9.257
  505   2HD1  ILE  62          2HD1      ILE  62 -12.342  -7.263  -9.018
  506   3HD1  ILE  62          3HD1      ILE  62 -11.538  -8.041  -7.655
  507    H    LYS  63           H        LYS  63 -12.440  -3.499  -8.418
  508    HA   LYS  63           HA       LYS  63 -11.643  -2.817  -5.619
  509   1HB   LYS  63          2HB       LYS  63 -13.899  -1.446  -7.096
  510   2HB   LYS  63          1HB       LYS  63 -13.143  -0.964  -5.576
  511   1HG   LYS  63          2HG       LYS  63 -11.834   0.398  -6.814
  512   2HG   LYS  63          1HG       LYS  63 -11.014  -1.062  -7.366
  513   1HD   LYS  63          2HD       LYS  63 -11.643  -0.217  -9.417
  514   2HD   LYS  63          1HD       LYS  63 -13.102  -1.135  -9.041
  515   1HE   LYS  63          2HE       LYS  63 -13.098   1.563  -7.882
  516   2HE   LYS  63          1HE       LYS  63 -13.033   1.560  -9.644
  517   1HZ   LYS  63          1HZ       LYS  63 -15.187   0.839  -7.900
  518   2HZ   LYS  63          2HZ       LYS  63 -14.867  -0.360  -9.059
  519   3HZ   LYS  63          3HZ       LYS  63 -15.216   1.229  -9.550
  520    H    VAL  64           H        VAL  64 -13.269  -3.351  -4.024
  521    HA   VAL  64           HA       VAL  64 -14.979  -5.601  -4.875
  522    HB   VAL  64           HB       VAL  64 -15.323  -5.968  -2.477
  523   1HG1  VAL  64          1HG1      VAL  64 -12.484  -5.379  -3.345
  524   2HG1  VAL  64          2HG1      VAL  64 -13.306  -6.941  -3.317
  525   3HG1  VAL  64          3HG1      VAL  64 -12.866  -6.148  -1.804
  526   1HG2  VAL  64          1HG2      VAL  64 -14.852  -4.407  -0.853
  527   2HG2  VAL  64          2HG2      VAL  64 -15.116  -3.292  -2.194
  528   3HG2  VAL  64          3HG2      VAL  64 -13.475  -3.752  -1.739
  529    HA   PRO  65           HA       PRO  65 -18.698  -3.273  -4.875
  530   1HB   PRO  65          2HB       PRO  65 -20.469  -5.273  -4.224
  531   2HB   PRO  65          1HB       PRO  65 -19.704  -5.123  -5.814
  532   1HG   PRO  65          2HG       PRO  65 -19.112  -7.057  -3.622
  533   2HG   PRO  65          1HG       PRO  65 -18.871  -7.232  -5.368
  534   1HD   PRO  65          2HD       PRO  65 -16.857  -6.639  -3.472
  535   2HD   PRO  65          1HD       PRO  65 -16.708  -6.484  -5.236
  536    H    ARG  66           H        ARG  66 -20.684  -2.827  -3.415
  537    HA   ARG  66           HA       ARG  66 -19.807  -2.097  -0.792
  538   1HB   ARG  66          2HB       ARG  66 -21.873  -1.316  -2.325
  539   2HB   ARG  66          1HB       ARG  66 -22.723  -2.461  -1.287
  540   1HG   ARG  66          2HG       ARG  66 -22.610  -1.078   0.497
  541   2HG   ARG  66          1HG       ARG  66 -20.900  -0.746   0.221
  542   1HD   ARG  66          2HD       ARG  66 -22.319   1.295  -0.002
  543   2HD   ARG  66          1HD       ARG  66 -21.454   0.904  -1.488
  544    HE   ARG  66           HE       ARG  66 -23.573   0.757  -2.486
  545   1HH1  ARG  66          1HH2      ARG  66 -24.016   0.759   0.866
  546   2HH1  ARG  66          2HH2      ARG  66 -25.554  -0.036   0.829
  547   1HH2  ARG  66          1HH1      ARG  66 -25.427  -0.701  -2.571
  548   2HH2  ARG  66          2HH1      ARG  66 -26.352  -0.863  -1.116
  549    H    SER  67           H        SER  67 -19.300  -3.609   0.726
  550    HA   SER  67           HA       SER  67 -21.352  -5.522   1.566
  551   1HB   SER  67          2HB       SER  67 -20.411  -6.901  -0.142
  552   2HB   SER  67          1HB       SER  67 -18.768  -6.424   0.277
  553    HG   SER  67           HG       SER  67 -19.311  -8.478   1.127
  554    H    GLN  68           H        GLN  68 -21.173  -4.441   3.585
  555    HA   GLN  68           HA       GLN  68 -18.617  -5.000   5.032
  556   1HB   GLN  68          2HB       GLN  68 -19.358  -2.856   6.375
  557   2HB   GLN  68          1HB       GLN  68 -18.497  -2.679   4.846
  558   1HG   GLN  68          2HG       GLN  68 -20.412  -1.193   4.808
  559   2HG   GLN  68          1HG       GLN  68 -20.718  -2.519   3.685
  560   1HE2  GLN  68          1HE2      GLN  68 -22.873  -3.138   3.863
  561   2HE2  GLN  68          2HE2      GLN  68 -23.730  -3.280   5.321
  562    H    GLU  69           H        GLU  69 -19.057  -4.845   7.509
  563    HA   GLU  69           HA       GLU  69 -21.742  -5.366   8.453
  564   1HB   GLU  69          2HB       GLU  69 -20.201  -7.601   7.433
  565   2HB   GLU  69          1HB       GLU  69 -20.522  -7.804   9.156
  566   1HG   GLU  69          2HG       GLU  69 -22.937  -7.317   8.714
  567   2HG   GLU  69          1HG       GLU  69 -22.575  -7.276   6.988
  568    H    GLU  70           H        GLU  70 -18.675  -6.878   9.453
  569    HA   GLU  70           HA       GLU  70 -18.989  -5.883  12.163
  570   1HB   GLU  70          2HB       GLU  70 -17.600  -7.968  11.018
  571   2HB   GLU  70          1HB       GLU  70 -16.310  -6.825  11.396
  572   1HG   GLU  70          2HG       GLU  70 -18.380  -7.268  13.493
  573   2HG   GLU  70          1HG       GLU  70 -17.230  -8.575  13.209
  574    HA   PRO  71           HA       PRO  71 -15.347  -3.059  10.917
  575   1HB   PRO  71          2HB       PRO  71 -14.620  -3.013   8.266
  576   2HB   PRO  71          1HB       PRO  71 -13.918  -4.122   9.457
  577   1HG   PRO  71          2HG       PRO  71 -15.881  -4.697   7.292
  578   2HG   PRO  71          1HG       PRO  71 -14.729  -5.787   8.079
  579   1HD   PRO  71          2HD       PRO  71 -17.510  -5.625   8.606
  580   2HD   PRO  71          1HD       PRO  71 -16.308  -6.501   9.577
  581    H    GLY  72           H        GLY  72 -15.495  -0.832  10.311
  582   1HA   GLY  72          2HA       GLY  72 -18.088  -0.094   9.065
  583   2HA   GLY  72          1HA       GLY  72 -17.075   0.976  10.039
  584    H    LYS  73           H        LYS  73 -15.952  -1.064   7.371
  585    HA   LYS  73           HA       LYS  73 -14.833   1.339   6.073
  586   1HB   LYS  73          2HB       LYS  73 -14.561  -1.634   5.600
  587   2HB   LYS  73          1HB       LYS  73 -13.931  -0.452   4.451
  588   1HG   LYS  73          2HG       LYS  73 -12.443   0.475   6.069
  589   2HG   LYS  73          1HG       LYS  73 -13.246  -0.368   7.395
  590   1HD   LYS  73          2HD       LYS  73 -12.589  -2.512   5.957
  591   2HD   LYS  73          1HD       LYS  73 -11.333  -1.428   5.356
  592   1HE   LYS  73          2HE       LYS  73 -11.726  -1.404   8.291
  593   2HE   LYS  73          1HE       LYS  73 -11.079  -2.904   7.626
  594   1HZ   LYS  73          1HZ       LYS  73  -9.909  -0.457   6.595
  595   2HZ   LYS  73          2HZ       LYS  73  -9.165  -1.922   7.028
  596   3HZ   LYS  73          3HZ       LYS  73  -9.580  -0.790   8.224
  597    H    GLY  74           H        GLY  74 -14.996   1.024   3.461
  598   1HA   GLY  74          2HA       GLY  74 -17.864   0.487   2.816
  599   2HA   GLY  74          1HA       GLY  74 -17.089   1.976   2.273
  600    H    SER  75           H        SER  75 -14.973   1.572   1.011
  601    HA   SER  75           HA       SER  75 -15.446  -0.704  -0.865
  602   1HB   SER  75          2HB       SER  75 -13.973   1.915  -1.276
  603   2HB   SER  75          1HB       SER  75 -14.108   0.639  -2.483
  604    HG   SER  75           HG       SER  75 -16.278   0.979  -2.594
  605    H    PHE  76           H        PHE  76 -13.289  -1.478  -1.902
  606    HA   PHE  76           HA       PHE  76 -10.961  -1.270  -0.101
  607   1HB   PHE  76          2HB       PHE  76 -12.772  -3.342   0.293
  608   2HB   PHE  76          1HB       PHE  76 -11.522  -4.075  -0.712
  609    HD1  PHE  76           HD1      PHE  76  -9.178  -2.382   0.195
  610    HD2  PHE  76           HD2      PHE  76 -12.288  -4.360   2.402
  611    HE1  PHE  76           HE1      PHE  76  -7.681  -2.542   2.168
  612    HE2  PHE  76           HE2      PHE  76 -10.787  -4.516   4.370
  613    HZ   PHE  76           HZ       PHE  76  -8.487  -3.606   4.253
  614    H    TRP  77           H        TRP  77  -9.249  -1.039  -1.430
  615    HA   TRP  77           HA       TRP  77  -9.422  -1.717  -4.267
  616   1HB   TRP  77          2HB       TRP  77  -7.483  -0.341  -2.472
  617   2HB   TRP  77          1HB       TRP  77  -6.830  -1.065  -3.938
  618    HD1  TRP  77           HD1      TRP  77  -8.306   2.034  -2.753
  619    HE1  TRP  77           HE1      TRP  77  -9.152   3.474  -4.716
  620    HE3  TRP  77           HE3      TRP  77  -8.233  -1.448  -6.478
  621    HZ2  TRP  77           HZ2      TRP  77  -9.718   3.180  -7.506
  622    HZ3  TRP  77           HZ3      TRP  77  -8.925  -0.844  -8.778
  623    HH2  TRP  77           HH2      TRP  77  -9.654   1.462  -9.290
  624    H    ARG  78           H        ARG  78  -8.501  -3.512  -5.272
  625    HA   ARG  78           HA       ARG  78  -6.605  -5.194  -3.738
  626   1HB   ARG  78          2HB       ARG  78  -8.450  -6.959  -5.067
  627   2HB   ARG  78          1HB       ARG  78  -8.020  -6.914  -3.364
  628   1HG   ARG  78          2HG       ARG  78 -10.252  -6.442  -3.146
  629   2HG   ARG  78          1HG       ARG  78  -9.702  -4.797  -3.444
  630   1HD   ARG  78          2HD       ARG  78 -11.278  -4.892  -5.103
  631   2HD   ARG  78          1HD       ARG  78  -9.960  -5.651  -5.994
  632    HE   ARG  78           HE       ARG  78 -12.351  -6.956  -5.525
  633   1HH1  ARG  78          1HH2      ARG  78  -9.910  -8.269  -6.750
  634   2HH1  ARG  78          2HH2      ARG  78  -9.655  -9.599  -5.669
  635   1HH2  ARG  78          1HH1      ARG  78 -11.671  -8.298  -3.166
  636   2HH2  ARG  78          2HH1      ARG  78 -10.651  -9.615  -3.641
  637    H    ILE  79           H        ILE  79  -5.554  -6.823  -5.134
  638    HA   ILE  79           HA       ILE  79  -5.415  -5.844  -7.961
  639    HB   ILE  79           HB       ILE  79  -3.277  -5.850  -6.727
  640   1HG1  ILE  79          2HG1      ILE  79  -2.534  -8.080  -8.357
  641   2HG1  ILE  79          1HG1      ILE  79  -3.775  -7.168  -9.207
  642   1HG2  ILE  79          1HG2      ILE  79  -3.395  -7.482  -5.106
  643   2HG2  ILE  79          2HG2      ILE  79  -2.384  -8.275  -6.314
  644   3HG2  ILE  79          3HG2      ILE  79  -4.100  -8.667  -6.207
  645   1HD1  ILE  79          1HD1      ILE  79  -1.383  -6.397  -9.613
  646   2HD1  ILE  79          2HD1      ILE  79  -1.362  -5.858  -7.937
  647   3HD1  ILE  79          3HD1      ILE  79  -2.497  -5.143  -9.079
  648    H    ASP  80           H        ASP  80  -5.516  -7.424  -9.685
  649    HA   ASP  80           HA       ASP  80  -7.438  -9.467  -9.339
  650   1HB   ASP  80          2HB       ASP  80  -5.385  -8.878 -11.450
  651   2HB   ASP  80          1HB       ASP  80  -6.298 -10.385 -11.527
  652    HA   PRO  81           HA       PRO  81  -5.065 -12.641  -7.447
  653   1HB   PRO  81          2HB       PRO  81  -6.798 -14.716  -7.933
  654   2HB   PRO  81          1HB       PRO  81  -7.076 -13.470  -6.705
  655   1HG   PRO  81          2HG       PRO  81  -8.394 -13.818  -9.353
  656   2HG   PRO  81          1HG       PRO  81  -9.004 -13.020  -7.895
  657   1HD   PRO  81          2HD       PRO  81  -7.936 -11.732 -10.192
  658   2HD   PRO  81          1HD       PRO  81  -8.293 -10.967  -8.628
  659    H    ALA  82           H        ALA  82  -6.512 -13.668 -10.579
  660    HA   ALA  82           HA       ALA  82  -4.444 -15.645 -11.032
  661   1HB   ALA  82          1HB       ALA  82  -5.679 -16.253 -12.860
  662   2HB   ALA  82          2HB       ALA  82  -5.945 -14.584 -13.363
  663   3HB   ALA  82          3HB       ALA  82  -6.918 -15.281 -12.068
  664    H    SER  83           H        SER  83  -4.168 -12.361 -11.066
  665    HA   SER  83           HA       SER  83  -2.097 -12.489 -13.221
  666   1HB   SER  83          2HB       SER  83  -3.773 -10.138 -12.293
  667   2HB   SER  83          1HB       SER  83  -2.421 -10.004 -13.413
  668    HG   SER  83           HG       SER  83  -4.869 -11.401 -13.733
  669    H    GLU  84           H        GLU  84  -2.756 -12.080  -9.911
  670    HA   GLU  84           HA       GLU  84  -0.774 -10.244  -9.097
  671   1HB   GLU  84          2HB       GLU  84  -2.425 -11.014  -7.521
  672   2HB   GLU  84          1HB       GLU  84  -1.883 -12.683  -7.698
  673   1HG   GLU  84          2HG       GLU  84  -0.086 -12.383  -6.329
  674   2HG   GLU  84          1HG       GLU  84   0.232 -10.759  -6.939
  675    H    ALA  85           H        ALA  85  -0.427 -13.616 -10.079
  676    HA   ALA  85           HA       ALA  85   2.250 -13.849  -8.945
  677   1HB   ALA  85          1HB       ALA  85   2.200 -16.009  -9.714
  678   2HB   ALA  85          2HB       ALA  85   1.513 -15.548 -11.272
  679   3HB   ALA  85          3HB       ALA  85   0.472 -15.681  -9.854
  680    H    LYS  86           H        LYS  86   0.958 -12.586 -11.950
  681    HA   LYS  86           HA       LYS  86   3.632 -12.611 -13.192
  682   1HB   LYS  86          2HB       LYS  86   2.479 -11.577 -15.125
  683   2HB   LYS  86          1HB       LYS  86   1.703 -13.076 -14.624
  684   1HG   LYS  86          2HG       LYS  86  -0.080 -11.913 -13.557
  685   2HG   LYS  86          1HG       LYS  86   0.779 -10.374 -13.636
  686   1HD   LYS  86          2HD       LYS  86   0.576 -11.454 -16.286
  687   2HD   LYS  86          1HD       LYS  86  -1.026 -11.450 -15.546
  688   1HE   LYS  86          2HE       LYS  86  -0.704  -9.303 -16.612
  689   2HE   LYS  86          1HE       LYS  86  -0.624  -9.058 -14.867
  690   1HZ   LYS  86          1HZ       LYS  86   1.612  -8.698 -14.921
  691   2HZ   LYS  86          2HZ       LYS  86   1.192  -8.076 -16.445
  692   3HZ   LYS  86          3HZ       LYS  86   1.858  -9.633 -16.314
  693    H    LEU  87           H        LEU  87   1.327 -10.249 -11.857
  694    HA   LEU  87           HA       LEU  87   2.897  -7.953 -12.555
  695   1HB   LEU  87          2HB       LEU  87   1.606  -6.918 -10.519
  696   2HB   LEU  87          1HB       LEU  87   0.744  -7.336 -11.976
  697    HG   LEU  87           HG       LEU  87   0.770  -9.658 -10.318
  698   1HD1  LEU  87          1HD1      LEU  87   1.031  -8.500  -8.317
  699   2HD1  LEU  87          2HD1      LEU  87  -0.721  -8.485  -8.504
  700   3HD1  LEU  87          3HD1      LEU  87   0.224  -7.059  -8.930
  701   1HD2  LEU  87          1HD2      LEU  87  -1.664  -9.369 -10.447
  702   2HD2  LEU  87          2HD2      LEU  87  -0.945  -9.000 -12.014
  703   3HD2  LEU  87          3HD2      LEU  87  -1.457  -7.692 -10.948
  704    H    VAL  88           H        VAL  88   2.517  -9.672  -9.488
  705    HA   VAL  88           HA       VAL  88   4.277  -8.352  -7.858
  706    HB   VAL  88           HB       VAL  88   4.893 -10.602  -6.972
  707   1HG1  VAL  88          1HG1      VAL  88   2.170  -9.523  -7.298
  708   2HG1  VAL  88          2HG1      VAL  88   3.038  -9.940  -5.822
  709   3HG1  VAL  88          3HG1      VAL  88   2.251 -11.202  -6.768
  710   1HG2  VAL  88          1HG2      VAL  88   4.892 -12.164  -8.642
  711   2HG2  VAL  88          2HG2      VAL  88   3.599 -11.351  -9.524
  712   3HG2  VAL  88          3HG2      VAL  88   3.216 -12.363  -8.132
  713    H    GLU  89           H        GLU  89   5.142 -10.391 -10.619
  714    HA   GLU  89           HA       GLU  89   7.889 -10.762 -10.080
  715   1HB   GLU  89          2HB       GLU  89   6.383 -11.533 -12.125
  716   2HB   GLU  89          1HB       GLU  89   7.038 -10.076 -12.874
  717   1HG   GLU  89          2HG       GLU  89   9.201 -10.892 -12.896
  718   2HG   GLU  89          1HG       GLU  89   8.945 -11.901 -11.471
  719    H    GLN  90           H        GLN  90   6.360  -8.101 -11.926
  720    HA   GLN  90           HA       GLN  90   8.796  -6.547 -12.026
  721   1HB   GLN  90          2HB       GLN  90   6.697  -6.303 -13.514
  722   2HB   GLN  90          1HB       GLN  90   5.995  -5.413 -12.163
  723   1HG   GLN  90          2HG       GLN  90   7.207  -3.571 -12.637
  724   2HG   GLN  90          1HG       GLN  90   8.699  -4.504 -12.751
  725   1HE2  GLN  90          1HE2      GLN  90   7.160  -2.393 -14.584
  726   2HE2  GLN  90          2HE2      GLN  90   7.320  -3.085 -16.125
  727    H    ALA  91           H        ALA  91   6.443  -7.193  -9.620
  728    HA   ALA  91           HA       ALA  91   6.766  -4.768  -8.085
  729   1HB   ALA  91          1HB       ALA  91   5.782  -7.475  -7.196
  730   2HB   ALA  91          2HB       ALA  91   4.774  -6.198  -7.876
  731   3HB   ALA  91          3HB       ALA  91   5.573  -5.956  -6.323
  732    H    PHE  92           H        PHE  92   8.596  -7.674  -8.432
  733    HA   PHE  92           HA       PHE  92  10.025  -7.240  -5.881
  734   1HB   PHE  92          2HB       PHE  92  10.355  -9.309  -8.074
  735   2HB   PHE  92          1HB       PHE  92  11.335  -9.258  -6.608
  736    HD1  PHE  92           HD1      PHE  92   9.294  -8.407  -4.609
  737    HD2  PHE  92           HD2      PHE  92   9.063 -11.275  -7.800
  738    HE1  PHE  92           HE1      PHE  92   7.520  -9.630  -3.383
  739    HE2  PHE  92           HE2      PHE  92   7.289 -12.497  -6.573
  740    HZ   PHE  92           HZ       PHE  92   6.517 -11.676  -4.364
  741    H    ARG  93           H        ARG  93  10.344  -6.494  -9.253
  742    HA   ARG  93           HA       ARG  93  13.198  -6.146  -9.330
  743   1HB   ARG  93          2HB       ARG  93  10.954  -4.929 -10.962
  744   2HB   ARG  93          1HB       ARG  93  12.661  -4.639 -11.302
  745   1HG   ARG  93          2HG       ARG  93  12.791  -7.288 -11.197
  746   2HG   ARG  93          1HG       ARG  93  11.076  -7.162 -11.590
  747   1HD   ARG  93          2HD       ARG  93  11.477  -6.217 -13.668
  748   2HD   ARG  93          1HD       ARG  93  13.019  -5.520 -13.169
  749    HE   ARG  93           HE       ARG  93  12.870  -8.473 -13.370
  750   1HH1  ARG  93          1HH2      ARG  93  13.022  -5.986 -15.572
  751   2HH1  ARG  93          2HH2      ARG  93  14.577  -6.394 -16.216
  752   1HH2  ARG  93          1HH1      ARG  93  15.254  -8.776 -13.788
  753   2HH2  ARG  93          2HH1      ARG  93  15.840  -7.974 -15.207
  754    H    LYS  94           H        LYS  94  14.319  -4.680  -8.149
  755    HA   LYS  94           HA       LYS  94  12.920  -2.356  -6.994
  756   1HB   LYS  94          2HB       LYS  94  15.870  -2.843  -6.711
  757   2HB   LYS  94          1HB       LYS  94  14.738  -2.158  -5.544
  758   1HG   LYS  94          2HG       LYS  94  13.650  -4.410  -5.363
  759   2HG   LYS  94          1HG       LYS  94  14.918  -5.061  -6.402
  760   1HD   LYS  94          2HD       LYS  94  16.475  -5.010  -4.744
  761   2HD   LYS  94          1HD       LYS  94  15.897  -3.465  -4.119
  762   1HE   LYS  94          2HE       LYS  94  13.820  -4.865  -3.337
  763   2HE   LYS  94          1HE       LYS  94  14.916  -6.237  -3.502
  764   1HZ   LYS  94          1HZ       LYS  94  16.484  -4.605  -2.173
  765   2HZ   LYS  94          2HZ       LYS  94  15.392  -5.643  -1.385
  766   3HZ   LYS  94          3HZ       LYS  94  14.995  -4.008  -1.620
  767    H    ARG  95           H        ARG  95  14.333  -0.236  -7.047
  768    HA   ARG  95           HA       ARG  95  15.550   0.131  -9.738
  769   1HB   ARG  95          2HB       ARG  95  13.462   1.982  -8.543
  770   2HB   ARG  95          1HB       ARG  95  14.270   2.185 -10.099
  771   1HG   ARG  95          2HG       ARG  95  13.276   0.122 -10.935
  772   2HG   ARG  95          1HG       ARG  95  12.549  -0.199  -9.360
  773   1HD   ARG  95          2HD       ARG  95  10.955   0.817 -11.021
  774   2HD   ARG  95          1HD       ARG  95  11.138   1.758  -9.540
  775    HE   ARG  95           HE       ARG  95  11.648   3.463 -11.106
  776   1HH1  ARG  95          1HH2      ARG  95  12.416   0.676 -12.759
  777   2HH1  ARG  95          2HH2      ARG  95  13.837   1.299 -13.529
  778   1HH2  ARG  95          1HH1      ARG  95  13.884   4.223 -11.667
  779   2HH2  ARG  95          2HH1      ARG  95  14.669   3.308 -12.910
  780    H    ARG  96           H        ARG  96  16.874  -0.135  -7.271
  781    HA   ARG  96           HA       ARG  96  18.577   2.140  -7.272
  782   1HB   ARG  96          2HB       ARG  96  17.973   3.136  -5.078
  783   2HB   ARG  96          1HB       ARG  96  16.670   3.311  -6.253
  784   1HG   ARG  96          2HG       ARG  96  15.272   2.195  -4.895
  785   2HG   ARG  96          1HG       ARG  96  16.346   0.796  -4.923
  786   1HD   ARG  96          2HD       ARG  96  17.752   2.172  -3.190
  787   2HD   ARG  96          1HD       ARG  96  16.251   3.066  -2.952
  788    HE   ARG  96           HE       ARG  96  15.727   0.248  -2.811
  789   1HH1  ARG  96          1HH2      ARG  96  17.281   2.841  -1.137
  790   2HH1  ARG  96          2HH2      ARG  96  16.993   2.170   0.433
  791   1HH2  ARG  96          1HH1      ARG  96  15.318  -0.619  -0.768
  792   2HH2  ARG  96          2HH1      ARG  96  15.882   0.214   0.643
  793    H    GLN  97           H        GLN  97  20.311   1.885  -5.691
  794    HA   GLN  97           HA       GLN  97  20.230  -0.697  -4.192
  795   1HB   GLN  97          2HB       GLN  97  22.648  -1.012  -4.881
  796   2HB   GLN  97          1HB       GLN  97  21.480  -1.193  -6.191
  797   1HG   GLN  97          2HG       GLN  97  21.972   0.962  -7.070
  798   2HG   GLN  97          1HG       GLN  97  22.826   1.448  -5.604
  799   1HE2  GLN  97          1HE2      GLN  97  23.178  -0.141  -8.682
  800   2HE2  GLN  97          2HE2      GLN  97  24.813  -0.565  -8.508
  801    H    ARG  98           H        ARG  98  21.421  -0.679  -2.245
  802    HA   ARG  98           HA       ARG  98  21.755   1.865  -0.966
  803   1HB   ARG  98          2HB       ARG  98  22.589  -0.950  -0.277
  804   2HB   ARG  98          1HB       ARG  98  23.069   0.410   0.738
  805   1HG   ARG  98          2HG       ARG  98  20.418   0.945   0.397
  806   2HG   ARG  98          1HG       ARG  98  20.403  -0.819   0.371
  807   1HD   ARG  98          2HD       ARG  98  20.143  -0.082   2.671
  808   2HD   ARG  98          1HD       ARG  98  21.743  -0.801   2.492
  809    HE   ARG  98           HE       ARG  98  22.711   1.402   2.657
  810   1HH1  ARG  98          1HH2      ARG  98  19.885   1.144   4.294
  811   2HH1  ARG  98          2HH2      ARG  98  19.455   2.822   4.252
  812   1HH2  ARG  98          1HH1      ARG  98  21.905   3.662   1.942
  813   2HH2  ARG  98          2HH1      ARG  98  20.601   4.249   2.920
  814    H    GLY  99           H        GLY  99  23.320   3.289  -1.566
  815   1HA   GLY  99          2HA       GLY  99  25.832   2.337  -2.755
  816   2HA   GLY  99          1HA       GLY  99  25.360   4.024  -2.542
  817    H    VAL 100           H        VAL 100  26.205   1.169  -0.542
  818    HA   VAL 100           HA       VAL 100  27.456   3.048   1.408
  819    HB   VAL 100           HB       VAL 100  26.702   0.126   1.727
  820   1HG1  VAL 100          1HG1      VAL 100  26.974   1.088   4.233
  821   2HG1  VAL 100          2HG1      VAL 100  28.160   2.101   3.409
  822   3HG1  VAL 100          3HG1      VAL 100  28.310   0.345   3.352
  823   1HG2  VAL 100          1HG2      VAL 100  25.351   2.725   2.430
  824   2HG2  VAL 100          2HG2      VAL 100  25.053   1.278   3.392
  825   3HG2  VAL 100          3HG2      VAL 100  24.660   1.291   1.674
  826    H    SER 101           HN       SER 101  28.116   0.492  -0.863
  827    HA   SER 101           HA       SER 101  30.666  -0.342   0.113
  828   1HB   SER 101          2HB       SER 101  30.339  -0.195  -2.825
  829   2HB   SER 101          1HB       SER 101  30.781  -1.565  -1.809
  830    HG   SER 101           HG       SER 101  28.248  -0.556  -2.490
  Start of MODEL    4
    1   1H    GLU   1          1HT       GLU   1  13.021   5.651  -7.929
    2   2H    GLU   1          2HT       GLU   1  13.703   6.189  -9.389
    3   3H    GLU   1          3HT       GLU   1  12.464   7.083  -8.648
    4    HA   GLU   1           HA       GLU   1  14.573   6.736  -6.812
    5   1HB   GLU   1          2HB       GLU   1  15.343   8.058  -9.430
    6   2HB   GLU   1          1HB       GLU   1  16.350   7.904  -7.990
    7   1HG   GLU   1          2HG       GLU   1  15.530   5.291  -8.506
    8   2HG   GLU   1          1HG       GLU   1  15.843   5.958 -10.109
    9    H    SER   2           H        SER   2  15.352   9.103  -6.274
   10    HA   SER   2           HA       SER   2  14.790  11.321  -5.742
   11   1HB   SER   2          2HB       SER   2  14.185  11.392  -8.237
   12   2HB   SER   2          1HB       SER   2  12.521  11.104  -7.733
   13    HG   SER   2           HG       SER   2  12.751  13.284  -7.762
   14    H    LYS   3           H        LYS   3  11.561  11.692  -6.228
   15    HA   LYS   3           HA       LYS   3  10.981  11.123  -3.450
   16   1HB   LYS   3          2HB       LYS   3   9.719  12.607  -5.606
   17   2HB   LYS   3          1HB       LYS   3   8.552  11.687  -4.660
   18   1HG   LYS   3          2HG       LYS   3   8.680  13.208  -3.013
   19   2HG   LYS   3          1HG       LYS   3  10.402  12.870  -2.838
   20   1HD   LYS   3          2HD       LYS   3  10.230  15.209  -3.323
   21   2HD   LYS   3          1HD       LYS   3  10.782  14.439  -4.812
   22   1HE   LYS   3          2HE       LYS   3   8.212  14.265  -5.341
   23   2HE   LYS   3          1HE       LYS   3   8.074  15.561  -4.153
   24   1HZ   LYS   3          1HZ       LYS   3   8.812  17.009  -5.636
   25   2HZ   LYS   3          2HZ       LYS   3   8.796  15.785  -6.816
   26   3HZ   LYS   3          3HZ       LYS   3  10.210  16.091  -5.924
   27    HA   PRO   4           HA       PRO   4   8.066   7.864  -5.332
   28   1HB   PRO   4          2HB       PRO   4   8.223   7.468  -8.050
   29   2HB   PRO   4          1HB       PRO   4   7.115   8.621  -7.287
   30   1HG   PRO   4          2HG       PRO   4   9.646   9.151  -8.775
   31   2HG   PRO   4          1HG       PRO   4   8.229  10.193  -8.565
   32   1HD   PRO   4          2HD       PRO   4  10.663  10.418  -7.149
   33   2HD   PRO   4          1HD       PRO   4   9.139  11.206  -6.713
   34    HA   PRO   5           HA       PRO   5  11.726   5.216  -5.358
   35   1HB   PRO   5          2HB       PRO   5  10.572   3.254  -3.814
   36   2HB   PRO   5          1HB       PRO   5  11.292   4.729  -3.145
   37   1HG   PRO   5          2HG       PRO   5   8.410   4.023  -3.455
   38   2HG   PRO   5          1HG       PRO   5   9.183   5.092  -2.272
   39   1HD   PRO   5          2HD       PRO   5   7.777   5.926  -4.576
   40   2HD   PRO   5          1HD       PRO   5   8.851   6.940  -3.587
   41    H    TYR   6           H        TYR   6   8.485   3.704  -5.492
   42    HA   TYR   6           HA       TYR   6   9.440   2.086  -7.815
   43   1HB   TYR   6          2HB       TYR   6   7.186   1.509  -5.870
   44   2HB   TYR   6          1HB       TYR   6   7.686   0.466  -7.201
   45    HD1  TYR   6           HD1      TYR   6  10.623   0.676  -7.075
   46    HD2  TYR   6           HD2      TYR   6   7.735   0.326  -3.915
   47    HE1  TYR   6           HE1      TYR   6  12.340  -0.360  -5.618
   48    HE2  TYR   6           HE2      TYR   6   9.451  -0.710  -2.458
   49    HH   TYR   6           HH       TYR   6  12.830  -0.927  -3.479
   50    H    SER   7           H        SER   7   7.999   1.940  -9.645
   51    HA   SER   7           HA       SER   7   6.654   4.274 -10.404
   52   1HB   SER   7          2HB       SER   7   6.413   1.399 -11.224
   53   2HB   SER   7          1HB       SER   7   5.191   2.534 -11.792
   54    HG   SER   7           HG       SER   7   7.878   3.280 -11.962
   55    H    TYR   8           H        TYR   8   4.142   4.436 -10.675
   56    HA   TYR   8           HA       TYR   8   3.017   3.890  -8.015
   57   1HB   TYR   8          2HB       TYR   8   1.888   5.356 -10.414
   58   2HB   TYR   8          1HB       TYR   8   1.081   5.216  -8.849
   59    HD1  TYR   8           HD1      TYR   8   2.850   7.481 -10.668
   60    HD2  TYR   8           HD2      TYR   8   3.041   5.537  -6.842
   61    HE1  TYR   8           HE1      TYR   8   4.223   9.348  -9.784
   62    HE2  TYR   8           HE2      TYR   8   4.410   7.404  -5.959
   63    HH   TYR   8           HH       TYR   8   5.331   9.372  -6.391
   64    H    ALA   9           H        ALA   9   3.501   1.879 -10.356
   65    HA   ALA   9           HA       ALA   9   0.829   0.561 -10.121
   66   1HB   ALA   9          1HB       ALA   9   1.363   1.309 -12.454
   67   2HB   ALA   9          2HB       ALA   9   1.194  -0.441 -12.311
   68   3HB   ALA   9          3HB       ALA   9   2.798   0.284 -12.412
   69    H    GLN  10           H        GLN  10   4.321   0.276 -10.088
   70    HA   GLN  10           HA       GLN  10   4.248  -2.601  -9.362
   71   1HB   GLN  10          2HB       GLN  10   6.079  -1.899 -10.815
   72   2HB   GLN  10          1HB       GLN  10   6.509  -0.594  -9.710
   73   1HG   GLN  10          2HG       GLN  10   6.637  -2.694  -8.006
   74   2HG   GLN  10          1HG       GLN  10   7.071  -3.501  -9.514
   75   1HE2  GLN  10          1HE2      GLN  10   8.857  -2.332 -10.825
   76   2HE2  GLN  10          2HE2      GLN  10  10.096  -1.578  -9.943
   77    H    LEU  11           H        LEU  11   4.759   0.596  -8.050
   78    HA   LEU  11           HA       LEU  11   5.667  -0.067  -5.432
   79   1HB   LEU  11          2HB       LEU  11   5.587   2.243  -6.398
   80   2HB   LEU  11          1HB       LEU  11   3.829   2.192  -6.306
   81    HG   LEU  11           HG       LEU  11   4.548   1.484  -3.752
   82   1HD1  LEU  11          1HD1      LEU  11   6.189   3.548  -3.353
   83   2HD1  LEU  11          2HD1      LEU  11   6.666   3.175  -5.010
   84   3HD1  LEU  11          3HD1      LEU  11   6.814   1.947  -3.752
   85   1HD2  LEU  11          1HD2      LEU  11   3.389   3.722  -5.159
   86   2HD2  LEU  11          2HD2      LEU  11   4.366   4.313  -3.815
   87   3HD2  LEU  11          3HD2      LEU  11   3.059   3.165  -3.519
   88    H    ILE  12           H        ILE  12   2.476   0.266  -6.877
   89    HA   ILE  12           HA       ILE  12   0.930  -0.311  -4.510
   90    HB   ILE  12           HB       ILE  12  -0.016  -1.051  -7.248
   91   1HG1  ILE  12          2HG1      ILE  12   1.035   1.043  -7.781
   92   2HG1  ILE  12          1HG1      ILE  12  -0.659   1.410  -7.520
   93   1HG2  ILE  12          1HG2      ILE  12  -2.061  -0.767  -6.327
   94   2HG2  ILE  12          2HG2      ILE  12  -1.565   0.657  -5.413
   95   3HG2  ILE  12          3HG2      ILE  12  -1.182  -0.955  -4.811
   96   1HD1  ILE  12          1HD1      ILE  12  -0.255   2.585  -5.612
   97   2HD1  ILE  12          2HD1      ILE  12   1.333   2.794  -6.345
   98   3HD1  ILE  12          3HD1      ILE  12   1.084   1.553  -5.121
   99    H    VAL  13           H        VAL  13   1.750  -2.369  -7.334
  100    HA   VAL  13           HA       VAL  13   0.581  -4.731  -6.414
  101    HB   VAL  13           HB       VAL  13   3.139  -4.355  -7.985
  102   1HG1  VAL  13          1HG1      VAL  13   3.157  -6.564  -6.942
  103   2HG1  VAL  13          2HG1      VAL  13   2.777  -6.740  -8.654
  104   3HG1  VAL  13          3HG1      VAL  13   1.493  -6.849  -7.450
  105   1HG2  VAL  13          1HG2      VAL  13   0.261  -4.972  -8.730
  106   2HG2  VAL  13          2HG2      VAL  13   1.607  -4.978  -9.870
  107   3HG2  VAL  13          3HG2      VAL  13   1.135  -3.481  -9.072
  108    H    GLN  14           H        GLN  14   3.672  -3.309  -5.419
  109    HA   GLN  14           HA       GLN  14   4.425  -5.655  -3.856
  110   1HB   GLN  14          2HB       GLN  14   6.091  -3.984  -4.702
  111   2HB   GLN  14          1HB       GLN  14   5.405  -2.798  -3.591
  112   1HG   GLN  14          2HG       GLN  14   6.141  -3.961  -1.689
  113   2HG   GLN  14          1HG       GLN  14   6.326  -5.476  -2.575
  114   1HE2  GLN  14          1HE2      GLN  14   7.509  -2.229  -3.519
  115   2HE2  GLN  14          2HE2      GLN  14   9.148  -2.663  -3.538
  116    H    ALA  15           H        ALA  15   2.684  -2.668  -3.350
  117    HA   ALA  15           HA       ALA  15   2.548  -2.714  -0.495
  118   1HB   ALA  15          1HB       ALA  15   1.939  -0.789  -2.044
  119   2HB   ALA  15          2HB       ALA  15   0.787  -1.094  -0.742
  120   3HB   ALA  15          3HB       ALA  15   0.433  -1.644  -2.379
  121    H    ILE  16           H        ILE  16   0.020  -3.636  -2.853
  122    HA   ILE  16           HA       ILE  16  -1.553  -4.957  -0.817
  123    HB   ILE  16           HB       ILE  16  -2.432  -5.986  -3.266
  124   1HG1  ILE  16          2HG1      ILE  16  -1.615  -3.075  -3.572
  125   2HG1  ILE  16          1HG1      ILE  16  -0.954  -4.414  -4.504
  126   1HG2  ILE  16          1HG2      ILE  16  -4.234  -4.294  -2.947
  127   2HG2  ILE  16          2HG2      ILE  16  -3.239  -3.520  -1.717
  128   3HG2  ILE  16          3HG2      ILE  16  -3.835  -5.158  -1.462
  129   1HD1  ILE  16          1HD1      ILE  16  -3.050  -4.862  -5.542
  130   2HD1  ILE  16          2HD1      ILE  16  -2.824  -3.119  -5.630
  131   3HD1  ILE  16          3HD1      ILE  16  -3.907  -3.804  -4.423
  132    H    SER  17           H        SER  17   0.664  -6.144  -3.329
  133    HA   SER  17           HA       SER  17   0.162  -8.916  -2.999
  134   1HB   SER  17          2HB       SER  17   2.339  -9.288  -3.982
  135   2HB   SER  17          1HB       SER  17   1.625  -7.888  -4.775
  136    HG   SER  17           HG       SER  17   3.939  -7.969  -3.666
  137    H    SER  18           H        SER  18   2.531  -6.833  -1.325
  138    HA   SER  18           HA       SER  18   3.336  -9.009   0.451
  139   1HB   SER  18          2HB       SER  18   4.020  -6.102   0.197
  140   2HB   SER  18          1HB       SER  18   4.374  -6.924   1.712
  141    HG   SER  18           HG       SER  18   5.576  -8.438   0.546
  142    H    ALA  19           H        ALA  19   0.621  -7.049   0.328
  143    HA   ALA  19           HA       ALA  19   0.237  -6.455   3.114
  144   1HB   ALA  19          1HB       ALA  19  -1.911  -7.005   1.045
  145   2HB   ALA  19          2HB       ALA  19  -1.084  -5.455   1.208
  146   3HB   ALA  19          3HB       ALA  19  -2.082  -6.067   2.528
  147    H    GLN  20           H        GLN  20  -2.255  -7.673   3.703
  148    HA   GLN  20           HA       GLN  20  -1.352 -10.225   4.674
  149   1HB   GLN  20          2HB       GLN  20  -3.032  -9.222   5.986
  150   2HB   GLN  20          1HB       GLN  20  -4.037  -8.845   4.591
  151   1HG   GLN  20          2HG       GLN  20  -4.874 -11.002   4.443
  152   2HG   GLN  20          1HG       GLN  20  -3.424 -11.721   5.144
  153   1HE2  GLN  20          1HE2      GLN  20  -5.613  -9.122   6.364
  154   2HE2  GLN  20          2HE2      GLN  20  -5.945  -9.895   7.839
  155    H    ASP  21           H        ASP  21  -4.253  -9.813   2.611
  156    HA   ASP  21           HA       ASP  21  -3.562 -12.368   1.292
  157   1HB   ASP  21          2HB       ASP  21  -6.022 -10.649   1.459
  158   2HB   ASP  21          1HB       ASP  21  -5.863 -11.810   0.139
  159    H    ARG  22           H        ARG  22  -4.967  -9.372  -0.047
  160    HA   ARG  22           HA       ARG  22  -2.791  -8.648  -1.713
  161   1HB   ARG  22          2HB       ARG  22  -3.754  -9.490  -3.916
  162   2HB   ARG  22          1HB       ARG  22  -3.038 -10.729  -2.887
  163   1HG   ARG  22          2HG       ARG  22  -4.995 -11.835  -2.890
  164   2HG   ARG  22          1HG       ARG  22  -5.753 -10.456  -2.093
  165   1HD   ARG  22          2HD       ARG  22  -5.506  -9.641  -4.748
  166   2HD   ARG  22          1HD       ARG  22  -5.975 -11.337  -4.865
  167    HE   ARG  22           HE       ARG  22  -7.765  -9.273  -4.208
  168   1HH1  ARG  22          1HH2      ARG  22  -7.594 -12.548  -4.126
  169   2HH1  ARG  22          2HH2      ARG  22  -8.639 -12.783  -2.765
  170   1HH2  ARG  22          1HH1      ARG  22  -8.705  -9.426  -1.901
  171   2HH2  ARG  22          2HH1      ARG  22  -9.267 -11.015  -1.504
  172    H    GLN  23           H        GLN  23  -5.031  -7.541  -0.154
  173    HA   GLN  23           HA       GLN  23  -6.158  -5.763  -2.268
  174   1HB   GLN  23          2HB       GLN  23  -8.334  -5.790  -1.150
  175   2HB   GLN  23          1HB       GLN  23  -7.874  -7.440  -1.577
  176   1HG   GLN  23          2HG       GLN  23  -6.864  -7.575   0.793
  177   2HG   GLN  23          1HG       GLN  23  -7.801  -6.121   1.137
  178   1HE2  GLN  23          1HE2      GLN  23 -10.030  -6.922  -0.686
  179   2HE2  GLN  23          2HE2      GLN  23 -10.853  -8.173   0.113
  180    H    LEU  24           H        LEU  24  -6.485  -3.587  -1.548
  181    HA   LEU  24           HA       LEU  24  -5.677  -2.994   1.244
  182   1HB   LEU  24          2HB       LEU  24  -4.316  -2.086  -1.269
  183   2HB   LEU  24          1HB       LEU  24  -4.399  -0.988   0.100
  184    HG   LEU  24           HG       LEU  24  -3.381  -3.827   0.320
  185   1HD1  LEU  24          1HD1      LEU  24  -1.339  -3.162  -0.378
  186   2HD1  LEU  24          2HD1      LEU  24  -1.408  -1.696   0.599
  187   3HD1  LEU  24          3HD1      LEU  24  -2.131  -1.719  -1.010
  188   1HD2  LEU  24          1HD2      LEU  24  -4.266  -2.622   2.377
  189   2HD2  LEU  24          2HD2      LEU  24  -2.977  -1.441   2.145
  190   3HD2  LEU  24          3HD2      LEU  24  -2.579  -3.126   2.483
  191    H    THR  25           H        THR  25  -6.480  -0.981   2.011
  192    HA   THR  25           HA       THR  25  -8.878  -0.037   0.599
  193    HB   THR  25           HB       THR  25  -9.293   1.281   2.575
  194    HG1  THR  25           HG1      THR  25  -7.075   0.696   3.996
  195   1HG2  THR  25          1HG2      THR  25  -8.334  -0.682   4.313
  196   2HG2  THR  25          2HG2      THR  25  -8.526  -1.522   2.774
  197   3HG2  THR  25          3HG2      THR  25  -9.899  -0.685   3.499
  198    H    LEU  26           H        LEU  26  -8.952   2.620   0.714
  199    HA   LEU  26           HA       LEU  26  -7.050   3.470  -1.241
  200   1HB   LEU  26          2HB       LEU  26  -9.372   4.544  -0.327
  201   2HB   LEU  26          1HB       LEU  26  -8.204   5.583   0.493
  202    HG   LEU  26           HG       LEU  26  -8.016   4.955  -2.458
  203   1HD1  LEU  26          1HD1      LEU  26  -9.961   6.597  -1.090
  204   2HD1  LEU  26          2HD1      LEU  26  -9.796   6.287  -2.818
  205   3HD1  LEU  26          3HD1      LEU  26  -8.906   7.614  -2.072
  206   1HD2  LEU  26          1HD2      LEU  26  -6.122   6.171  -2.291
  207   2HD2  LEU  26          2HD2      LEU  26  -6.378   6.314  -0.552
  208   3HD2  LEU  26          3HD2      LEU  26  -7.040   7.530  -1.643
  209    H    SER  27           H        SER  27  -7.130   3.855   2.288
  210    HA   SER  27           HA       SER  27  -4.451   5.142   2.187
  211   1HB   SER  27          2HB       SER  27  -6.576   4.874   4.298
  212   2HB   SER  27          1HB       SER  27  -4.929   5.327   4.728
  213    HG   SER  27           HG       SER  27  -5.220   7.218   3.826
  214    H    GLY  28           H        GLY  28  -4.741   2.266   1.602
  215   1HA   GLY  28          2HA       GLY  28  -3.533   1.040   4.045
  216   2HA   GLY  28          1HA       GLY  28  -4.178   0.139   2.670
  217    H    ILE  29           H        ILE  29  -3.058   1.364   0.582
  218    HA   ILE  29           HA       ILE  29  -0.503   0.258   0.286
  219    HB   ILE  29           HB       ILE  29  -2.070   1.018  -1.495
  220   1HG1  ILE  29          2HG1      ILE  29   0.721   2.163  -1.617
  221   2HG1  ILE  29          1HG1      ILE  29   0.242   0.528  -2.079
  222   1HG2  ILE  29          1HG2      ILE  29  -2.178   3.359  -0.165
  223   2HG2  ILE  29          2HG2      ILE  29  -2.562   3.204  -1.873
  224   3HG2  ILE  29          3HG2      ILE  29  -0.961   3.748  -1.376
  225   1HD1  ILE  29          1HD1      ILE  29  -1.487   2.440  -3.343
  226   2HD1  ILE  29          2HD1      ILE  29  -0.448   1.225  -4.081
  227   3HD1  ILE  29          3HD1      ILE  29   0.195   2.822  -3.703
  228    H    TYR  30           H        TYR  30  -1.507   3.374   1.455
  229    HA   TYR  30           HA       TYR  30   1.089   4.613   1.358
  230   1HB   TYR  30          2HB       TYR  30  -1.249   5.325   3.146
  231   2HB   TYR  30          1HB       TYR  30   0.064   6.392   2.630
  232    HD1  TYR  30           HD1      TYR  30  -3.126   6.450   2.092
  233    HD2  TYR  30           HD2      TYR  30   0.337   5.375  -0.193
  234    HE1  TYR  30           HE1      TYR  30  -4.348   6.930  -0.012
  235    HE2  TYR  30           HE2      TYR  30  -0.870   5.864  -2.292
  236    HH   TYR  30           HH       TYR  30  -4.306   6.796  -2.237
  237    H    ALA  31           H        ALA  31  -0.767   3.170   4.054
  238    HA   ALA  31           HA       ALA  31   1.375   3.445   5.952
  239   1HB   ALA  31          1HB       ALA  31  -0.105   1.196   6.720
  240   2HB   ALA  31          2HB       ALA  31  -1.261   2.207   5.854
  241   3HB   ALA  31          3HB       ALA  31  -0.386   2.857   7.241
  242    H    HIS  32           H        HIS  32   0.886   1.323   3.284
  243    HA   HIS  32           HA       HIS  32   2.494  -0.881   4.311
  244   1HB   HIS  32          2HB       HIS  32   0.760  -1.216   2.581
  245   2HB   HIS  32          1HB       HIS  32   1.673  -0.196   1.470
  246    HD1  HIS  32           HD1      HIS  32   1.211  -3.638   2.294
  247    HD2  HIS  32           HD2      HIS  32   4.520  -1.343   1.217
  248    HE1  HIS  32           HE1      HIS  32   2.985  -5.263   1.510
  249    H    ILE  33           H        ILE  33   3.127   1.018   1.372
  250    HA   ILE  33           HA       ILE  33   5.922   0.579   1.291
  251    HB   ILE  33           HB       ILE  33   4.282   1.609  -0.435
  252   1HG1  ILE  33          2HG1      ILE  33   6.887   1.274  -0.492
  253   2HG1  ILE  33          1HG1      ILE  33   6.116   2.280  -1.714
  254   1HG2  ILE  33          1HG2      ILE  33   3.633   3.519   1.025
  255   2HG2  ILE  33          2HG2      ILE  33   4.244   4.019  -0.551
  256   3HG2  ILE  33          3HG2      ILE  33   5.275   4.149   0.873
  257   1HD1  ILE  33          1HD1      ILE  33   7.131   3.491   0.853
  258   2HD1  ILE  33          2HD1      ILE  33   6.831   4.278  -0.697
  259   3HD1  ILE  33          3HD1      ILE  33   8.219   3.211  -0.507
  260    H    THR  34           H        THR  34   4.102   3.175   2.918
  261    HA   THR  34           HA       THR  34   6.314   4.798   3.633
  262    HB   THR  34           HB       THR  34   4.906   5.579   5.530
  263    HG1  THR  34           HG1      THR  34   3.282   4.417   6.185
  264   1HG2  THR  34          1HG2      THR  34   3.892   5.314   2.736
  265   2HG2  THR  34          2HG2      THR  34   4.323   6.765   3.643
  266   3HG2  THR  34          3HG2      THR  34   2.787   5.955   3.953
  267    H    LYS  35           H        LYS  35   5.181   1.776   5.050
  268    HA   LYS  35           HA       LYS  35   6.990   2.054   7.354
  269   1HB   LYS  35          2HB       LYS  35   4.764   0.334   6.606
  270   2HB   LYS  35          1HB       LYS  35   6.122  -0.602   7.232
  271   1HG   LYS  35          2HG       LYS  35   6.179   0.690   9.264
  272   2HG   LYS  35          1HG       LYS  35   5.014   1.852   8.621
  273   1HD   LYS  35          2HD       LYS  35   3.673   0.473   9.968
  274   2HD   LYS  35          1HD       LYS  35   3.454  -0.225   8.362
  275   1HE   LYS  35          2HE       LYS  35   5.068  -1.960   8.818
  276   2HE   LYS  35          1HE       LYS  35   5.529  -1.198  10.341
  277   1HZ   LYS  35          1HZ       LYS  35   3.214  -2.823   9.709
  278   2HZ   LYS  35          2HZ       LYS  35   2.898  -1.461  10.676
  279   3HZ   LYS  35          3HZ       LYS  35   4.030  -2.622  11.182
  280    H    HIS  36           H        HIS  36   6.789   0.058   4.403
  281    HA   HIS  36           HA       HIS  36   9.373  -1.199   5.012
  282   1HB   HIS  36          2HB       HIS  36   7.235  -1.534   2.984
  283   2HB   HIS  36          1HB       HIS  36   8.870  -1.926   2.450
  284    HD1  HIS  36           HD1      HIS  36  10.013  -3.974   3.492
  285    HD2  HIS  36           HD2      HIS  36   6.271  -3.177   5.147
  286    HE1  HIS  36           HE1      HIS  36   9.423  -5.976   4.927
  287    H    TYR  37           H        TYR  37   8.619   1.810   3.979
  288    HA   TYR  37           HA       TYR  37  11.158   1.986   2.439
  289   1HB   TYR  37          2HB       TYR  37   8.539   2.382   1.379
  290   2HB   TYR  37          1HB       TYR  37   9.351   3.950   1.415
  291    HD1  TYR  37           HD1      TYR  37  11.066   4.437  -0.168
  292    HD2  TYR  37           HD2      TYR  37   9.692   0.414   0.392
  293    HE1  TYR  37           HE1      TYR  37  12.407   3.701  -2.116
  294    HE2  TYR  37           HE2      TYR  37  11.023  -0.324  -1.546
  295    HH   TYR  37           HH       TYR  37  13.479   1.230  -2.790
  296    HA   PRO  38           HA       PRO  38  11.579   5.119   5.590
  297   1HB   PRO  38          2HB       PRO  38  14.211   5.682   5.026
  298   2HB   PRO  38          1HB       PRO  38  13.687   4.287   5.987
  299   1HG   PRO  38          2HG       PRO  38  14.685   4.363   3.177
  300   2HG   PRO  38          1HG       PRO  38  14.754   3.044   4.358
  301   1HD   PRO  38          2HD       PRO  38  12.918   3.251   2.215
  302   2HD   PRO  38          1HD       PRO  38  12.792   2.136   3.593
  303    H    TYR  39           H        TYR  39  11.626   5.500   2.216
  304    HA   TYR  39           HA       TYR  39  12.285   8.382   2.317
  305   1HB   TYR  39          2HB       TYR  39  13.021   6.869   0.414
  306   2HB   TYR  39          1HB       TYR  39  11.325   6.778  -0.068
  307    HD1  TYR  39           HD1      TYR  39  14.332   8.532  -0.567
  308    HD2  TYR  39           HD2      TYR  39  10.102   9.164  -0.173
  309    HE1  TYR  39           HE1      TYR  39  14.544  10.705  -1.741
  310    HE2  TYR  39           HE2      TYR  39  10.314  11.333  -1.346
  311    HH   TYR  39           HH       TYR  39  13.064  12.216  -3.081
  312    H    TYR  40           H        TYR  40   9.495   6.255   1.896
  313    HA   TYR  40           HA       TYR  40   7.711   8.562   1.439
  314   1HB   TYR  40          2HB       TYR  40   7.500   5.606   1.236
  315   2HB   TYR  40          1HB       TYR  40   6.025   6.468   1.665
  316    HD1  TYR  40           HD1      TYR  40   8.391   8.430  -0.232
  317    HD2  TYR  40           HD2      TYR  40   5.192   5.590  -0.592
  318    HE1  TYR  40           HE1      TYR  40   8.065   9.096  -2.593
  319    HE2  TYR  40           HE2      TYR  40   4.875   6.249  -2.962
  320    HH   TYR  40           HH       TYR  40   5.345   8.306  -4.372
  321    H    ARG  41           H        ARG  41   9.157   7.504   4.118
  322    HA   ARG  41           HA       ARG  41   7.009   7.041   5.962
  323   1HB   ARG  41          2HB       ARG  41   8.636   7.563   7.704
  324   2HB   ARG  41          1HB       ARG  41   9.426   6.596   6.455
  325   1HG   ARG  41          2HG       ARG  41  10.294   8.684   5.421
  326   2HG   ARG  41          1HG       ARG  41   9.561   9.614   6.730
  327   1HD   ARG  41          2HD       ARG  41  11.409   7.341   7.390
  328   2HD   ARG  41          1HD       ARG  41  12.084   8.899   6.911
  329    HE   ARG  41           HE       ARG  41  10.080   8.866   9.103
  330   1HH1  ARG  41          1HH2      ARG  41  12.701   7.738  10.012
  331   2HH1  ARG  41          2HH2      ARG  41  13.539   9.156  10.549
  332   1HH2  ARG  41          1HH1      ARG  41  11.418  11.353   8.906
  333   2HH2  ARG  41          2HH1      ARG  41  12.813  11.203   9.923
  334    H    THR  42           H        THR  42   8.539   9.965   4.717
  335    HA   THR  42           HA       THR  42   6.294  11.545   5.873
  336    HB   THR  42           HB       THR  42   7.904  13.352   6.468
  337    HG1  THR  42           HG1      THR  42   9.704  13.072   5.383
  338   1HG2  THR  42          1HG2      THR  42   8.012  12.463   8.534
  339   2HG2  THR  42          2HG2      THR  42   9.134  11.212   7.999
  340   3HG2  THR  42          3HG2      THR  42   7.396  10.963   7.840
  341    H    ALA  43           H        ALA  43   5.497  11.481   3.654
  342    HA   ALA  43           HA       ALA  43   7.084  13.213   1.801
  343   1HB   ALA  43          1HB       ALA  43   6.378  10.609   1.354
  344   2HB   ALA  43          2HB       ALA  43   6.666  11.790   0.075
  345   3HB   ALA  43          3HB       ALA  43   5.021  11.464   0.621
  346    H    ASP  44           H        ASP  44   5.219  13.793  -0.078
  347    HA   ASP  44           HA       ASP  44   3.226  15.381   1.470
  348   1HB   ASP  44          2HB       ASP  44   4.248  15.667  -1.373
  349   2HB   ASP  44          1HB       ASP  44   3.061  16.733  -0.618
  350    H    LYS  45           H        LYS  45   1.125  15.749   0.042
  351    HA   LYS  45           HA       LYS  45   0.039  13.070  -0.487
  352   1HB   LYS  45          2HB       LYS  45  -1.330  15.758  -0.785
  353   2HB   LYS  45          1HB       LYS  45  -2.105  14.181  -0.646
  354   1HG   LYS  45          2HG       LYS  45  -0.746  14.044   1.612
  355   2HG   LYS  45          1HG       LYS  45  -0.722  15.801   1.467
  356   1HD   LYS  45          2HD       LYS  45  -3.105  15.936   1.478
  357   2HD   LYS  45          1HD       LYS  45  -3.274  14.200   1.222
  358   1HE   LYS  45          2HE       LYS  45  -1.726  14.381   3.530
  359   2HE   LYS  45          1HE       LYS  45  -2.913  15.671   3.715
  360   1HZ   LYS  45          1HZ       LYS  45  -3.786  13.626   4.593
  361   2HZ   LYS  45          2HZ       LYS  45  -3.489  12.818   3.130
  362   3HZ   LYS  45          3HZ       LYS  45  -4.658  14.048   3.201
  363    H    GLY  46           H        GLY  46   1.728  13.008  -2.379
  364   1HA   GLY  46          2HA       GLY  46   0.504  14.231  -4.820
  365   2HA   GLY  46          1HA       GLY  46   2.212  13.802  -4.682
  366    H    TRP  47           H        TRP  47   2.603  11.401  -4.237
  367    HA   TRP  47           HA       TRP  47   1.470   9.821  -6.299
  368   1HB   TRP  47          2HB       TRP  47   2.581   7.929  -5.258
  369   2HB   TRP  47          1HB       TRP  47   3.640   9.335  -5.177
  370    HD1  TRP  47           HD1      TRP  47   3.084  10.820  -2.711
  371    HE1  TRP  47           HE1      TRP  47   3.154   9.814  -0.357
  372    HE3  TRP  47           HE3      TRP  47   2.301   5.900  -3.846
  373    HZ2  TRP  47           HZ2      TRP  47   2.922   7.259   0.894
  374    HZ3  TRP  47           HZ3      TRP  47   2.245   4.205  -2.045
  375    HH2  TRP  47           HH2      TRP  47   2.546   4.878   0.318
  376    H    GLN  48           H        GLN  48   0.580  10.096  -2.860
  377    HA   GLN  48           HA       GLN  48  -1.146   7.891  -2.751
  378   1HB   GLN  48          2HB       GLN  48  -1.428   8.675  -0.653
  379   2HB   GLN  48          1HB       GLN  48  -0.585  10.146  -1.108
  380   1HG   GLN  48          2HG       GLN  48  -3.564   9.679  -1.463
  381   2HG   GLN  48          1HG       GLN  48  -2.838  10.595  -0.143
  382   1HE2  GLN  48          1HE2      GLN  48  -0.737  11.448  -2.382
  383   2HE2  GLN  48          2HE2      GLN  48  -1.539  12.708  -3.166
  384    H    ASN  49           H        ASN  49  -1.532  10.926  -4.404
  385    HA   ASN  49           HA       ASN  49  -4.402  10.691  -4.841
  386   1HB   ASN  49          2HB       ASN  49  -2.238  12.536  -5.604
  387   2HB   ASN  49          1HB       ASN  49  -3.457  12.313  -6.859
  388   1HD2  ASN  49          1HD2      ASN  49  -2.846  14.540  -4.700
  389   2HD2  ASN  49          2HD2      ASN  49  -4.386  14.870  -4.068
  390    H    SER  50           H        SER  50  -1.568  10.375  -6.979
  391    HA   SER  50           HA       SER  50  -3.022   9.203  -9.148
  392   1HB   SER  50          2HB       SER  50  -0.241   8.324  -8.965
  393   2HB   SER  50          1HB       SER  50  -1.026   9.303 -10.198
  394    HG   SER  50           HG       SER  50   0.388  10.051  -7.940
  395    H    ILE  51           H        ILE  51  -2.227   7.954  -6.109
  396    HA   ILE  51           HA       ILE  51  -1.822   5.179  -6.875
  397    HB   ILE  51           HB       ILE  51  -2.319   6.677  -4.301
  398   1HG1  ILE  51          2HG1      ILE  51  -0.059   6.493  -4.314
  399   2HG1  ILE  51          1HG1      ILE  51  -0.315   4.818  -3.868
  400   1HG2  ILE  51          1HG2      ILE  51  -2.085   4.197  -3.314
  401   2HG2  ILE  51          2HG2      ILE  51  -2.906   3.788  -4.819
  402   3HG2  ILE  51          3HG2      ILE  51  -3.659   4.903  -3.678
  403   1HD1  ILE  51          1HD1      ILE  51   0.139   5.921  -6.651
  404   2HD1  ILE  51          2HD1      ILE  51  -0.341   4.257  -6.328
  405   3HD1  ILE  51          3HD1      ILE  51   1.205   4.856  -5.735
  406    H    ARG  52           H        ARG  52  -4.551   6.640  -5.045
  407    HA   ARG  52           HA       ARG  52  -6.368   4.539  -5.443
  408   1HB   ARG  52          2HB       ARG  52  -6.872   6.442  -3.976
  409   2HB   ARG  52          1HB       ARG  52  -6.956   7.518  -5.372
  410   1HG   ARG  52          2HG       ARG  52  -8.742   5.801  -6.240
  411   2HG   ARG  52          1HG       ARG  52  -8.860   5.349  -4.540
  412   1HD   ARG  52          2HD       ARG  52  -9.189   7.808  -4.016
  413   2HD   ARG  52          1HD       ARG  52  -9.336   8.082  -5.752
  414    HE   ARG  52           HE       ARG  52 -11.150   6.028  -5.153
  415   1HH1  ARG  52          1HH1      ARG  52 -11.517   7.475  -2.570
  416   2HH1  ARG  52          2HH1      ARG  52 -12.746   8.630  -2.964
  417   1HH2  ARG  52          1HH2      ARG  52 -12.329   8.302  -6.390
  418   2HH2  ARG  52          2HH2      ARG  52 -13.205   9.100  -5.127
  419    H    HIS  53           H        HIS  53  -5.525   7.199  -7.605
  420    HA   HIS  53           HA       HIS  53  -7.537   6.559  -9.600
  421   1HB   HIS  53          2HB       HIS  53  -6.052   8.748  -9.143
  422   2HB   HIS  53          1HB       HIS  53  -5.015   7.975 -10.341
  423    HD1  HIS  53           HD1      HIS  53  -8.805   8.433 -10.051
  424    HD2  HIS  53           HD2      HIS  53  -5.733   8.916 -12.827
  425    HE1  HIS  53           HE1      HIS  53  -9.891   9.258 -12.185
  426    H    ASN  54           H        ASN  54  -4.239   5.595  -8.962
  427    HA   ASN  54           HA       ASN  54  -3.710   4.431 -11.535
  428   1HB   ASN  54          2HB       ASN  54  -2.411   4.501  -8.879
  429   2HB   ASN  54          1HB       ASN  54  -2.032   3.092  -9.870
  430   1HD2  ASN  54          1HD2      ASN  54  -0.603   5.856  -9.161
  431   2HD2  ASN  54          2HD2      ASN  54   0.009   6.330 -10.673
  432    H    LEU  55           H        LEU  55  -4.934   3.033  -8.461
  433    HA   LEU  55           HA       LEU  55  -4.906   0.368  -9.593
  434   1HB   LEU  55          2HB       LEU  55  -6.701   0.931  -7.276
  435   2HB   LEU  55          1HB       LEU  55  -5.650  -0.438  -7.569
  436    HG   LEU  55           HG       LEU  55  -4.447   0.559  -5.915
  437   1HD1  LEU  55          1HD1      LEU  55  -3.318   2.616  -7.674
  438   2HD1  LEU  55          2HD1      LEU  55  -3.347   0.997  -8.373
  439   3HD1  LEU  55          3HD1      LEU  55  -2.527   1.282  -6.841
  440   1HD2  LEU  55          1HD2      LEU  55  -4.427   3.138  -5.695
  441   2HD2  LEU  55          2HD2      LEU  55  -5.897   2.268  -5.262
  442   3HD2  LEU  55          3HD2      LEU  55  -5.785   3.088  -6.819
  443    H    SER  56           H        SER  56  -6.785   2.962 -10.309
  444    HA   SER  56           HA       SER  56  -9.318   1.467 -10.603
  445   1HB   SER  56          2HB       SER  56  -8.806   4.249 -11.636
  446   2HB   SER  56          1HB       SER  56 -10.324   3.536 -11.100
  447    HG   SER  56           HG       SER  56  -9.755   3.833  -9.052
  448    H    LEU  57           H        LEU  57  -7.017   3.210 -12.719
  449    HA   LEU  57           HA       LEU  57  -8.246   1.966 -15.093
  450   1HB   LEU  57          2HB       LEU  57  -6.643   3.377 -16.336
  451   2HB   LEU  57          1HB       LEU  57  -7.574   4.331 -15.185
  452    HG   LEU  57           HG       LEU  57  -5.289   3.330 -13.813
  453   1HD1  LEU  57          1HD1      LEU  57  -4.623   4.726 -16.424
  454   2HD1  LEU  57          2HD1      LEU  57  -4.288   3.031 -16.063
  455   3HD1  LEU  57          3HD1      LEU  57  -3.475   4.304 -15.153
  456   1HD2  LEU  57          1HD2      LEU  57  -6.761   5.583 -13.824
  457   2HD2  LEU  57          2HD2      LEU  57  -5.392   6.147 -14.781
  458   3HD2  LEU  57          3HD2      LEU  57  -5.132   5.528 -13.150
  459    H    ASN  58           H        ASN  58  -5.537   1.461 -12.991
  460    HA   ASN  58           HA       ASN  58  -3.592   0.269 -14.546
  461   1HB   ASN  58          2HB       ASN  58  -4.559  -0.168 -11.793
  462   2HB   ASN  58          1HB       ASN  58  -3.745  -1.562 -12.500
  463   1HD2  ASN  58          1HD2      ASN  58  -3.128   1.961 -12.969
  464   2HD2  ASN  58          2HD2      ASN  58  -1.504   1.888 -12.483
  465    H    ARG  59           H        ARG  59  -3.200  -2.133 -14.941
  466    HA   ARG  59           HA       ARG  59  -5.610  -3.216 -16.249
  467   1HB   ARG  59          2HB       ARG  59  -3.566  -3.205 -17.551
  468   2HB   ARG  59          1HB       ARG  59  -2.712  -4.093 -16.289
  469   1HG   ARG  59          2HG       ARG  59  -3.573  -6.083 -16.948
  470   2HG   ARG  59          1HG       ARG  59  -5.186  -5.407 -17.176
  471   1HD   ARG  59          2HD       ARG  59  -2.854  -5.198 -19.103
  472   2HD   ARG  59          1HD       ARG  59  -4.328  -6.138 -19.335
  473    HE   ARG  59           HE       ARG  59  -4.057  -3.373 -19.956
  474   1HH1  ARG  59          1HH1      ARG  59  -6.323  -5.534 -20.412
  475   2HH1  ARG  59          2HH1      ARG  59  -7.676  -4.642 -19.802
  476   1HH2  ARG  59          1HH2      ARG  59  -5.727  -2.221 -18.263
  477   2HH2  ARG  59          2HH2      ARG  59  -7.339  -2.766 -18.585
  478    H    TYR  60           H        TYR  60  -3.350  -4.164 -13.651
  479    HA   TYR  60           HA       TYR  60  -4.977  -6.611 -13.231
  480   1HB   TYR  60          2HB       TYR  60  -3.153  -6.806 -11.281
  481   2HB   TYR  60          1HB       TYR  60  -2.828  -7.325 -12.931
  482    HD1  TYR  60           HD1      TYR  60  -2.859  -3.987 -11.135
  483    HD2  TYR  60           HD2      TYR  60  -0.730  -6.744 -13.647
  484    HE1  TYR  60           HE1      TYR  60  -0.984  -2.385 -11.326
  485    HE2  TYR  60           HE2      TYR  60   1.142  -5.144 -13.834
  486    HH   TYR  60           HH       TYR  60   1.684  -2.719 -11.839
  487    H    PHE  61           H        PHE  61  -4.507  -3.459 -11.834
  488    HA   PHE  61           HA       PHE  61  -5.572  -4.235  -9.241
  489   1HB   PHE  61          2HB       PHE  61  -5.074  -1.569 -10.562
  490   2HB   PHE  61          1HB       PHE  61  -5.726  -1.718  -8.924
  491    HD1  PHE  61           HD1      PHE  61  -2.840  -0.824 -10.276
  492    HD2  PHE  61           HD2      PHE  61  -4.298  -4.077  -7.888
  493    HE1  PHE  61           HE1      PHE  61  -0.553  -1.231  -9.442
  494    HE2  PHE  61           HE2      PHE  61  -2.009  -4.479  -7.051
  495    HZ   PHE  61           HZ       PHE  61  -0.143  -3.052  -7.817
  496    H    ILE  62           H        ILE  62  -7.651  -3.652  -8.429
  497    HA   ILE  62           HA       ILE  62  -9.709  -3.000 -10.471
  498    HB   ILE  62           HB       ILE  62 -11.047  -4.888  -9.945
  499   1HG1  ILE  62          2HG1      ILE  62  -9.438  -6.205  -7.916
  500   2HG1  ILE  62          1HG1      ILE  62  -9.955  -4.619  -7.356
  501   1HG2  ILE  62          1HG2      ILE  62  -8.120  -5.653 -10.005
  502   2HG2  ILE  62          2HG2      ILE  62  -9.269  -5.646 -11.344
  503   3HG2  ILE  62          3HG2      ILE  62  -9.411  -6.854 -10.068
  504   1HD1  ILE  62          1HD1      ILE  62 -12.294  -5.193  -8.017
  505   2HD1  ILE  62          2HD1      ILE  62 -11.654  -6.268  -6.774
  506   3HD1  ILE  62          3HD1      ILE  62 -11.740  -6.809  -8.450
  507    H    LYS  63           H        LYS  63 -11.923  -2.752  -9.236
  508    HA   LYS  63           HA       LYS  63 -11.417  -1.450  -6.594
  509   1HB   LYS  63          2HB       LYS  63 -12.618  -0.334  -9.060
  510   2HB   LYS  63          1HB       LYS  63 -13.513  -0.008  -7.573
  511   1HG   LYS  63          2HG       LYS  63 -10.672   0.350  -7.138
  512   2HG   LYS  63          1HG       LYS  63 -11.218   1.341  -8.492
  513   1HD   LYS  63          2HD       LYS  63 -12.777   1.256  -5.915
  514   2HD   LYS  63          1HD       LYS  63 -11.401   2.344  -6.106
  515   1HE   LYS  63          2HE       LYS  63 -12.686   2.875  -8.413
  516   2HE   LYS  63          1HE       LYS  63 -14.070   2.413  -7.422
  517   1HZ   LYS  63          1HZ       LYS  63 -12.479   4.779  -7.319
  518   2HZ   LYS  63          2HZ       LYS  63 -12.566   4.019  -5.802
  519   3HZ   LYS  63          3HZ       LYS  63 -13.990   4.465  -6.615
  520    H    VAL  64           H        VAL  64 -13.019  -1.830  -5.045
  521    HA   VAL  64           HA       VAL  64 -15.159  -3.740  -5.884
  522    HB   VAL  64           HB       VAL  64 -14.121  -3.330  -3.075
  523   1HG1  VAL  64          1HG1      VAL  64 -15.292  -5.849  -4.216
  524   2HG1  VAL  64          2HG1      VAL  64 -16.370  -4.529  -3.761
  525   3HG1  VAL  64          3HG1      VAL  64 -15.315  -5.263  -2.553
  526   1HG2  VAL  64          1HG2      VAL  64 -13.267  -5.560  -4.924
  527   2HG2  VAL  64          2HG2      VAL  64 -12.527  -5.045  -3.407
  528   3HG2  VAL  64          3HG2      VAL  64 -12.367  -4.044  -4.851
  529    HA   PRO  65           HA       PRO  65 -17.559  -0.062  -4.749
  530   1HB   PRO  65          2HB       PRO  65 -19.617  -0.645  -6.479
  531   2HB   PRO  65          1HB       PRO  65 -18.150   0.226  -6.961
  532   1HG   PRO  65          2HG       PRO  65 -18.935  -2.592  -7.538
  533   2HG   PRO  65          1HG       PRO  65 -17.871  -1.513  -8.455
  534   1HD   PRO  65          2HD       PRO  65 -17.031  -3.593  -6.727
  535   2HD   PRO  65          1HD       PRO  65 -16.002  -2.307  -7.392
  536    H    ARG  66           H        ARG  66 -20.237  -0.174  -4.458
  537    HA   ARG  66           HA       ARG  66 -20.598  -2.278  -2.412
  538   1HB   ARG  66          2HB       ARG  66 -21.204   0.169  -2.036
  539   2HB   ARG  66          1HB       ARG  66 -22.539  -0.080  -3.163
  540   1HG   ARG  66          2HG       ARG  66 -22.880  -2.224  -1.527
  541   2HG   ARG  66          1HG       ARG  66 -22.206  -1.058  -0.387
  542   1HD   ARG  66          2HD       ARG  66 -24.674  -0.737  -2.108
  543   2HD   ARG  66          1HD       ARG  66 -24.586  -0.749  -0.346
  544    HE   ARG  66           HE       ARG  66 -23.070   1.391  -1.697
  545   1HH1  ARG  66          1HH2      ARG  66 -24.947   0.614   0.929
  546   2HH1  ARG  66          2HH2      ARG  66 -25.876   2.074   0.942
  547   1HH2  ARG  66          1HH1      ARG  66 -24.686   3.173  -2.124
  548   2HH2  ARG  66          2HH1      ARG  66 -25.728   3.524  -0.786
  549    H    SER  67           H        SER  67 -20.681  -2.753  -5.422
  550    HA   SER  67           HA       SER  67 -23.499  -3.659  -5.712
  551   1HB   SER  67          2HB       SER  67 -22.450  -2.365  -7.574
  552   2HB   SER  67          1HB       SER  67 -21.254  -3.647  -7.752
  553    HG   SER  67           HG       SER  67 -23.822  -3.523  -8.623
  554    H    GLN  68           H        GLN  68 -21.223  -4.930  -4.060
  555    HA   GLN  68           HA       GLN  68 -21.053  -7.567  -5.420
  556   1HB   GLN  68          2HB       GLN  68 -19.249  -6.106  -3.846
  557   2HB   GLN  68          1HB       GLN  68 -19.786  -7.427  -2.806
  558   1HG   GLN  68          2HG       GLN  68 -19.103  -8.084  -5.639
  559   2HG   GLN  68          1HG       GLN  68 -17.773  -7.748  -4.532
  560   1HE2  GLN  68          1HE2      GLN  68 -18.642 -10.389  -5.744
  561   2HE2  GLN  68          2HE2      GLN  68 -18.905 -11.415  -4.417
  562    H    GLU  69           H        GLU  69 -21.395  -9.508  -3.923
  563    HA   GLU  69           HA       GLU  69 -24.019  -9.261  -2.682
  564   1HB   GLU  69          2HB       GLU  69 -22.100 -11.610  -2.706
  565   2HB   GLU  69          1HB       GLU  69 -23.809 -11.670  -2.277
  566   1HG   GLU  69          2HG       GLU  69 -23.623 -10.380  -4.807
  567   2HG   GLU  69          1HG       GLU  69 -22.626 -11.833  -4.884
  568    H    GLU  70           H        GLU  70 -21.026  -8.429  -1.582
  569    HA   GLU  70           HA       GLU  70 -21.483  -9.403   1.187
  570   1HB   GLU  70          2HB       GLU  70 -19.132  -8.019  -0.137
  571   2HB   GLU  70          1HB       GLU  70 -19.199  -8.391   1.587
  572   1HG   GLU  70          2HG       GLU  70 -19.877 -10.655  -0.183
  573   2HG   GLU  70          1HG       GLU  70 -18.209 -10.096  -0.312
  574    HA   PRO  71           HA       PRO  71 -23.072  -5.460   2.353
  575   1HB   PRO  71          2HB       PRO  71 -22.809  -5.769   5.072
  576   2HB   PRO  71          1HB       PRO  71 -24.076  -6.559   4.116
  577   1HG   PRO  71          2HG       PRO  71 -21.614  -7.742   5.310
  578   2HG   PRO  71          1HG       PRO  71 -23.155  -8.521   4.916
  579   1HD   PRO  71          2HD       PRO  71 -20.774  -8.671   3.386
  580   2HD   PRO  71          1HD       PRO  71 -22.393  -9.176   2.855
  581    H    GLY  72           H        GLY  72 -21.334  -4.094   1.557
  582   1HA   GLY  72          2HA       GLY  72 -19.198  -3.520   3.570
  583   2HA   GLY  72          1HA       GLY  72 -18.996  -3.284   1.830
  584    H    LYS  73           H        LYS  73 -18.528  -1.186   3.632
  585    HA   LYS  73           HA       LYS  73 -20.545   0.750   2.686
  586   1HB   LYS  73          2HB       LYS  73 -21.241  -0.180   4.992
  587   2HB   LYS  73          1HB       LYS  73 -19.848   0.698   5.624
  588   1HG   LYS  73          2HG       LYS  73 -20.961   2.644   4.110
  589   2HG   LYS  73          1HG       LYS  73 -22.411   1.741   4.546
  590   1HD   LYS  73          2HD       LYS  73 -22.292   2.367   6.726
  591   2HD   LYS  73          1HD       LYS  73 -20.540   2.174   6.782
  592   1HE   LYS  73          2HE       LYS  73 -20.271   4.311   5.567
  593   2HE   LYS  73          1HE       LYS  73 -22.024   4.511   5.545
  594   1HZ   LYS  73          1HZ       LYS  73 -21.962   4.390   8.003
  595   2HZ   LYS  73          2HZ       LYS  73 -21.148   5.740   7.369
  596   3HZ   LYS  73          3HZ       LYS  73 -20.268   4.400   7.933
  597    H    GLY  74           H        GLY  74 -17.782   0.317   2.034
  598   1HA   GLY  74          2HA       GLY  74 -16.752   3.000   2.664
  599   2HA   GLY  74          1HA       GLY  74 -15.766   1.661   3.254
  600    H    SER  75           H        SER  75 -14.023   2.074   1.821
  601    HA   SER  75           HA       SER  75 -14.626   1.426  -1.035
  602   1HB   SER  75          2HB       SER  75 -12.447   3.333  -0.169
  603   2HB   SER  75          1HB       SER  75 -13.078   3.073  -1.792
  604    HG   SER  75           HG       SER  75 -13.836   4.944  -0.314
  605    H    PHE  76           H        PHE  76 -13.592  -0.433  -1.577
  606    HA   PHE  76           HA       PHE  76 -10.883  -0.913  -0.434
  607   1HB   PHE  76          2HB       PHE  76 -13.085  -2.261   0.505
  608   2HB   PHE  76          1HB       PHE  76 -12.516  -3.341  -0.768
  609    HD1  PHE  76           HD1      PHE  76 -12.375  -3.224   2.535
  610    HD2  PHE  76           HD2      PHE  76  -9.622  -2.907  -0.746
  611    HE1  PHE  76           HE1      PHE  76 -10.533  -3.995   4.006
  612    HE2  PHE  76           HE2      PHE  76  -7.782  -3.681   0.726
  613    HZ   PHE  76           HZ       PHE  76  -8.236  -4.223   3.101
  614    H    TRP  77           H        TRP  77  -9.624  -0.902  -2.224
  615    HA   TRP  77           HA       TRP  77 -10.662  -2.263  -4.683
  616   1HB   TRP  77          2HB       TRP  77  -9.153  -0.829  -5.937
  617   2HB   TRP  77          1HB       TRP  77 -10.030   0.204  -4.805
  618    HD1  TRP  77           HD1      TRP  77  -8.674   1.341  -2.876
  619    HE1  TRP  77           HE1      TRP  77  -6.156   1.447  -2.319
  620    HE3  TRP  77           HE3      TRP  77  -6.947  -2.193  -6.094
  621    HZ2  TRP  77           HZ2      TRP  77  -3.723   0.172  -3.149
  622    HZ3  TRP  77           HZ3      TRP  77  -4.543  -2.735  -6.205
  623    HH2  TRP  77           HH2      TRP  77  -2.942  -1.556  -4.739
  624    H    ARG  78           H        ARG  78  -9.323  -3.930  -5.613
  625    HA   ARG  78           HA       ARG  78  -6.738  -4.482  -4.239
  626   1HB   ARG  78          2HB       ARG  78  -7.352  -6.886  -4.013
  627   2HB   ARG  78          1HB       ARG  78  -8.338  -5.824  -3.018
  628   1HG   ARG  78          2HG       ARG  78  -9.936  -5.796  -5.098
  629   2HG   ARG  78          1HG       ARG  78  -9.089  -7.282  -5.530
  630   1HD   ARG  78          2HD       ARG  78  -9.709  -7.436  -2.755
  631   2HD   ARG  78          1HD       ARG  78 -11.171  -6.927  -3.597
  632    HE   ARG  78           HE       ARG  78 -10.013  -9.555  -3.717
  633   1HH1  ARG  78          1HH2      ARG  78 -12.223  -7.363  -5.082
  634   2HH1  ARG  78          2HH2      ARG  78 -12.593  -8.350  -6.456
  635   1HH2  ARG  78          1HH1      ARG  78 -10.188 -10.737  -5.721
  636   2HH2  ARG  78          2HH1      ARG  78 -11.442 -10.260  -6.817
  637    H    ILE  79           H        ILE  79  -5.460  -6.160  -5.375
  638    HA   ILE  79           HA       ILE  79  -5.755  -5.831  -8.305
  639    HB   ILE  79           HB       ILE  79  -3.521  -5.573  -7.192
  640   1HG1  ILE  79          2HG1      ILE  79  -3.126  -7.926  -8.934
  641   2HG1  ILE  79          1HG1      ILE  79  -4.149  -6.664  -9.619
  642   1HG2  ILE  79          1HG2      ILE  79  -2.369  -7.786  -6.671
  643   2HG2  ILE  79          2HG2      ILE  79  -3.980  -8.506  -6.652
  644   3HG2  ILE  79          3HG2      ILE  79  -3.566  -7.239  -5.497
  645   1HD1  ILE  79          1HD1      ILE  79  -2.457  -5.080  -9.595
  646   2HD1  ILE  79          2HD1      ILE  79  -1.536  -6.541  -9.919
  647   3HD1  ILE  79          3HD1      ILE  79  -1.584  -5.879  -8.289
  648    H    ASP  80           H        ASP  80  -5.638  -7.726  -9.732
  649    HA   ASP  80           HA       ASP  80  -7.531  -9.726  -9.039
  650   1HB   ASP  80          2HB       ASP  80  -5.875  -9.048 -11.336
  651   2HB   ASP  80          1HB       ASP  80  -5.984 -10.795 -11.112
  652    HA   PRO  81           HA       PRO  81  -4.905 -12.479  -6.830
  653   1HB   PRO  81          2HB       PRO  81  -6.620 -14.628  -6.825
  654   2HB   PRO  81          1HB       PRO  81  -6.821 -13.212  -5.780
  655   1HG   PRO  81          2HG       PRO  81  -8.371 -13.987  -8.200
  656   2HG   PRO  81          1HG       PRO  81  -8.857 -12.967  -6.836
  657   1HD   PRO  81          2HD       PRO  81  -8.030 -12.068  -9.406
  658   2HD   PRO  81          1HD       PRO  81  -8.276 -11.052  -7.967
  659    H    ALA  82           H        ALA  82  -6.150 -13.184 -10.016
  660    HA   ALA  82           HA       ALA  82  -4.419 -15.561 -10.317
  661   1HB   ALA  82          1HB       ALA  82  -5.651 -14.623 -12.772
  662   2HB   ALA  82          2HB       ALA  82  -6.841 -14.735 -11.475
  663   3HB   ALA  82          3HB       ALA  82  -5.888 -16.150 -11.921
  664    H    SER  83           H        SER  83  -4.327 -12.160 -10.996
  665    HA   SER  83           HA       SER  83  -2.043 -12.579 -12.868
  666   1HB   SER  83          2HB       SER  83  -4.086 -10.486 -12.535
  667   2HB   SER  83          1HB       SER  83  -2.453  -9.846 -12.730
  668    HG   SER  83           HG       SER  83  -2.532 -10.428 -14.742
  669    H    GLU  84           H        GLU  84  -2.694 -12.010  -9.618
  670    HA   GLU  84           HA       GLU  84  -0.740 -10.092  -8.911
  671   1HB   GLU  84          2HB       GLU  84  -2.441 -10.924  -7.332
  672   2HB   GLU  84          1HB       GLU  84  -1.666 -12.508  -7.330
  673   1HG   GLU  84          2HG       GLU  84   0.308 -11.646  -6.288
  674   2HG   GLU  84          1HG       GLU  84  -0.198  -9.978  -6.558
  675    H    ALA  85           H        ALA  85  -0.392 -13.607  -9.407
  676    HA   ALA  85           HA       ALA  85   2.323 -13.733  -8.475
  677   1HB   ALA  85          1HB       ALA  85   2.117 -15.924  -9.003
  678   2HB   ALA  85          2HB       ALA  85   1.754 -15.554 -10.689
  679   3HB   ALA  85          3HB       ALA  85   0.463 -15.553  -9.487
  680    H    LYS  86           H        LYS  86   0.918 -12.473 -11.366
  681    HA   LYS  86           HA       LYS  86   3.449 -12.562 -12.872
  682   1HB   LYS  86          2HB       LYS  86   1.361 -12.865 -14.109
  683   2HB   LYS  86          1HB       LYS  86   0.761 -11.313 -13.523
  684   1HG   LYS  86          2HG       LYS  86   3.347 -10.894 -14.677
  685   2HG   LYS  86          1HG       LYS  86   2.374 -11.816 -15.823
  686   1HD   LYS  86          2HD       LYS  86   0.772 -10.141 -16.024
  687   2HD   LYS  86          1HD       LYS  86   1.141  -9.457 -14.440
  688   1HE   LYS  86          2HE       LYS  86   3.210  -8.514 -15.249
  689   2HE   LYS  86          1HE       LYS  86   3.053  -9.363 -16.787
  690   1HZ   LYS  86          1HZ       LYS  86   2.003  -6.864 -16.058
  691   2HZ   LYS  86          2HZ       LYS  86   0.708  -7.917 -16.373
  692   3HZ   LYS  86          3HZ       LYS  86   1.900  -7.655 -17.554
  693    H    LEU  87           H        LEU  87   1.231  -9.931 -11.835
  694    HA   LEU  87           HA       LEU  87   2.951  -7.784 -12.379
  695   1HB   LEU  87          2HB       LEU  87   1.755  -6.803 -10.189
  696   2HB   LEU  87          1HB       LEU  87   0.926  -6.948 -11.721
  697    HG   LEU  87           HG       LEU  87   0.772  -9.426 -10.203
  698   1HD1  LEU  87          1HD1      LEU  87   0.164  -6.847  -8.853
  699   2HD1  LEU  87          2HD1      LEU  87   0.632  -8.399  -8.157
  700   3HD1  LEU  87          3HD1      LEU  87  -1.029  -8.134  -8.685
  701   1HD2  LEU  87          1HD2      LEU  87  -1.165  -7.446 -11.414
  702   2HD2  LEU  87          2HD2      LEU  87  -1.707  -8.909 -10.597
  703   3HD2  LEU  87          3HD2      LEU  87  -0.712  -9.019 -12.049
  704    H    VAL  88           H        VAL  88   2.553  -9.414  -9.263
  705    HA   VAL  88           HA       VAL  88   4.391  -8.142  -7.693
  706    HB   VAL  88           HB       VAL  88   4.870 -10.357  -6.709
  707   1HG1  VAL  88          1HG1      VAL  88   2.950  -9.566  -5.724
  708   2HG1  VAL  88          2HG1      VAL  88   2.239 -10.933  -6.582
  709   3HG1  VAL  88          3HG1      VAL  88   2.151  -9.313  -7.275
  710   1HG2  VAL  88          1HG2      VAL  88   3.366 -12.210  -7.825
  711   2HG2  VAL  88          2HG2      VAL  88   4.971 -11.875  -8.475
  712   3HG2  VAL  88          3HG2      VAL  88   3.545 -11.194  -9.256
  713    H    GLU  89           H        GLU  89   5.130 -10.295 -10.389
  714    HA   GLU  89           HA       GLU  89   7.867 -10.770  -9.894
  715   1HB   GLU  89          2HB       GLU  89   6.629 -11.807 -11.772
  716   2HB   GLU  89          1HB       GLU  89   6.535 -10.238 -12.572
  717   1HG   GLU  89          2HG       GLU  89   8.939 -10.136 -12.805
  718   2HG   GLU  89          1HG       GLU  89   9.144 -11.578 -11.809
  719    H    GLN  90           H        GLN  90   6.420  -8.108 -11.804
  720    HA   GLN  90           HA       GLN  90   8.897  -6.647 -12.015
  721   1HB   GLN  90          2HB       GLN  90   6.014  -5.713 -12.225
  722   2HB   GLN  90          1HB       GLN  90   7.418  -4.743 -12.671
  723   1HG   GLN  90          2HG       GLN  90   7.915  -6.064 -14.523
  724   2HG   GLN  90          1HG       GLN  90   7.110  -7.483 -13.853
  725   1HE2  GLN  90          1HE2      GLN  90   4.855  -7.745 -14.267
  726   2HE2  GLN  90          2HE2      GLN  90   3.960  -6.674 -15.233
  727    H    ALA  91           H        ALA  91   6.600  -7.108  -9.501
  728    HA   ALA  91           HA       ALA  91   6.920  -4.666  -8.066
  729   1HB   ALA  91          1HB       ALA  91   5.174  -6.439  -7.632
  730   2HB   ALA  91          2HB       ALA  91   5.958  -5.779  -6.196
  731   3HB   ALA  91          3HB       ALA  91   6.438  -7.360  -6.814
  732    H    PHE  92           H        PHE  92   8.770  -7.691  -8.033
  733    HA   PHE  92           HA       PHE  92  10.582  -6.624  -5.962
  734   1HB   PHE  92          2HB       PHE  92  11.108  -9.131  -7.538
  735   2HB   PHE  92          1HB       PHE  92  11.514  -8.768  -5.862
  736    HD1  PHE  92           HD1      PHE  92   9.813 -11.113  -7.307
  737    HD2  PHE  92           HD2      PHE  92   8.876  -7.646  -4.952
  738    HE1  PHE  92           HE1      PHE  92   7.709 -12.191  -6.559
  739    HE2  PHE  92           HE2      PHE  92   6.770  -8.725  -4.203
  740    HZ   PHE  92           HZ       PHE  92   6.188 -10.997  -5.007
  741    H    ARG  93           H        ARG  93  10.722  -4.871  -8.001
  742    HA   ARG  93           HA       ARG  93  13.372  -5.497  -9.214
  743   1HB   ARG  93          2HB       ARG  93  10.835  -4.898 -10.597
  744   2HB   ARG  93          1HB       ARG  93  12.210  -3.936 -11.142
  745   1HG   ARG  93          2HG       ARG  93  12.725  -6.834 -10.748
  746   2HG   ARG  93          1HG       ARG  93  11.674  -6.410 -12.101
  747   1HD   ARG  93          2HD       ARG  93  13.402  -4.777 -12.873
  748   2HD   ARG  93          1HD       ARG  93  14.465  -5.346 -11.585
  749    HE   ARG  93           HE       ARG  93  13.496  -7.115 -13.797
  750   1HH1  ARG  93          1HH2      ARG  93  16.234  -5.506 -13.123
  751   2HH1  ARG  93          2HH2      ARG  93  17.255  -6.883 -12.871
  752   1HH2  ARG  93          1HH1      ARG  93  14.627  -9.144 -12.770
  753   2HH2  ARG  93          2HH1      ARG  93  16.344  -8.944 -12.671
  754    H    LYS  94           H        LYS  94  13.973  -3.179 -10.434
  755    HA   LYS  94           HA       LYS  94  13.644  -1.130  -8.277
  756   1HB   LYS  94          2HB       LYS  94  16.004  -2.078  -9.803
  757   2HB   LYS  94          1HB       LYS  94  15.894  -0.332  -9.569
  758   1HG   LYS  94          2HG       LYS  94  15.356  -0.966  -7.083
  759   2HG   LYS  94          1HG       LYS  94  16.111  -2.505  -7.503
  760   1HD   LYS  94          2HD       LYS  94  18.107  -1.232  -8.337
  761   2HD   LYS  94          1HD       LYS  94  17.363   0.247  -7.727
  762   1HE   LYS  94          2HE       LYS  94  17.680  -0.339  -5.515
  763   2HE   LYS  94          1HE       LYS  94  17.591  -2.068  -5.851
  764   1HZ   LYS  94          1HZ       LYS  94  19.765  -2.119  -6.604
  765   2HZ   LYS  94          2HZ       LYS  94  19.857  -1.048  -5.288
  766   3HZ   LYS  94          3HZ       LYS  94  19.832  -0.446  -6.876
  767    H    ARG  95           H        ARG  95  13.775   1.145  -9.089
  768    HA   ARG  95           HA       ARG  95  12.239   1.394 -11.602
  769   1HB   ARG  95          2HB       ARG  95  11.358   2.708  -9.820
  770   2HB   ARG  95          1HB       ARG  95  12.953   3.314  -9.376
  771   1HG   ARG  95          2HG       ARG  95  11.594   4.995 -10.628
  772   2HG   ARG  95          1HG       ARG  95  13.097   4.582 -11.452
  773   1HD   ARG  95          2HD       ARG  95  12.004   3.301 -13.083
  774   2HD   ARG  95          1HD       ARG  95  10.574   3.067 -12.076
  775    HE   ARG  95           HE       ARG  95   9.974   5.429 -12.542
  776   1HH1  ARG  95          1HH1      ARG  95  12.900   5.975 -13.497
  777   2HH1  ARG  95          2HH1      ARG  95  12.614   6.225 -15.187
  778   1HH2  ARG  95          1HH2      ARG  95   9.413   4.889 -15.113
  779   2HH2  ARG  95          2HH2      ARG  95  10.640   5.609 -16.103
  780    H    ARG  96           H        ARG  96  13.473   1.463 -13.424
  781    HA   ARG  96           HA       ARG  96  15.518   3.535 -13.686
  782   1HB   ARG  96          2HB       ARG  96  16.611   1.424 -12.612
  783   2HB   ARG  96          1HB       ARG  96  16.448   0.720 -14.220
  784   1HG   ARG  96          2HG       ARG  96  18.062   2.061 -15.115
  785   2HG   ARG  96          1HG       ARG  96  17.576   3.456 -14.149
  786   1HD   ARG  96          2HD       ARG  96  19.867   2.399 -13.609
  787   2HD   ARG  96          1HD       ARG  96  18.782   2.708 -12.252
  788    HE   ARG  96           HE       ARG  96  18.286   0.069 -13.190
  789   1HH1  ARG  96          1HH2      ARG  96  19.204   1.282 -10.421
  790   2HH1  ARG  96          2HH2      ARG  96  20.573   0.267 -10.116
  791   1HH2  ARG  96          1HH1      ARG  96  20.720  -0.957 -13.358
  792   2HH2  ARG  96          2HH1      ARG  96  21.432  -1.002 -11.779
  793    H    GLN  97           H        GLN  97  14.424   0.468 -15.195
  794    HA   GLN  97           HA       GLN  97  14.057   2.018 -17.728
  795   1HB   GLN  97          2HB       GLN  97  15.903  -0.022 -17.322
  796   2HB   GLN  97          1HB       GLN  97  14.549  -0.841 -18.102
  797   1HG   GLN  97          2HG       GLN  97  16.021  -0.009 -19.837
  798   2HG   GLN  97          1HG       GLN  97  14.554   0.970 -19.850
  799   1HE2  GLN  97          1HE2      GLN  97  15.358   3.016 -20.472
  800   2HE2  GLN  97          2HE2      GLN  97  16.584   3.844 -19.640
  801    H    ARG  98           H        ARG  98  12.432   0.948 -19.202
  802    HA   ARG  98           HA       ARG  98  10.372  -0.547 -17.630
  803   1HB   ARG  98          2HB       ARG  98  10.117   2.054 -18.582
  804   2HB   ARG  98          1HB       ARG  98   9.296   1.084 -19.805
  805   1HG   ARG  98          2HG       ARG  98   8.641   0.158 -17.131
  806   2HG   ARG  98          1HG       ARG  98   8.253   1.869 -17.323
  807   1HD   ARG  98          2HD       ARG  98   7.451   0.549 -19.714
  808   2HD   ARG  98          1HD       ARG  98   6.839  -0.401 -18.360
  809    HE   ARG  98           HE       ARG  98   5.787   2.117 -19.188
  810   1HH1  ARG  98          1HH1      ARG  98   4.835  -0.055 -17.124
  811   2HH1  ARG  98          2HH1      ARG  98   4.607   0.955 -15.736
  812   1HH2  ARG  98          1HH2      ARG  98   6.352   3.635 -17.074
  813   2HH2  ARG  98          2HH2      ARG  98   5.466   3.045 -15.708
  814    H    GLY  99           H        GLY  99  12.382  -0.506 -20.345
  815   1HA   GLY  99          2HA       GLY  99  10.576  -2.239 -21.942
  816   2HA   GLY  99          1HA       GLY  99  12.096  -1.549 -22.509
  817    H    VAL 100           H        VAL 100  11.234  -3.520 -19.644
  818    HA   VAL 100           HA       VAL 100  13.671  -5.118 -20.029
  819    HB   VAL 100           HB       VAL 100  11.463  -5.605 -18.018
  820   1HG1  VAL 100          1HG1      VAL 100  13.675  -6.276 -16.741
  821   2HG1  VAL 100          2HG1      VAL 100  14.328  -6.424 -18.373
  822   3HG1  VAL 100          3HG1      VAL 100  12.940  -7.398 -17.884
  823   1HG2  VAL 100          1HG2      VAL 100  13.772  -4.140 -17.023
  824   2HG2  VAL 100          2HG2      VAL 100  12.058  -3.760 -16.857
  825   3HG2  VAL 100          3HG2      VAL 100  12.943  -3.237 -18.291
  826    H    SER 101           HN       SER 101  13.732  -7.107 -21.000
  827    HA   SER 101           HA       SER 101  11.236  -8.125 -22.194
  828   1HB   SER 101          2HB       SER 101  13.917  -9.475 -22.410
  829   2HB   SER 101          1HB       SER 101  12.601  -9.438 -23.580
  830    HG   SER 101           HG       SER 101  13.041  -7.216 -23.876
  Start of MODEL    5
    1   1H    GLU   1          1HT       GLU   1  14.386  15.389  -6.660
    2   2H    GLU   1          2HT       GLU   1  15.716  14.813  -5.772
    3   3H    GLU   1          3HT       GLU   1  15.323  16.466  -5.745
    4    HA   GLU   1           HA       GLU   1  14.576  14.677  -3.874
    5   1HB   GLU   1          2HB       GLU   1  13.336  17.288  -4.772
    6   2HB   GLU   1          1HB       GLU   1  12.868  16.473  -3.280
    7   1HG   GLU   1          2HG       GLU   1  15.723  17.234  -3.957
    8   2HG   GLU   1          1HG       GLU   1  14.649  18.230  -2.971
    9    H    SER   2           H        SER   2  13.797  12.863  -5.412
   10    HA   SER   2           HA       SER   2  10.856  12.848  -5.314
   11   1HB   SER   2          2HB       SER   2  12.242  12.256  -7.937
   12   2HB   SER   2          1HB       SER   2  10.511  12.384  -7.639
   13    HG   SER   2           HG       SER   2  10.705  14.439  -7.975
   14    H    LYS   3           H        LYS   3  10.287  10.533  -6.584
   15    HA   LYS   3           HA       LYS   3  12.297   8.501  -5.839
   16   1HB   LYS   3          2HB       LYS   3  10.611   9.160  -3.876
   17   2HB   LYS   3          1HB       LYS   3   9.553   8.052  -4.750
   18   1HG   LYS   3          2HG       LYS   3  10.617   6.450  -3.527
   19   2HG   LYS   3          1HG       LYS   3  11.886   6.634  -4.740
   20   1HD   LYS   3          2HD       LYS   3  12.714   8.578  -3.185
   21   2HD   LYS   3          1HD       LYS   3  11.760   7.752  -1.954
   22   1HE   LYS   3          2HE       LYS   3  12.983   5.631  -2.524
   23   2HE   LYS   3          1HE       LYS   3  14.022   6.576  -3.592
   24   1HZ   LYS   3          1HZ       LYS   3  14.346   8.029  -1.500
   25   2HZ   LYS   3          2HZ       LYS   3  15.201   6.568  -1.635
   26   3HZ   LYS   3          3HZ       LYS   3  13.815   6.656  -0.658
   27    HA   PRO   4           HA       PRO   4   9.864   7.221  -9.482
   28   1HB   PRO   4          2HB       PRO   4  12.024   6.959 -11.134
   29   2HB   PRO   4          1HB       PRO   4  11.182   8.494 -10.861
   30   1HG   PRO   4          2HG       PRO   4  13.863   7.656  -9.919
   31   2HG   PRO   4          1HG       PRO   4  13.188   9.287 -10.056
   32   1HD   PRO   4          2HD       PRO   4  13.428   7.665  -7.670
   33   2HD   PRO   4          1HD       PRO   4  12.766   9.310  -7.811
   34    HA   PRO   5           HA       PRO   5  12.490   3.187  -9.004
   35   1HB   PRO   5          2HB       PRO   5  12.179   2.222  -6.452
   36   2HB   PRO   5          1HB       PRO   5  13.565   3.194  -6.969
   37   1HG   PRO   5          2HG       PRO   5  11.252   3.980  -5.276
   38   2HG   PRO   5          1HG       PRO   5  12.883   4.668  -5.335
   39   1HD   PRO   5          2HD       PRO   5  10.555   5.763  -6.521
   40   2HD   PRO   5          1HD       PRO   5  12.230   6.291  -6.802
   41    H    TYR   6           H        TYR   6   9.708   3.555  -6.776
   42    HA   TYR   6           HA       TYR   6   8.518   1.102  -7.923
   43   1HB   TYR   6          2HB       TYR   6   7.784   2.823  -5.556
   44   2HB   TYR   6          1HB       TYR   6   6.815   1.453  -6.097
   45    HD1  TYR   6           HD1      TYR   6  10.151   0.720  -6.917
   46    HD2  TYR   6           HD2      TYR   6   7.483   0.936  -3.558
   47    HE1  TYR   6           HE1      TYR   6  11.628  -0.815  -5.638
   48    HE2  TYR   6           HE2      TYR   6   8.958  -0.597  -2.278
   49    HH   TYR   6           HH       TYR   6  11.429  -2.401  -3.734
   50    H    SER   7           H        SER   7   7.601   1.613  -9.857
   51    HA   SER   7           HA       SER   7   6.350   3.988 -10.659
   52   1HB   SER   7          2HB       SER   7   5.999   1.094 -11.319
   53   2HB   SER   7          1HB       SER   7   4.782   2.225 -11.913
   54    HG   SER   7           HG       SER   7   6.699   3.477 -12.660
   55    H    TYR   8           H        TYR   8   3.826   4.238 -10.861
   56    HA   TYR   8           HA       TYR   8   2.750   3.794  -8.154
   57   1HB   TYR   8          2HB       TYR   8   1.621   5.284 -10.537
   58   2HB   TYR   8          1HB       TYR   8   0.862   5.204  -8.944
   59    HD1  TYR   8           HD1      TYR   8   3.020   5.371  -7.068
   60    HD2  TYR   8           HD2      TYR   8   2.549   7.437 -10.803
   61    HE1  TYR   8           HE1      TYR   8   4.504   7.178  -6.249
   62    HE2  TYR   8           HE2      TYR   8   4.032   9.248  -9.983
   63    HH   TYR   8           HH       TYR   8   6.037   8.952  -7.390
   64    H    ALA   9           H        ALA   9   3.018   1.816 -10.640
   65    HA   ALA   9           HA       ALA   9   0.288   0.642 -10.283
   66   1HB   ALA   9          1HB       ALA   9   1.257  -0.674 -12.447
   67   2HB   ALA   9          2HB       ALA   9   2.091   0.868 -12.638
   68   3HB   ALA   9          3HB       ALA   9   0.330   0.820 -12.572
   69    H    GLN  10           H        GLN  10   3.746   0.145 -10.252
   70    HA   GLN  10           HA       GLN  10   3.487  -2.692  -9.421
   71   1HB   GLN  10          2HB       GLN  10   5.329  -2.137 -10.949
   72   2HB   GLN  10          1HB       GLN  10   5.901  -0.889  -9.842
   73   1HG   GLN  10          2HG       GLN  10   5.576  -3.643  -8.748
   74   2HG   GLN  10          1HG       GLN  10   6.935  -3.356  -9.834
   75   1HE2  GLN  10          1HE2      GLN  10   8.629  -1.901  -9.116
   76   2HE2  GLN  10          2HE2      GLN  10   8.719  -1.353  -7.511
   77    H    LEU  11           H        LEU  11   4.100   0.521  -8.239
   78    HA   LEU  11           HA       LEU  11   5.102  -0.066  -5.637
   79   1HB   LEU  11          2HB       LEU  11   5.131   2.213  -6.418
   80   2HB   LEU  11          1HB       LEU  11   3.400   2.189  -6.740
   81    HG   LEU  11           HG       LEU  11   3.391   1.586  -4.094
   82   1HD1  LEU  11          1HD1      LEU  11   5.883   1.819  -4.025
   83   2HD1  LEU  11          2HD1      LEU  11   5.049   2.953  -2.961
   84   3HD1  LEU  11          3HD1      LEU  11   5.698   3.505  -4.506
   85   1HD2  LEU  11          1HD2      LEU  11   2.284   3.469  -5.496
   86   2HD2  LEU  11          2HD2      LEU  11   3.672   4.443  -5.017
   87   3HD2  LEU  11          3HD2      LEU  11   2.591   3.787  -3.790
   88    H    ILE  12           H        ILE  12   1.887   0.017  -7.049
   89    HA   ILE  12           HA       ILE  12   0.409  -0.406  -4.589
   90    HB   ILE  12           HB       ILE  12  -0.506  -1.462  -7.230
   91   1HG1  ILE  12          2HG1      ILE  12   0.360   0.647  -7.942
   92   2HG1  ILE  12          1HG1      ILE  12  -1.364   0.911  -7.693
   93   1HG2  ILE  12          1HG2      ILE  12  -1.850  -1.674  -5.136
   94   2HG2  ILE  12          2HG2      ILE  12  -2.673  -0.789  -6.421
   95   3HG2  ILE  12          3HG2      ILE  12  -1.940   0.086  -5.076
   96   1HD1  ILE  12          1HD1      ILE  12  -0.940   1.849  -5.492
   97   2HD1  ILE  12          2HD1      ILE  12   0.014   2.714  -6.697
   98   3HD1  ILE  12          3HD1      ILE  12   0.784   1.521  -5.651
   99    H    VAL  13           H        VAL  13   1.548  -2.541  -7.189
  100    HA   VAL  13           HA       VAL  13   0.632  -4.993  -6.213
  101    HB   VAL  13           HB       VAL  13   3.300  -4.442  -7.537
  102   1HG1  VAL  13          1HG1      VAL  13   2.923  -6.789  -8.380
  103   2HG1  VAL  13          2HG1      VAL  13   1.597  -6.927  -7.231
  104   3HG1  VAL  13          3HG1      VAL  13   3.245  -6.681  -6.654
  105   1HG2  VAL  13          1HG2      VAL  13   2.090  -4.820  -9.630
  106   2HG2  VAL  13          2HG2      VAL  13   1.313  -3.515  -8.740
  107   3HG2  VAL  13          3HG2      VAL  13   0.598  -5.125  -8.742
  108    H    GLN  14           H        GLN  14   3.123  -2.917  -4.979
  109    HA   GLN  14           HA       GLN  14   4.365  -4.972  -3.299
  110   1HB   GLN  14          2HB       GLN  14   5.696  -3.026  -3.950
  111   2HB   GLN  14          1HB       GLN  14   4.502  -1.938  -3.243
  112   1HG   GLN  14          2HG       GLN  14   5.135  -2.418  -1.077
  113   2HG   GLN  14          1HG       GLN  14   5.647  -4.058  -1.480
  114   1HE2  GLN  14          1HE2      GLN  14   7.441  -3.558  -3.599
  115   2HE2  GLN  14          2HE2      GLN  14   8.749  -2.647  -3.024
  116    H    ALA  15           H        ALA  15   2.006  -2.391  -3.013
  117    HA   ALA  15           HA       ALA  15   1.507  -2.482  -0.236
  118   1HB   ALA  15          1HB       ALA  15  -0.664  -1.972  -2.254
  119   2HB   ALA  15          2HB       ALA  15   0.665  -0.833  -2.050
  120   3HB   ALA  15          3HB       ALA  15  -0.402  -1.195  -0.695
  121    H    ILE  16           H        ILE  16  -0.503  -4.081  -2.806
  122    HA   ILE  16           HA       ILE  16  -2.019  -5.522  -0.829
  123    HB   ILE  16           HB       ILE  16  -2.472  -7.117  -2.832
  124   1HG1  ILE  16          2HG1      ILE  16  -1.997  -6.348  -4.962
  125   2HG1  ILE  16          1HG1      ILE  16  -1.570  -4.730  -4.430
  126   1HG2  ILE  16          1HG2      ILE  16  -4.253  -5.708  -3.520
  127   2HG2  ILE  16          2HG2      ILE  16  -3.330  -4.247  -3.168
  128   3HG2  ILE  16          3HG2      ILE  16  -3.928  -5.252  -1.850
  129   1HD1  ILE  16          1HD1      ILE  16   0.505  -5.475  -3.600
  130   2HD1  ILE  16          2HD1      ILE  16   0.320  -6.360  -5.110
  131   3HD1  ILE  16          3HD1      ILE  16  -0.008  -7.161  -3.585
  132    H    SER  17           H        SER  17   1.115  -6.062  -2.055
  133    HA   SER  17           HA       SER  17   1.295  -8.892  -1.844
  134   1HB   SER  17          2HB       SER  17   3.289  -6.652  -1.621
  135   2HB   SER  17          1HB       SER  17   3.778  -8.293  -1.215
  136    HG   SER  17           HG       SER  17   3.233  -8.939  -3.273
  137    H    SER  18           H        SER  18   0.784  -6.483   0.501
  138    HA   SER  18           HA       SER  18   1.738  -8.249   2.698
  139   1HB   SER  18          2HB       SER  18   2.519  -5.999   2.963
  140   2HB   SER  18          1HB       SER  18   0.926  -5.336   2.607
  141    HG   SER  18           HG       SER  18   1.350  -7.111   4.761
  142    H    ALA  19           H        ALA  19  -1.138  -7.137   1.090
  143    HA   ALA  19           HA       ALA  19  -2.981  -7.469   3.273
  144   1HB   ALA  19          1HB       ALA  19  -3.121  -6.943   0.448
  145   2HB   ALA  19          2HB       ALA  19  -4.352  -6.662   1.680
  146   3HB   ALA  19          3HB       ALA  19  -4.270  -8.218   0.854
  147    H    GLN  20           H        GLN  20  -3.784  -9.361   4.183
  148    HA   GLN  20           HA       GLN  20  -2.624 -11.861   3.850
  149   1HB   GLN  20          2HB       GLN  20  -4.714 -10.910   5.349
  150   2HB   GLN  20          1HB       GLN  20  -5.548 -12.002   4.242
  151   1HG   GLN  20          2HG       GLN  20  -4.453 -13.876   5.040
  152   2HG   GLN  20          1HG       GLN  20  -3.019 -12.963   5.515
  153   1HE2  GLN  20          1HE2      GLN  20  -3.511 -14.378   7.587
  154   2HE2  GLN  20          2HE2      GLN  20  -4.513 -13.656   8.752
  155    H    ASP  21           H        ASP  21  -5.599 -10.729   2.221
  156    HA   ASP  21           HA       ASP  21  -5.386 -12.975   0.310
  157   1HB   ASP  21          2HB       ASP  21  -7.523 -11.394   1.346
  158   2HB   ASP  21          1HB       ASP  21  -7.445 -11.096  -0.391
  159    H    ARG  22           H        ARG  22  -6.242  -9.579  -0.361
  160    HA   ARG  22           HA       ARG  22  -3.864  -8.834  -1.705
  161   1HB   ARG  22          2HB       ARG  22  -4.429  -9.191  -4.042
  162   2HB   ARG  22          1HB       ARG  22  -4.501 -10.742  -3.207
  163   1HG   ARG  22          2HG       ARG  22  -7.027  -9.182  -3.250
  164   2HG   ARG  22          1HG       ARG  22  -6.493  -9.827  -4.802
  165   1HD   ARG  22          2HD       ARG  22  -6.150 -12.055  -3.528
  166   2HD   ARG  22          1HD       ARG  22  -7.154 -11.329  -2.273
  167    HE   ARG  22           HE       ARG  22  -8.062 -11.937  -5.047
  168   1HH1  ARG  22          1HH1      ARG  22  -9.428  -9.589  -3.707
  169   2HH1  ARG  22          2HH1      ARG  22 -10.790 -10.360  -2.965
  170   1HH2  ARG  22          1HH2      ARG  22  -9.479 -13.556  -3.256
  171   2HH2  ARG  22          2HH2      ARG  22 -10.820 -12.606  -2.709
  172    H    GLN  23           H        GLN  23  -5.765  -7.548  -0.049
  173    HA   GLN  23           HA       GLN  23  -6.577  -5.362  -1.865
  174   1HB   GLN  23          2HB       GLN  23  -8.870  -5.345  -1.133
  175   2HB   GLN  23          1HB       GLN  23  -8.501  -6.991  -1.649
  176   1HG   GLN  23          2HG       GLN  23  -7.791  -7.205   0.932
  177   2HG   GLN  23          1HG       GLN  23  -9.013  -5.941   1.087
  178   1HE2  GLN  23          1HE2      GLN  23  -9.667  -8.366   2.241
  179   2HE2  GLN  23          2HE2      GLN  23 -10.818  -9.186   1.301
  180    H    LEU  24           H        LEU  24  -5.924  -3.479  -0.933
  181    HA   LEU  24           HA       LEU  24  -5.802  -3.336   2.046
  182   1HB   LEU  24          2HB       LEU  24  -4.426  -1.350   0.251
  183   2HB   LEU  24          1HB       LEU  24  -4.017  -1.838   1.883
  184    HG   LEU  24           HG       LEU  24  -2.345  -2.930   0.761
  185   1HD1  LEU  24          1HD1      LEU  24  -2.750  -5.147   1.024
  186   2HD1  LEU  24          2HD1      LEU  24  -4.164  -5.117  -0.027
  187   3HD1  LEU  24          3HD1      LEU  24  -4.304  -4.598   1.651
  188   1HD2  LEU  24          1HD2      LEU  24  -3.159  -2.029  -1.431
  189   2HD2  LEU  24          2HD2      LEU  24  -4.217  -3.432  -1.563
  190   3HD2  LEU  24          3HD2      LEU  24  -2.471  -3.645  -1.541
  191    H    THR  25           H        THR  25  -6.194  -0.942   2.780
  192    HA   THR  25           HA       THR  25  -8.730  -0.075   1.583
  193    HB   THR  25           HB       THR  25  -8.418   1.831   3.314
  194    HG1  THR  25           HG1      THR  25  -6.832   1.517   4.797
  195   1HG2  THR  25          1HG2      THR  25  -9.766   0.524   4.544
  196   2HG2  THR  25          2HG2      THR  25  -8.403  -0.492   5.012
  197   3HG2  THR  25          3HG2      THR  25  -9.300  -0.847   3.536
  198    H    LEU  26           H        LEU  26  -8.889   2.380   0.977
  199    HA   LEU  26           HA       LEU  26  -7.126   2.926  -1.162
  200   1HB   LEU  26          2HB       LEU  26  -9.386   4.113  -0.390
  201   2HB   LEU  26          1HB       LEU  26  -8.257   5.248   0.353
  202    HG   LEU  26           HG       LEU  26  -8.079   4.380  -2.546
  203   1HD1  LEU  26          1HD1      LEU  26  -8.857   7.023  -2.538
  204   2HD1  LEU  26          2HD1      LEU  26  -9.808   6.356  -1.212
  205   3HD1  LEU  26          3HD1      LEU  26  -9.935   5.658  -2.827
  206   1HD2  LEU  26          1HD2      LEU  26  -6.450   5.980  -0.732
  207   2HD2  LEU  26          2HD2      LEU  26  -6.954   6.914  -2.141
  208   3HD2  LEU  26          3HD2      LEU  26  -6.071   5.402  -2.355
  209    H    SER  27           H        SER  27  -6.933   3.896   2.247
  210    HA   SER  27           HA       SER  27  -4.288   5.141   1.721
  211   1HB   SER  27          2HB       SER  27  -6.337   5.356   3.862
  212   2HB   SER  27          1HB       SER  27  -4.655   5.571   4.337
  213    HG   SER  27           HG       SER  27  -4.826   7.491   3.521
  214    H    GLY  28           H        GLY  28  -4.445   2.294   1.535
  215   1HA   GLY  28          2HA       GLY  28  -3.183   1.363   4.077
  216   2HA   GLY  28          1HA       GLY  28  -3.819   0.304   2.816
  217    H    ILE  29           H        ILE  29  -2.741   1.445   0.597
  218    HA   ILE  29           HA       ILE  29  -0.196   0.313   0.332
  219    HB   ILE  29           HB       ILE  29  -1.547   0.881  -1.554
  220   1HG1  ILE  29          2HG1      ILE  29   0.862   2.702  -1.492
  221   2HG1  ILE  29          1HG1      ILE  29   0.899   0.986  -1.912
  222   1HG2  ILE  29          1HG2      ILE  29  -2.556   2.876  -1.889
  223   2HG2  ILE  29          2HG2      ILE  29  -1.147   3.780  -1.343
  224   3HG2  ILE  29          3HG2      ILE  29  -2.260   3.088  -0.165
  225   1HD1  ILE  29          1HD1      ILE  29  -0.065   1.320  -3.936
  226   2HD1  ILE  29          2HD1      ILE  29   0.577   2.952  -3.744
  227   3HD1  ILE  29          3HD1      ILE  29  -1.108   2.612  -3.344
  228    H    TYR  30           H        TYR  30  -1.129   3.562   1.197
  229    HA   TYR  30           HA       TYR  30   1.467   4.732   1.044
  230   1HB   TYR  30          2HB       TYR  30  -0.724   5.560   2.944
  231   2HB   TYR  30          1HB       TYR  30   0.509   6.579   2.203
  232    HD1  TYR  30           HD1      TYR  30  -2.780   6.302   2.065
  233    HD2  TYR  30           HD2      TYR  30   0.528   5.643  -0.583
  234    HE1  TYR  30           HE1      TYR  30  -4.271   6.632   0.116
  235    HE2  TYR  30           HE2      TYR  30  -0.956   5.980  -2.532
  236    HH   TYR  30           HH       TYR  30  -4.444   6.592  -2.093
  237    H    ALA  31           H        ALA  31  -0.310   3.301   3.756
  238    HA   ALA  31           HA       ALA  31   1.905   3.636   5.605
  239   1HB   ALA  31          1HB       ALA  31   0.094   1.466   6.291
  240   2HB   ALA  31          2HB       ALA  31  -0.797   2.909   5.809
  241   3HB   ALA  31          3HB       ALA  31   0.369   2.993   7.129
  242    H    HIS  32           H        HIS  32   1.156   1.376   3.089
  243    HA   HIS  32           HA       HIS  32   2.663  -0.851   4.212
  244   1HB   HIS  32          2HB       HIS  32   0.918  -1.363   2.630
  245   2HB   HIS  32          1HB       HIS  32   1.617  -0.286   1.424
  246    HD1  HIS  32           HD1      HIS  32   1.830  -3.723   2.752
  247    HD2  HIS  32           HD2      HIS  32   4.174  -1.247   0.356
  248    HE1  HIS  32           HE1      HIS  32   3.530  -5.221   1.619
  249    H    ILE  33           H        ILE  33   3.307   0.870   1.144
  250    HA   ILE  33           HA       ILE  33   6.026   0.152   0.952
  251    HB   ILE  33           HB       ILE  33   6.234   2.209  -0.488
  252   1HG1  ILE  33          2HG1      ILE  33   3.592   2.976  -0.804
  253   2HG1  ILE  33          1HG1      ILE  33   3.756   2.810   0.947
  254   1HG2  ILE  33          1HG2      ILE  33   4.281   1.436  -2.045
  255   2HG2  ILE  33          2HG2      ILE  33   4.038   0.182  -0.828
  256   3HG2  ILE  33          3HG2      ILE  33   5.578   0.298  -1.679
  257   1HD1  ILE  33          1HD1      ILE  33   4.615   4.920   0.821
  258   2HD1  ILE  33          2HD1      ILE  33   5.016   4.759  -0.888
  259   3HD1  ILE  33          3HD1      ILE  33   6.090   4.083   0.337
  260    H    THR  34           H        THR  34   4.548   2.818   2.733
  261    HA   THR  34           HA       THR  34   6.861   4.362   3.246
  262    HB   THR  34           HB       THR  34   5.623   4.955   5.430
  263    HG1  THR  34           HG1      THR  34   3.968   3.779   5.894
  264   1HG2  THR  34          1HG2      THR  34   4.520   5.256   2.649
  265   2HG2  THR  34          2HG2      THR  34   5.340   6.453   3.648
  266   3HG2  THR  34          3HG2      THR  34   3.686   5.976   4.024
  267    H    LYS  35           H        LYS  35   5.763   1.373   4.766
  268    HA   LYS  35           HA       LYS  35   7.562   1.471   7.005
  269   1HB   LYS  35          2HB       LYS  35   5.533  -0.217   6.178
  270   2HB   LYS  35          1HB       LYS  35   6.975  -1.216   5.995
  271   1HG   LYS  35          2HG       LYS  35   6.276   0.337   8.503
  272   2HG   LYS  35          1HG       LYS  35   5.969  -1.384   8.277
  273   1HD   LYS  35          2HD       LYS  35   8.718  -0.145   8.000
  274   2HD   LYS  35          1HD       LYS  35   8.119  -0.843   9.506
  275   1HE   LYS  35          2HE       LYS  35   8.247  -2.342   6.875
  276   2HE   LYS  35          1HE       LYS  35   9.475  -2.451   8.134
  277   1HZ   LYS  35          1HZ       LYS  35   8.030  -4.232   8.516
  278   2HZ   LYS  35          2HZ       LYS  35   6.640  -3.287   8.266
  279   3HZ   LYS  35          3HZ       LYS  35   7.580  -3.068   9.665
  280    H    HIS  36           H        HIS  36   7.866   0.123   3.726
  281    HA   HIS  36           HA       HIS  36  10.647  -0.711   4.340
  282   1HB   HIS  36          2HB       HIS  36   9.094  -1.051   1.760
  283   2HB   HIS  36          1HB       HIS  36  10.586  -1.873   2.218
  284    HD1  HIS  36           HD1      HIS  36  10.420  -3.823   3.892
  285    HD2  HIS  36           HD2      HIS  36   6.749  -2.008   3.112
  286    HE1  HIS  36           HE1      HIS  36   8.648  -5.335   4.886
  287    H    TYR  37           H        TYR  37   9.145   2.072   3.357
  288    HA   TYR  37           HA       TYR  37  11.581   2.927   1.858
  289   1HB   TYR  37          2HB       TYR  37   8.722   3.104   1.110
  290   2HB   TYR  37          1HB       TYR  37   9.651   4.585   0.869
  291    HD1  TYR  37           HD1      TYR  37  10.419   0.924   0.531
  292    HD2  TYR  37           HD2      TYR  37  10.336   4.786  -1.347
  293    HE1  TYR  37           HE1      TYR  37  11.396  -0.058  -1.522
  294    HE2  TYR  37           HE2      TYR  37  11.315   3.805  -3.403
  295    HH   TYR  37           HH       TYR  37  12.490   1.948  -4.170
  296    HA   PRO  38           HA       PRO  38  11.302   5.734   5.375
  297   1HB   PRO  38          2HB       PRO  38  13.901   6.611   5.147
  298   2HB   PRO  38          1HB       PRO  38  13.437   5.111   5.969
  299   1HG   PRO  38          2HG       PRO  38  14.707   5.473   3.293
  300   2HG   PRO  38          1HG       PRO  38  14.814   4.101   4.409
  301   1HD   PRO  38          2HD       PRO  38  13.205   4.209   2.094
  302   2HD   PRO  38          1HD       PRO  38  13.047   3.028   3.412
  303    H    TYR  39           H        TYR  39  11.792   6.340   2.054
  304    HA   TYR  39           HA       TYR  39  12.005   9.269   2.392
  305   1HB   TYR  39          2HB       TYR  39  13.285   8.207   0.581
  306   2HB   TYR  39          1HB       TYR  39  11.795   7.560  -0.105
  307    HD1  TYR  39           HD1      TYR  39   9.922   9.290  -0.676
  308    HD2  TYR  39           HD2      TYR  39  14.052  10.322  -0.088
  309    HE1  TYR  39           HE1      TYR  39   9.569  11.410  -1.912
  310    HE2  TYR  39           HE2      TYR  39  13.697  12.443  -1.324
  311    HH   TYR  39           HH       TYR  39  10.692  13.717  -1.961
  312    H    TYR  40           H        TYR  40   9.608   6.818   1.660
  313    HA   TYR  40           HA       TYR  40   7.629   8.850   0.847
  314   1HB   TYR  40          2HB       TYR  40   7.894   5.936   0.646
  315   2HB   TYR  40          1HB       TYR  40   6.275   6.445   1.123
  316    HD1  TYR  40           HD1      TYR  40   7.565   5.285  -1.615
  317    HD2  TYR  40           HD2      TYR  40   6.166   9.111  -0.255
  318    HE1  TYR  40           HE1      TYR  40   7.073   5.942  -3.961
  319    HE2  TYR  40           HE2      TYR  40   5.679   9.769  -2.598
  320    HH   TYR  40           HH       TYR  40   6.405   7.572  -5.310
  321    H    ARG  41           H        ARG  41   8.792   7.678   3.754
  322    HA   ARG  41           HA       ARG  41   6.206   7.583   5.147
  323   1HB   ARG  41          2HB       ARG  41   7.520   7.127   7.144
  324   2HB   ARG  41          1HB       ARG  41   8.121   6.129   5.819
  325   1HG   ARG  41          2HG       ARG  41  10.000   7.563   5.465
  326   2HG   ARG  41          1HG       ARG  41   9.328   8.817   6.507
  327   1HD   ARG  41          2HD       ARG  41  10.040   6.047   7.500
  328   2HD   ARG  41          1HD       ARG  41  11.152   7.413   7.572
  329    HE   ARG  41           HE       ARG  41   9.138   8.516   8.886
  330   1HH1  ARG  41          1HH2      ARG  41  10.698   5.486   9.178
  331   2HH1  ARG  41          2HH2      ARG  41   9.910   5.058  10.661
  332   1HH2  ARG  41          1HH1      ARG  41   7.872   7.865  10.692
  333   2HH2  ARG  41          2HH1      ARG  41   8.309   6.406  11.518
  334    H    THR  42           H        THR  42   7.588  10.116   3.842
  335    HA   THR  42           HA       THR  42   6.378  12.030   5.558
  336    HB   THR  42           HB       THR  42   8.043  11.615   7.210
  337    HG1  THR  42           HG1      THR  42   7.750  13.867   6.331
  338   1HG2  THR  42          1HG2      THR  42  10.466  12.126   5.719
  339   2HG2  THR  42          2HG2      THR  42   9.580  10.780   5.004
  340   3HG2  THR  42          3HG2      THR  42  10.043  10.725   6.704
  341    H    ALA  43           H        ALA  43   6.353  11.729   2.835
  342    HA   ALA  43           HA       ALA  43   7.091  14.319   1.897
  343   1HB   ALA  43          1HB       ALA  43   8.977  12.061   1.186
  344   2HB   ALA  43          2HB       ALA  43   9.382  13.589   1.967
  345   3HB   ALA  43          3HB       ALA  43   8.888  13.568   0.275
  346    H    ASP  44           H        ASP  44   4.730  13.383   1.515
  347    HA   ASP  44           HA       ASP  44   4.400  11.597  -0.746
  348   1HB   ASP  44          2HB       ASP  44   2.023  12.321  -0.657
  349   2HB   ASP  44          1HB       ASP  44   2.625  11.841   0.931
  350    H    LYS  45           H        LYS  45   5.361  12.353  -2.639
  351    HA   LYS  45           HA       LYS  45   5.354  15.145  -3.390
  352   1HB   LYS  45          2HB       LYS  45   6.332  12.606  -4.504
  353   2HB   LYS  45          1HB       LYS  45   5.798  13.757  -5.730
  354   1HG   LYS  45          2HG       LYS  45   7.498  14.775  -3.490
  355   2HG   LYS  45          1HG       LYS  45   8.277  13.836  -4.765
  356   1HD   LYS  45          2HD       LYS  45   7.593  15.366  -6.454
  357   2HD   LYS  45          1HD       LYS  45   6.440  16.156  -5.378
  358   1HE   LYS  45          2HE       LYS  45   9.449  16.174  -5.008
  359   2HE   LYS  45          1HE       LYS  45   8.505  17.506  -5.673
  360   1HZ   LYS  45          1HZ       LYS  45   8.519  18.124  -3.511
  361   2HZ   LYS  45          2HZ       LYS  45   8.683  16.537  -2.927
  362   3HZ   LYS  45          3HZ       LYS  45   7.167  17.103  -3.447
  363    H    GLY  46           H        GLY  46   3.915  12.458  -5.265
  364   1HA   GLY  46          2HA       GLY  46   1.306  13.784  -5.340
  365   2HA   GLY  46          1HA       GLY  46   2.187  13.862  -6.871
  366    H    TRP  47           H        TRP  47   2.136  11.234  -4.482
  367    HA   TRP  47           HA       TRP  47   1.022   9.461  -6.614
  368   1HB   TRP  47          2HB       TRP  47   2.300   7.649  -5.679
  369   2HB   TRP  47          1HB       TRP  47   3.400   9.011  -5.883
  370    HD1  TRP  47           HD1      TRP  47   3.511  10.647  -3.531
  371    HE1  TRP  47           HE1      TRP  47   3.872   9.813  -1.130
  372    HE3  TRP  47           HE3      TRP  47   1.993   5.784  -4.043
  373    HZ2  TRP  47           HZ2      TRP  47   3.581   7.418   0.376
  374    HZ3  TRP  47           HZ3      TRP  47   2.061   4.256  -2.092
  375    HH2  TRP  47           HH2      TRP  47   2.857   5.068   0.104
  376    H    GLN  48           H        GLN  48   0.443  10.861  -3.598
  377    HA   GLN  48           HA       GLN  48  -0.929   8.824  -2.190
  378   1HB   GLN  48          2HB       GLN  48  -1.752  11.739  -2.297
  379   2HB   GLN  48          1HB       GLN  48  -2.042  10.597  -0.994
  380   1HG   GLN  48          2HG       GLN  48   0.729  11.407  -1.899
  381   2HG   GLN  48          1HG       GLN  48  -0.127  12.178  -0.565
  382   1HE2  GLN  48          1HE2      GLN  48   0.900   8.900  -1.666
  383   2HE2  GLN  48          2HE2      GLN  48   1.153   8.295  -0.100
  384    H    ASN  49           H        ASN  49  -2.540  11.419  -4.060
  385    HA   ASN  49           HA       ASN  49  -4.946   9.833  -4.391
  386   1HB   ASN  49          2HB       ASN  49  -4.064  12.535  -4.985
  387   2HB   ASN  49          1HB       ASN  49  -4.936  11.845  -6.354
  388   1HD2  ASN  49          1HD2      ASN  49  -7.077  12.536  -6.195
  389   2HD2  ASN  49          2HD2      ASN  49  -7.997  12.522  -4.768
  390    H    SER  50           H        SER  50  -2.007  10.327  -6.235
  391    HA   SER  50           HA       SER  50  -2.897   9.410  -8.778
  392   1HB   SER  50          2HB       SER  50  -0.560  10.377  -7.929
  393   2HB   SER  50          1HB       SER  50  -0.164   8.664  -7.825
  394    HG   SER  50           HG       SER  50  -0.703  10.262 -10.037
  395    H    ILE  51           H        ILE  51  -2.199   7.685  -5.825
  396    HA   ILE  51           HA       ILE  51  -1.854   5.078  -7.007
  397    HB   ILE  51           HB       ILE  51  -2.090   6.246  -4.319
  398   1HG1  ILE  51          2HG1      ILE  51  -0.295   4.813  -3.862
  399   2HG1  ILE  51          1HG1      ILE  51  -0.818   3.630  -5.044
  400   1HG2  ILE  51          1HG2      ILE  51  -4.068   4.837  -4.124
  401   2HG2  ILE  51          2HG2      ILE  51  -2.742   4.096  -3.233
  402   3HG2  ILE  51          3HG2      ILE  51  -3.199   3.467  -4.815
  403   1HD1  ILE  51          1HD1      ILE  51  -0.021   6.376  -5.957
  404   2HD1  ILE  51          2HD1      ILE  51   0.007   4.857  -6.853
  405   3HD1  ILE  51          3HD1      ILE  51   1.220   5.171  -5.612
  406    H    ARG  52           H        ARG  52  -4.655   6.443  -5.218
  407    HA   ARG  52           HA       ARG  52  -6.505   4.425  -5.834
  408   1HB   ARG  52          2HB       ARG  52  -6.975   6.293  -4.280
  409   2HB   ARG  52          1HB       ARG  52  -7.042   7.407  -5.646
  410   1HG   ARG  52          2HG       ARG  52  -8.846   5.817  -6.601
  411   2HG   ARG  52          1HG       ARG  52  -8.935   5.160  -4.965
  412   1HD   ARG  52          2HD       ARG  52 -10.016   6.986  -4.171
  413   2HD   ARG  52          1HD       ARG  52  -8.959   8.095  -5.044
  414    HE   ARG  52           HE       ARG  52 -11.152   6.660  -6.475
  415   1HH1  ARG  52          1HH2      ARG  52 -11.054   9.432  -4.770
  416   2HH1  ARG  52          2HH2      ARG  52 -11.263  10.523  -6.100
  417   1HH2  ARG  52          1HH1      ARG  52 -10.747   8.092  -8.519
  418   2HH2  ARG  52          2HH1      ARG  52 -11.089   9.764  -8.222
  419    H    HIS  53           H        HIS  53  -5.648   7.307  -7.742
  420    HA   HIS  53           HA       HIS  53  -7.509   6.762  -9.877
  421   1HB   HIS  53          2HB       HIS  53  -6.412   8.985  -9.431
  422   2HB   HIS  53          1HB       HIS  53  -4.900   8.301 -10.026
  423    HD1  HIS  53           HD1      HIS  53  -4.528   8.994 -12.383
  424    HD2  HIS  53           HD2      HIS  53  -8.566   8.283 -11.627
  425    HE1  HIS  53           HE1      HIS  53  -5.743   9.362 -14.575
  426    H    ASN  54           H        ASN  54  -4.266   5.683  -9.132
  427    HA   ASN  54           HA       ASN  54  -3.646   4.645 -11.755
  428   1HB   ASN  54          2HB       ASN  54  -2.443   4.585  -9.069
  429   2HB   ASN  54          1HB       ASN  54  -2.154   3.119 -10.013
  430   1HD2  ASN  54          1HD2      ASN  54  -0.790   6.082  -9.399
  431   2HD2  ASN  54          2HD2      ASN  54   0.024   6.331 -10.868
  432    H    LEU  55           H        LEU  55  -5.368   3.404  -8.959
  433    HA   LEU  55           HA       LEU  55  -5.335   0.640  -9.811
  434   1HB   LEU  55          2HB       LEU  55  -7.495   1.885  -8.118
  435   2HB   LEU  55          1HB       LEU  55  -6.839   0.250  -8.035
  436    HG   LEU  55           HG       LEU  55  -5.498   2.821  -7.187
  437   1HD1  LEU  55          1HD1      LEU  55  -6.283   0.255  -5.784
  438   2HD1  LEU  55          2HD1      LEU  55  -6.934   1.869  -5.498
  439   3HD1  LEU  55          3HD1      LEU  55  -5.268   1.499  -5.052
  440   1HD2  LEU  55          1HD2      LEU  55  -3.941   1.344  -8.481
  441   2HD2  LEU  55          2HD2      LEU  55  -4.286   0.046  -7.338
  442   3HD2  LEU  55          3HD2      LEU  55  -3.483   1.516  -6.788
  443    H    SER  56           H        SER  56  -6.878   3.377 -11.040
  444    HA   SER  56           HA       SER  56  -9.260   1.926 -12.011
  445   1HB   SER  56          2HB       SER  56  -8.615   4.646 -11.502
  446   2HB   SER  56          1HB       SER  56  -8.930   4.506 -13.230
  447    HG   SER  56           HG       SER  56 -10.796   3.112 -12.298
  448    H    LEU  57           H        LEU  57  -6.419   3.589 -13.420
  449    HA   LEU  57           HA       LEU  57  -7.068   2.513 -16.079
  450   1HB   LEU  57          2HB       LEU  57  -4.473   3.871 -15.412
  451   2HB   LEU  57          1HB       LEU  57  -5.417   3.943 -16.900
  452    HG   LEU  57           HG       LEU  57  -7.179   4.961 -15.039
  453   1HD1  LEU  57          1HD1      LEU  57  -4.990   4.922 -13.548
  454   2HD1  LEU  57          2HD1      LEU  57  -6.083   6.305 -13.492
  455   3HD1  LEU  57          3HD1      LEU  57  -4.608   6.386 -14.453
  456   1HD2  LEU  57          1HD2      LEU  57  -5.662   7.131 -16.099
  457   2HD2  LEU  57          2HD2      LEU  57  -7.187   6.482 -16.701
  458   3HD2  LEU  57          3HD2      LEU  57  -5.660   5.844 -17.308
  459    H    ASN  58           H        ASN  58  -5.264   1.484 -13.348
  460    HA   ASN  58           HA       ASN  58  -3.176   0.042 -14.691
  461   1HB   ASN  58          2HB       ASN  58  -4.440  -0.145 -11.969
  462   2HB   ASN  58          1HB       ASN  58  -3.365  -1.427 -12.520
  463   1HD2  ASN  58          1HD2      ASN  58  -3.051   2.034 -13.357
  464   2HD2  ASN  58          2HD2      ASN  58  -1.560   2.252 -12.576
  465    H    ARG  59           H        ARG  59  -3.077  -2.283 -15.067
  466    HA   ARG  59           HA       ARG  59  -5.666  -3.311 -16.045
  467   1HB   ARG  59          2HB       ARG  59  -3.052  -4.781 -16.269
  468   2HB   ARG  59          1HB       ARG  59  -4.425  -4.781 -17.377
  469   1HG   ARG  59          2HG       ARG  59  -3.732  -2.127 -17.358
  470   2HG   ARG  59          1HG       ARG  59  -2.158  -2.908 -17.202
  471   1HD   ARG  59          2HD       ARG  59  -2.197  -3.415 -19.394
  472   2HD   ARG  59          1HD       ARG  59  -3.662  -4.365 -19.143
  473    HE   ARG  59           HE       ARG  59  -3.681  -1.444 -19.795
  474   1HH1  ARG  59          1HH2      ARG  59  -4.218  -3.256 -22.050
  475   2HH1  ARG  59          2HH2      ARG  59  -5.943  -3.420 -22.020
  476   1HH2  ARG  59          1HH1      ARG  59  -6.264  -2.232 -18.778
  477   2HH2  ARG  59          2HH1      ARG  59  -7.100  -2.841 -20.167
  478    H    TYR  60           H        TYR  60  -3.413  -3.898 -13.422
  479    HA   TYR  60           HA       TYR  60  -5.065  -6.279 -12.683
  480   1HB   TYR  60          2HB       TYR  60  -2.904  -6.591 -11.111
  481   2HB   TYR  60          1HB       TYR  60  -3.022  -7.287 -12.723
  482    HD1  TYR  60           HD1      TYR  60  -0.979  -5.374 -10.602
  483    HD2  TYR  60           HD2      TYR  60  -2.332  -5.566 -14.671
  484    HE1  TYR  60           HE1      TYR  60   1.017  -4.096 -11.334
  485    HE2  TYR  60           HE2      TYR  60  -0.343  -4.282 -15.403
  486    HH   TYR  60           HH       TYR  60   2.268  -3.527 -13.170
  487    H    PHE  61           H        PHE  61  -6.039  -3.766 -12.005
  488    HA   PHE  61           HA       PHE  61  -5.907  -3.984  -9.064
  489   1HB   PHE  61          2HB       PHE  61  -5.161  -1.506 -10.614
  490   2HB   PHE  61          1HB       PHE  61  -5.724  -1.430  -8.939
  491    HD1  PHE  61           HD1      PHE  61  -3.034  -2.572 -11.170
  492    HD2  PHE  61           HD2      PHE  61  -4.423  -2.442  -7.114
  493    HE1  PHE  61           HE1      PHE  61  -0.808  -3.247 -10.392
  494    HE2  PHE  61           HE2      PHE  61  -2.195  -3.138  -6.342
  495    HZ   PHE  61           HZ       PHE  61  -0.380  -3.542  -7.969
  496    H    ILE  62           H        ILE  62  -7.987  -4.627  -8.983
  497    HA   ILE  62           HA       ILE  62 -10.057  -2.866 -10.228
  498    HB   ILE  62           HB       ILE  62 -11.567  -4.772 -10.027
  499   1HG1  ILE  62          2HG1      ILE  62  -9.222  -6.095  -8.624
  500   2HG1  ILE  62          1HG1      ILE  62 -10.765  -5.652  -7.889
  501   1HG2  ILE  62          1HG2      ILE  62  -9.648  -6.495 -11.099
  502   2HG2  ILE  62          2HG2      ILE  62  -9.018  -4.885 -11.442
  503   3HG2  ILE  62          3HG2      ILE  62 -10.627  -5.340 -12.002
  504   1HD1  ILE  62          1HD1      ILE  62 -10.338  -7.687 -10.095
  505   2HD1  ILE  62          2HD1      ILE  62 -11.917  -7.183  -9.494
  506   3HD1  ILE  62          3HD1      ILE  62 -10.796  -8.029  -8.428
  507    H    LYS  63           H        LYS  63 -12.030  -2.485  -8.894
  508    HA   LYS  63           HA       LYS  63 -11.390  -2.463  -5.971
  509   1HB   LYS  63          2HB       LYS  63 -11.433  -0.206  -7.332
  510   2HB   LYS  63          1HB       LYS  63 -13.183  -0.399  -7.216
  511   1HG   LYS  63          2HG       LYS  63 -12.299  -0.967  -4.642
  512   2HG   LYS  63          1HG       LYS  63 -11.264   0.369  -5.149
  513   1HD   LYS  63          2HD       LYS  63 -13.941   0.915  -6.016
  514   2HD   LYS  63          1HD       LYS  63 -13.981   0.492  -4.304
  515   1HE   LYS  63          2HE       LYS  63 -13.264   2.578  -3.848
  516   2HE   LYS  63          1HE       LYS  63 -11.728   2.150  -4.604
  517   1HZ   LYS  63          1HZ       LYS  63 -12.255   3.794  -6.009
  518   2HZ   LYS  63          2HZ       LYS  63 -13.909   3.751  -5.625
  519   3HZ   LYS  63          3HZ       LYS  63 -13.263   2.643  -6.739
  520    H    VAL  64           H        VAL  64 -13.025  -3.196  -4.624
  521    HA   VAL  64           HA       VAL  64 -15.154  -4.735  -5.790
  522    HB   VAL  64           HB       VAL  64 -15.931  -5.012  -3.459
  523   1HG1  VAL  64          1HG1      VAL  64 -14.014  -6.184  -2.675
  524   2HG1  VAL  64          2HG1      VAL  64 -12.910  -5.083  -3.499
  525   3HG1  VAL  64          3HG1      VAL  64 -13.884  -6.218  -4.434
  526   1HG2  VAL  64          1HG2      VAL  64 -14.396  -2.539  -3.157
  527   2HG2  VAL  64          2HG2      VAL  64 -13.975  -3.745  -1.941
  528   3HG2  VAL  64          3HG2      VAL  64 -15.648  -3.214  -2.113
  529    HA   PRO  65           HA       PRO  65 -17.923  -1.274  -6.312
  530   1HB   PRO  65          2HB       PRO  65 -19.953  -2.740  -7.444
  531   2HB   PRO  65          1HB       PRO  65 -18.514  -2.213  -8.335
  532   1HG   PRO  65          2HG       PRO  65 -19.206  -4.934  -7.331
  533   2HG   PRO  65          1HG       PRO  65 -18.171  -4.470  -8.692
  534   1HD   PRO  65          2HD       PRO  65 -17.284  -5.300  -6.131
  535   2HD   PRO  65          1HD       PRO  65 -16.286  -4.543  -7.391
  536    H    ARG  66           H        ARG  66 -20.083  -4.029  -5.847
  537    HA   ARG  66           HA       ARG  66 -20.733  -3.102  -3.099
  538   1HB   ARG  66          2HB       ARG  66 -22.461  -2.899  -5.490
  539   2HB   ARG  66          1HB       ARG  66 -23.233  -3.614  -4.075
  540   1HG   ARG  66          2HG       ARG  66 -23.029  -1.683  -2.815
  541   2HG   ARG  66          1HG       ARG  66 -21.596  -1.140  -3.689
  542   1HD   ARG  66          2HD       ARG  66 -24.356  -1.248  -4.931
  543   2HD   ARG  66          1HD       ARG  66 -23.692   0.197  -4.170
  544    HE   ARG  66           HE       ARG  66 -22.502  -1.109  -6.584
  545   1HH1  ARG  66          1HH2      ARG  66 -20.741   0.752  -4.984
  546   2HH1  ARG  66          2HH2      ARG  66 -20.995   2.260  -5.800
  547   1HH2  ARG  66          1HH1      ARG  66 -23.857   1.194  -7.442
  548   2HH2  ARG  66          2HH1      ARG  66 -22.761   2.511  -7.193
  549    H    SER  67           H        SER  67 -19.391  -5.483  -4.222
  550    HA   SER  67           HA       SER  67 -21.351  -7.661  -3.908
  551   1HB   SER  67          2HB       SER  67 -19.151  -7.494  -5.439
  552   2HB   SER  67          1HB       SER  67 -18.422  -8.208  -4.004
  553    HG   SER  67           HG       SER  67 -19.813  -9.418  -5.875
  554    H    GLN  68           H        GLN  68 -21.044  -6.021  -1.593
  555    HA   GLN  68           HA       GLN  68 -19.839  -8.020   0.273
  556   1HB   GLN  68          2HB       GLN  68 -18.823  -5.478  -0.161
  557   2HB   GLN  68          1HB       GLN  68 -19.846  -5.254   1.258
  558   1HG   GLN  68          2HG       GLN  68 -17.796  -5.908   2.197
  559   2HG   GLN  68          1HG       GLN  68 -18.695  -7.425   2.134
  560   1HE2  GLN  68          1HE2      GLN  68 -15.986  -7.761   2.178
  561   2HE2  GLN  68          2HE2      GLN  68 -15.386  -8.162   0.641
  562    H    GLU  69           H        GLU  69 -20.814  -7.807   2.514
  563    HA   GLU  69           HA       GLU  69 -23.643  -6.847   2.330
  564   1HB   GLU  69          2HB       GLU  69 -24.286  -8.739   3.768
  565   2HB   GLU  69          1HB       GLU  69 -23.511  -9.320   2.293
  566   1HG   GLU  69          2HG       GLU  69 -21.320  -9.114   3.804
  567   2HG   GLU  69          1HG       GLU  69 -22.495  -9.337   5.100
  568    H    GLU  70           H        GLU  70 -23.098  -4.864   3.380
  569    HA   GLU  70           HA       GLU  70 -22.832  -5.129   6.306
  570   1HB   GLU  70          2HB       GLU  70 -21.035  -3.243   6.186
  571   2HB   GLU  70          1HB       GLU  70 -20.529  -4.906   5.885
  572   1HG   GLU  70          2HG       GLU  70 -20.430  -4.581   3.549
  573   2HG   GLU  70          1HG       GLU  70 -21.409  -3.115   3.624
  574    HA   PRO  71           HA       PRO  71 -25.576  -1.706   6.093
  575   1HB   PRO  71          2HB       PRO  71 -25.279  -0.794   8.669
  576   2HB   PRO  71          1HB       PRO  71 -26.193  -2.252   8.246
  577   1HG   PRO  71          2HG       PRO  71 -23.496  -2.028   9.500
  578   2HG   PRO  71          1HG       PRO  71 -24.690  -3.328   9.633
  579   1HD   PRO  71          2HD       PRO  71 -22.375  -3.370   8.007
  580   2HD   PRO  71          1HD       PRO  71 -23.745  -4.495   7.899
  581    H    GLY  72           H        GLY  72 -22.715  -0.789   8.066
  582   1HA   GLY  72          2HA       GLY  72 -22.772   1.962   7.283
  583   2HA   GLY  72          1HA       GLY  72 -21.377   1.139   7.986
  584    H    LYS  73           H        LYS  73 -20.646   2.883   6.139
  585    HA   LYS  73           HA       LYS  73 -20.704   1.805   3.430
  586   1HB   LYS  73          2HB       LYS  73 -19.492   4.167   4.794
  587   2HB   LYS  73          1HB       LYS  73 -18.751   3.633   3.285
  588   1HG   LYS  73          2HG       LYS  73 -21.300   3.538   2.500
  589   2HG   LYS  73          1HG       LYS  73 -21.476   4.754   3.766
  590   1HD   LYS  73          2HD       LYS  73 -19.786   6.155   2.739
  591   2HD   LYS  73          1HD       LYS  73 -19.415   4.906   1.551
  592   1HE   LYS  73          2HE       LYS  73 -22.173   5.262   1.320
  593   2HE   LYS  73          1HE       LYS  73 -21.543   6.897   1.525
  594   1HZ   LYS  73          1HZ       LYS  73 -20.575   4.906  -0.455
  595   2HZ   LYS  73          2HZ       LYS  73 -19.969   6.481  -0.256
  596   3HZ   LYS  73          3HZ       LYS  73 -21.561   6.242  -0.800
  597    H    GLY  74           H        GLY  74 -18.451   1.538   2.300
  598   1HA   GLY  74          2HA       GLY  74 -16.196   0.678   3.853
  599   2HA   GLY  74          1HA       GLY  74 -17.147  -0.725   3.368
  600    H    SER  75           H        SER  75 -14.634  -0.616   2.384
  601    HA   SER  75           HA       SER  75 -15.004  -0.693  -0.448
  602   1HB   SER  75          2HB       SER  75 -13.071   1.336  -0.440
  603   2HB   SER  75          1HB       SER  75 -14.738   1.491  -0.985
  604    HG   SER  75           HG       SER  75 -15.299   2.325   0.934
  605    H    PHE  76           H        PHE  76 -13.158  -1.642  -1.452
  606    HA   PHE  76           HA       PHE  76 -10.684  -1.892   0.147
  607   1HB   PHE  76          2HB       PHE  76 -12.676  -3.917   0.173
  608   2HB   PHE  76          1HB       PHE  76 -11.346  -4.518  -0.817
  609    HD1  PHE  76           HD1      PHE  76 -12.426  -5.074   2.222
  610    HD2  PHE  76           HD2      PHE  76  -9.033  -3.137   0.434
  611    HE1  PHE  76           HE1      PHE  76 -11.095  -5.515   4.268
  612    HE2  PHE  76           HE2      PHE  76  -7.703  -3.578   2.481
  613    HZ   PHE  76           HZ       PHE  76  -8.734  -4.766   4.397
  614    H    TRP  77           H        TRP  77  -9.117  -1.420  -1.290
  615    HA   TRP  77           HA       TRP  77  -9.532  -1.826  -4.174
  616   1HB   TRP  77          2HB       TRP  77  -7.652  -0.356  -2.438
  617   2HB   TRP  77          1HB       TRP  77  -6.914  -1.054  -3.879
  618    HD1  TRP  77           HD1      TRP  77  -8.629   1.948  -2.796
  619    HE1  TRP  77           HE1      TRP  77  -9.570   3.269  -4.802
  620    HE3  TRP  77           HE3      TRP  77  -8.264  -1.608  -6.436
  621    HZ2  TRP  77           HZ2      TRP  77 -10.092   2.866  -7.586
  622    HZ3  TRP  77           HZ3      TRP  77  -8.986  -1.116  -8.754
  623    HH2  TRP  77           HH2      TRP  77  -9.890   1.114  -9.329
  624    H    ARG  78           H        ARG  78  -8.651  -3.535  -5.340
  625    HA   ARG  78           HA       ARG  78  -6.535  -5.174  -4.051
  626   1HB   ARG  78          2HB       ARG  78  -7.879  -7.243  -4.806
  627   2HB   ARG  78          1HB       ARG  78  -8.431  -6.402  -3.359
  628   1HG   ARG  78          2HG       ARG  78 -10.132  -5.220  -4.628
  629   2HG   ARG  78          1HG       ARG  78  -9.528  -5.903  -6.138
  630   1HD   ARG  78          2HD       ARG  78  -9.965  -8.206  -5.024
  631   2HD   ARG  78          1HD       ARG  78 -10.962  -7.301  -3.885
  632    HE   ARG  78           HE       ARG  78 -11.928  -6.440  -6.296
  633   1HH1  ARG  78          1HH1      ARG  78 -11.364  -9.495  -4.796
  634   2HH1  ARG  78          2HH1      ARG  78 -12.512 -10.338  -5.779
  635   1HH2  ARG  78          1HH2      ARG  78 -13.358  -7.548  -7.656
  636   2HH2  ARG  78          2HH2      ARG  78 -13.641  -9.237  -7.396
  637    H    ILE  79           H        ILE  79  -5.795  -6.937  -5.670
  638    HA   ILE  79           HA       ILE  79  -5.712  -5.697  -8.394
  639    HB   ILE  79           HB       ILE  79  -3.563  -6.701  -8.709
  640   1HG1  ILE  79          2HG1      ILE  79  -4.339  -8.281  -6.255
  641   2HG1  ILE  79          1HG1      ILE  79  -3.737  -8.875  -7.802
  642   1HG2  ILE  79          1HG2      ILE  79  -2.339  -5.469  -7.164
  643   2HG2  ILE  79          2HG2      ILE  79  -3.440  -5.862  -5.840
  644   3HG2  ILE  79          3HG2      ILE  79  -3.927  -4.712  -7.070
  645   1HD1  ILE  79          1HD1      ILE  79  -2.241  -8.127  -5.430
  646   2HD1  ILE  79          2HD1      ILE  79  -1.704  -7.186  -6.821
  647   3HD1  ILE  79          3HD1      ILE  79  -1.676  -8.943  -6.885
  648    H    ASP  80           H        ASP  80  -5.197  -7.527 -10.111
  649    HA   ASP  80           HA       ASP  80  -7.500  -9.181 -10.291
  650   1HB   ASP  80          2HB       ASP  80  -4.862  -9.087 -11.710
  651   2HB   ASP  80          1HB       ASP  80  -5.923 -10.469 -11.977
  652    HA   PRO  81           HA       PRO  81  -6.495 -12.725  -7.942
  653   1HB   PRO  81          2HB       PRO  81  -7.623 -14.715  -9.467
  654   2HB   PRO  81          1HB       PRO  81  -8.558 -13.563  -8.499
  655   1HG   PRO  81          2HG       PRO  81  -8.177 -13.654 -11.456
  656   2HG   PRO  81          1HG       PRO  81  -9.522 -12.985 -10.518
  657   1HD   PRO  81          2HD       PRO  81  -7.438 -11.495 -11.718
  658   2HD   PRO  81          1HD       PRO  81  -8.592 -10.888 -10.511
  659    H    ALA  82           H        ALA  82  -6.214 -14.054 -11.260
  660    HA   ALA  82           HA       ALA  82  -3.737 -15.428 -10.456
  661   1HB   ALA  82          1HB       ALA  82  -5.248 -15.440 -13.082
  662   2HB   ALA  82          2HB       ALA  82  -5.430 -16.619 -11.783
  663   3HB   ALA  82          3HB       ALA  82  -3.908 -16.507 -12.666
  664    H    SER  83           H        SER  83  -3.970 -12.379 -11.055
  665    HA   SER  83           HA       SER  83  -1.835 -12.267 -13.139
  666   1HB   SER  83          2HB       SER  83  -3.151  -9.818 -12.019
  667   2HB   SER  83          1HB       SER  83  -2.481 -10.083 -13.625
  668    HG   SER  83           HG       SER  83  -4.519 -10.400 -14.096
  669    H    GLU  84           H        GLU  84  -2.256 -12.320  -9.820
  670    HA   GLU  84           HA       GLU  84  -0.484 -10.315  -8.894
  671   1HB   GLU  84          2HB       GLU  84  -1.242 -13.034  -7.812
  672   2HB   GLU  84          1HB       GLU  84  -0.116 -11.981  -6.957
  673   1HG   GLU  84          2HG       GLU  84  -1.785 -10.659  -6.215
  674   2HG   GLU  84          1HG       GLU  84  -2.499 -10.541  -7.823
  675    H    ALA  85           H        ALA  85   0.340 -13.801  -9.206
  676    HA   ALA  85           HA       ALA  85   3.058 -13.694  -8.851
  677   1HB   ALA  85          1HB       ALA  85   3.213 -15.714  -9.989
  678   2HB   ALA  85          2HB       ALA  85   2.097 -15.205 -11.256
  679   3HB   ALA  85          3HB       ALA  85   1.479 -15.656  -9.666
  680    H    LYS  86           H        LYS  86   1.316 -12.368 -11.592
  681    HA   LYS  86           HA       LYS  86   3.749 -11.961 -13.167
  682   1HB   LYS  86          2HB       LYS  86   1.200 -12.163 -13.928
  683   2HB   LYS  86          1HB       LYS  86   1.250 -10.413 -13.710
  684   1HG   LYS  86          2HG       LYS  86   3.612 -10.918 -15.055
  685   2HG   LYS  86          1HG       LYS  86   2.494 -12.069 -15.790
  686   1HD   LYS  86          2HD       LYS  86   2.336 -10.012 -17.042
  687   2HD   LYS  86          1HD       LYS  86   0.862 -10.162 -16.083
  688   1HE   LYS  86          2HE       LYS  86   1.302  -8.185 -15.109
  689   2HE   LYS  86          1HE       LYS  86   2.806  -8.847 -14.466
  690   1HZ   LYS  86          1HZ       LYS  86   3.150  -8.310 -17.197
  691   2HZ   LYS  86          2HZ       LYS  86   3.934  -7.592 -15.872
  692   3HZ   LYS  86          3HZ       LYS  86   2.487  -6.929 -16.468
  693    H    LEU  87           H        LEU  87   1.399  -9.644 -11.734
  694    HA   LEU  87           HA       LEU  87   3.039  -7.377 -12.012
  695   1HB   LEU  87          2HB       LEU  87   1.744  -6.659  -9.786
  696   2HB   LEU  87          1HB       LEU  87   0.952  -6.700 -11.347
  697    HG   LEU  87           HG       LEU  87   0.853  -9.316 -10.091
  698   1HD1  LEU  87          1HD1      LEU  87  -0.995  -8.224  -8.465
  699   2HD1  LEU  87          2HD1      LEU  87   0.199  -6.929  -8.452
  700   3HD1  LEU  87          3HD1      LEU  87   0.654  -8.554  -7.938
  701   1HD2  LEU  87          1HD2      LEU  87  -0.616  -8.541 -11.923
  702   2HD2  LEU  87          2HD2      LEU  87  -1.262  -7.290 -10.863
  703   3HD2  LEU  87          3HD2      LEU  87  -1.566  -8.987 -10.505
  704    H    VAL  88           H        VAL  88   2.539  -9.135  -8.977
  705    HA   VAL  88           HA       VAL  88   4.434  -7.974  -7.378
  706    HB   VAL  88           HB       VAL  88   4.778 -10.240  -6.412
  707   1HG1  VAL  88          1HG1      VAL  88   2.565 -10.383  -5.531
  708   2HG1  VAL  88          2HG1      VAL  88   1.865  -9.744  -7.019
  709   3HG1  VAL  88          3HG1      VAL  88   2.781  -8.683  -5.949
  710   1HG2  VAL  88          1HG2      VAL  88   3.823 -10.944  -9.030
  711   2HG2  VAL  88          2HG2      VAL  88   2.771 -11.649  -7.803
  712   3HG2  VAL  88          3HG2      VAL  88   4.501 -11.997  -7.789
  713    H    GLU  89           H        GLU  89   5.069 -10.043 -10.129
  714    HA   GLU  89           HA       GLU  89   7.697 -10.877  -9.583
  715   1HB   GLU  89          2HB       GLU  89   6.049 -11.071 -11.751
  716   2HB   GLU  89          1HB       GLU  89   7.243  -9.916 -12.348
  717   1HG   GLU  89          2HG       GLU  89   8.728 -11.891 -11.002
  718   2HG   GLU  89          1HG       GLU  89   7.518 -12.771 -11.936
  719    H    GLN  90           H        GLN  90   6.675  -7.855 -11.211
  720    HA   GLN  90           HA       GLN  90   9.411  -6.795 -10.983
  721   1HB   GLN  90          2HB       GLN  90   6.828  -5.807 -12.178
  722   2HB   GLN  90          1HB       GLN  90   8.160  -4.683 -11.899
  723   1HG   GLN  90          2HG       GLN  90   8.697  -7.288 -13.294
  724   2HG   GLN  90          1HG       GLN  90   7.993  -5.947 -14.200
  725   1HE2  GLN  90          1HE2      GLN  90  10.357  -6.384 -15.226
  726   2HE2  GLN  90          2HE2      GLN  90  11.582  -5.388 -14.602
  727    H    ALA  91           H        ALA  91   6.789  -7.097  -8.931
  728    HA   ALA  91           HA       ALA  91   6.873  -4.518  -7.631
  729   1HB   ALA  91          1HB       ALA  91   5.879  -7.133  -6.505
  730   2HB   ALA  91          2HB       ALA  91   4.917  -6.052  -7.513
  731   3HB   ALA  91          3HB       ALA  91   5.478  -5.515  -5.930
  732    H    PHE  92           H        PHE  92   8.478  -7.620  -7.072
  733    HA   PHE  92           HA       PHE  92   9.772  -6.586  -4.637
  734   1HB   PHE  92          2HB       PHE  92  10.266  -9.181  -6.123
  735   2HB   PHE  92          1HB       PHE  92  10.801  -8.789  -4.489
  736    HD1  PHE  92           HD1      PHE  92   8.276  -7.283  -3.633
  737    HD2  PHE  92           HD2      PHE  92   8.861 -11.058  -5.599
  738    HE1  PHE  92           HE1      PHE  92   6.112  -8.090  -2.728
  739    HE2  PHE  92           HE2      PHE  92   6.697 -11.864  -4.695
  740    HZ   PHE  92           HZ       PHE  92   5.323 -10.380  -3.260
  741    H    ARG  93           H        ARG  93  10.292  -6.141  -7.879
  742    HA   ARG  93           HA       ARG  93  13.259  -6.052  -7.539
  743   1HB   ARG  93          2HB       ARG  93  11.529  -6.838  -9.736
  744   2HB   ARG  93          1HB       ARG  93  12.648  -5.569 -10.236
  745   1HG   ARG  93          2HG       ARG  93  14.205  -7.190 -10.447
  746   2HG   ARG  93          1HG       ARG  93  14.219  -7.270  -8.684
  747   1HD   ARG  93          2HD       ARG  93  11.948  -8.725  -9.717
  748   2HD   ARG  93          1HD       ARG  93  13.431  -9.307 -10.474
  749    HE   ARG  93           HE       ARG  93  12.736  -9.545  -7.627
  750   1HH1  ARG  93          1HH1      ARG  93  14.038 -11.584  -9.552
  751   2HH1  ARG  93          2HH1      ARG  93  15.628 -11.680  -8.874
  752   1HH2  ARG  93          1HH2      ARG  93  15.277  -8.809  -6.964
  753   2HH2  ARG  93          2HH2      ARG  93  16.330 -10.111  -7.409
  754    H    LYS  94           H        LYS  94  13.902  -4.222  -9.503
  755    HA   LYS  94           HA       LYS  94  12.735  -1.722  -8.363
  756   1HB   LYS  94          2HB       LYS  94  15.433  -2.551  -9.148
  757   2HB   LYS  94          1HB       LYS  94  14.971  -0.994  -9.837
  758   1HG   LYS  94          2HG       LYS  94  14.050  -0.686  -7.301
  759   2HG   LYS  94          1HG       LYS  94  15.430  -1.744  -7.006
  760   1HD   LYS  94          2HD       LYS  94  16.825   0.001  -7.251
  761   2HD   LYS  94          1HD       LYS  94  16.239   0.237  -8.898
  762   1HE   LYS  94          2HE       LYS  94  14.442   1.663  -8.120
  763   2HE   LYS  94          1HE       LYS  94  14.838   1.315  -6.436
  764   1HZ   LYS  94          1HZ       LYS  94  16.411   2.863  -8.406
  765   2HZ   LYS  94          2HZ       LYS  94  17.109   2.250  -6.982
  766   3HZ   LYS  94          3HZ       LYS  94  15.831   3.366  -6.892
  767    H    ARG  95           H        ARG  95  10.951  -1.419  -9.732
  768    HA   ARG  95           HA       ARG  95  11.074  -1.759 -12.595
  769   1HB   ARG  95          2HB       ARG  95   8.932  -1.811 -11.405
  770   2HB   ARG  95          1HB       ARG  95   9.164  -0.145 -10.876
  771   1HG   ARG  95          2HG       ARG  95   7.703  -0.101 -12.801
  772   2HG   ARG  95          1HG       ARG  95   9.272   0.525 -13.307
  773   1HD   ARG  95          2HD       ARG  95   9.643  -1.217 -14.714
  774   2HD   ARG  95          1HD       ARG  95   9.023  -2.396 -13.559
  775    HE   ARG  95           HE       ARG  95   7.339  -0.823 -15.456
  776   1HH1  ARG  95          1HH2      ARG  95   8.151  -3.866 -14.327
  777   2HH1  ARG  95          2HH2      ARG  95   6.525  -4.443 -14.174
  778   1HH2  ARG  95          1HH1      ARG  95   5.087  -1.346 -14.772
  779   2HH2  ARG  95          2HH1      ARG  95   4.790  -3.017 -14.426
  780    H    ARG  96           H        ARG  96  12.521  -0.528 -13.741
  781    HA   ARG  96           HA       ARG  96  12.259   2.415 -13.541
  782   1HB   ARG  96          2HB       ARG  96  14.664   2.760 -13.296
  783   2HB   ARG  96          1HB       ARG  96  14.082   1.767 -11.958
  784   1HG   ARG  96          2HG       ARG  96  14.671  -0.199 -13.680
  785   2HG   ARG  96          1HG       ARG  96  15.814   1.011 -14.264
  786   1HD   ARG  96          2HD       ARG  96  15.980   1.100 -11.450
  787   2HD   ARG  96          1HD       ARG  96  15.955  -0.611 -11.875
  788    HE   ARG  96           HE       ARG  96  17.779   0.552 -13.646
  789   1HH1  ARG  96          1HH1      ARG  96  18.109  -1.387 -11.157
  790   2HH1  ARG  96          2HH1      ARG  96  19.452  -0.611 -10.387
  791   1HH2  ARG  96          1HH2      ARG  96  19.188   2.296 -12.261
  792   2HH2  ARG  96          2HH2      ARG  96  20.063   1.474 -11.012
  793    H    GLN  97           H        GLN  97  11.805   0.119 -15.527
  794    HA   GLN  97           HA       GLN  97  13.621   1.055 -17.701
  795   1HB   GLN  97          2HB       GLN  97  12.971  -1.499 -16.979
  796   2HB   GLN  97          1HB       GLN  97  11.778  -1.192 -18.243
  797   1HG   GLN  97          2HG       GLN  97  13.355  -1.089 -19.890
  798   2HG   GLN  97          1HG       GLN  97  14.537  -0.296 -18.848
  799   1HE2  GLN  97          1HE2      GLN  97  15.533  -1.794 -17.104
  800   2HE2  GLN  97          2HE2      GLN  97  15.812  -3.410 -17.542
  801    H    ARG  98           H        ARG  98  10.240   0.773 -16.757
  802    HA   ARG  98           HA       ARG  98   9.520   2.800 -18.755
  803   1HB   ARG  98          2HB       ARG  98   8.943  -0.068 -19.130
  804   2HB   ARG  98          1HB       ARG  98   7.531   0.979 -19.285
  805   1HG   ARG  98          2HG       ARG  98   8.267   1.874 -21.230
  806   2HG   ARG  98          1HG       ARG  98   9.918   2.038 -20.629
  807   1HD   ARG  98          2HD       ARG  98  10.347  -0.329 -21.053
  808   2HD   ARG  98          1HD       ARG  98   8.673  -0.569 -21.554
  809    HE   ARG  98           HE       ARG  98  10.126   1.464 -23.094
  810   1HH1  ARG  98          1HH2      ARG  98   9.654  -1.909 -22.661
  811   2HH1  ARG  98          2HH2      ARG  98   9.650  -2.268 -24.356
  812   1HH2  ARG  98          1HH1      ARG  98   9.926   1.050 -25.328
  813   2HH2  ARG  98          2HH1      ARG  98   9.805  -0.592 -25.866
  814    H    GLY  99           H        GLY  99   8.121   4.132 -17.713
  815   1HA   GLY  99          2HA       GLY  99   6.458   2.957 -15.520
  816   2HA   GLY  99          1HA       GLY  99   7.091   4.602 -15.482
  817    H    VAL 100           H        VAL 100   6.478   4.858 -18.441
  818    HA   VAL 100           HA       VAL 100   3.565   4.654 -18.608
  819    HB   VAL 100           HB       VAL 100   3.695   6.657 -17.247
  820   1HG1  VAL 100          1HG1      VAL 100   6.162   7.026 -18.168
  821   2HG1  VAL 100          2HG1      VAL 100   5.205   8.384 -17.575
  822   3HG1  VAL 100          3HG1      VAL 100   5.329   8.084 -19.309
  823   1HG2  VAL 100          1HG2      VAL 100   3.285   8.222 -19.605
  824   2HG2  VAL 100          2HG2      VAL 100   2.066   7.516 -18.543
  825   3HG2  VAL 100          3HG2      VAL 100   2.673   6.599 -19.921
  826    H    SER 101           HN       SER 101   5.178   3.450 -20.322
  827    HA   SER 101           HA       SER 101   5.987   3.379 -22.539
  828   1HB   SER 101          2HB       SER 101   3.945   5.292 -23.466
  829   2HB   SER 101          1HB       SER 101   4.225   3.623 -23.953
  830    HG   SER 101           HG       SER 101   2.378   4.568 -22.309
  Start of MODEL    6
    1   1H    GLU   1          1HT       GLU   1   9.369  14.153  -9.948
    2   2H    GLU   1          2HT       GLU   1  10.374  15.217  -9.085
    3   3H    GLU   1          3HT       GLU   1   9.787  13.806  -8.342
    4    HA   GLU   1           HA       GLU   1  11.010  12.636 -10.315
    5   1HB   GLU   1          2HB       GLU   1  11.608  14.909 -11.275
    6   2HB   GLU   1          1HB       GLU   1  12.675  15.130  -9.887
    7   1HG   GLU   1          2HG       GLU   1  14.039  13.278 -10.511
    8   2HG   GLU   1          1HG       GLU   1  12.853  12.706 -11.684
    9    H    SER   2           H        SER   2  10.498  12.114  -7.708
   10    HA   SER   2           HA       SER   2  13.227  11.678  -6.616
   11   1HB   SER   2          2HB       SER   2  11.212  13.438  -5.484
   12   2HB   SER   2          1HB       SER   2  11.623  12.142  -4.365
   13    HG   SER   2           HG       SER   2  13.612  12.887  -4.218
   14    H    LYS   3           H        LYS   3  10.809  10.149  -7.843
   15    HA   LYS   3           HA       LYS   3  10.832   7.980  -5.795
   16   1HB   LYS   3          2HB       LYS   3   8.413   7.573  -6.917
   17   2HB   LYS   3          1HB       LYS   3   8.634   8.565  -5.476
   18   1HG   LYS   3          2HG       LYS   3   8.980   9.894  -8.123
   19   2HG   LYS   3          1HG       LYS   3   7.342   9.481  -7.628
   20   1HD   LYS   3          2HD       LYS   3   7.772  10.642  -5.444
   21   2HD   LYS   3          1HD       LYS   3   9.327  11.174  -6.088
   22   1HE   LYS   3          2HE       LYS   3   8.370  12.795  -7.339
   23   2HE   LYS   3          1HE       LYS   3   7.107  11.709  -7.920
   24   1HZ   LYS   3          1HZ       LYS   3   5.819  12.091  -6.012
   25   2HZ   LYS   3          2HZ       LYS   3   6.365  13.628  -6.490
   26   3HZ   LYS   3          3HZ       LYS   3   7.098  12.832  -5.180
   27    HA   PRO   4           HA       PRO   4  12.006   6.666 -10.126
   28   1HB   PRO   4          2HB       PRO   4  14.591   5.961  -9.511
   29   2HB   PRO   4          1HB       PRO   4  14.104   7.556 -10.109
   30   1HG   PRO   4          2HG       PRO   4  14.843   6.733  -7.334
   31   2HG   PRO   4          1HG       PRO   4  15.021   8.308  -8.124
   32   1HD   PRO   4          2HD       PRO   4  12.992   7.650  -6.290
   33   2HD   PRO   4          1HD       PRO   4  12.958   9.019  -7.418
   34    HA   PRO   5           HA       PRO   5  13.032   2.473  -7.974
   35   1HB   PRO   5          2HB       PRO   5  12.123   2.199  -5.391
   36   2HB   PRO   5          1HB       PRO   5  13.776   2.664  -5.818
   37   1HG   PRO   5          2HG       PRO   5  11.548   4.369  -4.802
   38   2HG   PRO   5          1HG       PRO   5  13.297   4.570  -4.602
   39   1HD   PRO   5          2HD       PRO   5  11.707   6.004  -6.404
   40   2HD   PRO   5          1HD       PRO   5  13.473   5.854  -6.493
   41    H    TYR   6           H        TYR   6  10.209   3.317  -5.934
   42    HA   TYR   6           HA       TYR   6   8.685   1.240  -7.333
   43   1HB   TYR   6          2HB       TYR   6   8.105   2.980  -4.948
   44   2HB   TYR   6          1HB       TYR   6   6.910   1.878  -5.634
   45    HD1  TYR   6           HD1      TYR   6  10.195   0.635  -6.228
   46    HD2  TYR   6           HD2      TYR   6   7.169   0.937  -3.193
   47    HE1  TYR   6           HE1      TYR   6  11.243  -1.242  -4.989
   48    HE2  TYR   6           HE2      TYR   6   8.217  -0.940  -1.958
   49    HH   TYR   6           HH       TYR   6  11.296  -2.022  -2.534
   50    H    SER   7           H        SER   7   8.045   1.848  -9.277
   51    HA   SER   7           HA       SER   7   7.297   4.432 -10.154
   52   1HB   SER   7          2HB       SER   7   6.778   1.631 -11.066
   53   2HB   SER   7          1HB       SER   7   5.854   2.936 -11.812
   54    HG   SER   7           HG       SER   7   8.572   2.348 -11.934
   55    H    TYR   8           H        TYR   8   4.822   4.569 -11.111
   56    HA   TYR   8           HA       TYR   8   3.120   4.404  -8.676
   57   1HB   TYR   8          2HB       TYR   8   2.926   6.026 -11.220
   58   2HB   TYR   8          1HB       TYR   8   1.613   5.938 -10.045
   59    HD1  TYR   8           HD1      TYR   8   1.533   7.686  -8.516
   60    HD2  TYR   8           HD2      TYR   8   5.351   6.339  -9.956
   61    HE1  TYR   8           HE1      TYR   8   2.664   9.390  -7.118
   62    HE2  TYR   8           HE2      TYR   8   6.479   8.044  -8.558
   63    HH   TYR   8           HH       TYR   8   5.323   9.446  -6.074
   64    H    ALA   9           H        ALA   9   3.258   1.981  -9.428
   65    HA   ALA   9           HA       ALA   9   0.652   1.218 -10.373
   66   1HB   ALA   9          1HB       ALA   9   1.287   0.145 -12.482
   67   2HB   ALA   9          2HB       ALA   9   2.956   0.675 -12.276
   68   3HB   ALA   9          3HB       ALA   9   1.682   1.862 -12.560
   69    H    GLN  10           H        GLN  10   4.026   0.357  -9.947
   70    HA   GLN  10           HA       GLN  10   3.363  -2.416  -9.128
   71   1HB   GLN  10          2HB       GLN  10   5.365  -2.230 -10.469
   72   2HB   GLN  10          1HB       GLN  10   5.966  -0.892  -9.489
   73   1HG   GLN  10          2HG       GLN  10   5.369  -3.216  -7.850
   74   2HG   GLN  10          1HG       GLN  10   6.533  -3.607  -9.116
   75   1HE2  GLN  10          1HE2      GLN  10   6.240  -0.353  -7.714
   76   2HE2  GLN  10          2HE2      GLN  10   7.747  -0.369  -6.933
   77    H    LEU  11           H        LEU  11   4.142   0.728  -7.958
   78    HA   LEU  11           HA       LEU  11   5.024   0.257  -5.330
   79   1HB   LEU  11          2HB       LEU  11   4.911   2.485  -6.351
   80   2HB   LEU  11          1HB       LEU  11   3.153   2.381  -6.434
   81    HG   LEU  11           HG       LEU  11   3.468   1.913  -3.812
   82   1HD1  LEU  11          1HD1      LEU  11   5.749   2.104  -3.488
   83   2HD1  LEU  11          2HD1      LEU  11   5.271   3.785  -3.256
   84   3HD1  LEU  11          3HD1      LEU  11   5.943   3.263  -4.801
   85   1HD2  LEU  11          1HD2      LEU  11   3.721   4.769  -4.301
   86   2HD2  LEU  11          2HD2      LEU  11   2.323   3.859  -3.728
   87   3HD2  LEU  11          3HD2      LEU  11   2.622   4.019  -5.459
   88    H    ILE  12           H        ILE  12   1.868   0.070  -6.819
   89    HA   ILE  12           HA       ILE  12   0.423  -0.404  -4.268
   90    HB   ILE  12           HB       ILE  12  -0.692  -1.051  -6.966
   91   1HG1  ILE  12          2HG1      ILE  12   0.354   1.547  -6.162
   92   2HG1  ILE  12          1HG1      ILE  12  -0.294   1.045  -7.716
   93   1HG2  ILE  12          1HG2      ILE  12  -1.839   0.117  -4.429
   94   2HG2  ILE  12          2HG2      ILE  12  -1.963  -1.561  -4.951
   95   3HG2  ILE  12          3HG2      ILE  12  -2.760  -0.288  -5.875
   96   1HD1  ILE  12          1HD1      ILE  12  -1.804   2.708  -7.131
   97   2HD1  ILE  12          2HD1      ILE  12  -1.710   2.333  -5.415
   98   3HD1  ILE  12          3HD1      ILE  12  -2.622   1.285  -6.490
   99    H    VAL  13           H        VAL  13   1.275  -2.282  -7.159
  100    HA   VAL  13           HA       VAL  13   0.106  -4.708  -6.512
  101    HB   VAL  13           HB       VAL  13   2.853  -4.309  -7.716
  102   1HG1  VAL  13          1HG1      VAL  13   0.885  -6.602  -7.706
  103   2HG1  VAL  13          2HG1      VAL  13   2.556  -6.610  -7.151
  104   3HG1  VAL  13          3HG1      VAL  13   2.197  -6.478  -8.872
  105   1HG2  VAL  13          1HG2      VAL  13   1.643  -4.310  -9.860
  106   2HG2  VAL  13          2HG2      VAL  13   1.053  -3.009  -8.830
  107   3HG2  VAL  13          3HG2      VAL  13   0.111  -4.481  -9.008
  108    H    GLN  14           H        GLN  14   3.446  -3.774  -5.563
  109    HA   GLN  14           HA       GLN  14   3.774  -6.111  -3.912
  110   1HB   GLN  14          2HB       GLN  14   5.654  -4.677  -4.786
  111   2HB   GLN  14          1HB       GLN  14   5.176  -3.449  -3.615
  112   1HG   GLN  14          2HG       GLN  14   5.466  -5.132  -1.791
  113   2HG   GLN  14          1HG       GLN  14   6.068  -6.277  -2.991
  114   1HE2  GLN  14          1HE2      GLN  14   6.731  -2.774  -2.988
  115   2HE2  GLN  14          2HE2      GLN  14   8.394  -2.933  -2.746
  116    H    ALA  15           H        ALA  15   2.219  -3.060  -3.465
  117    HA   ALA  15           HA       ALA  15   2.286  -2.982  -0.588
  118   1HB   ALA  15          1HB       ALA  15   0.257  -1.800  -2.510
  119   2HB   ALA  15          2HB       ALA  15   1.747  -1.011  -1.991
  120   3HB   ALA  15          3HB       ALA  15   0.468  -1.338  -0.821
  121    H    ILE  16           H        ILE  16  -0.171  -4.131  -2.900
  122    HA   ILE  16           HA       ILE  16  -1.788  -5.218  -0.698
  123    HB   ILE  16           HB       ILE  16  -2.798  -6.142  -3.191
  124   1HG1  ILE  16          2HG1      ILE  16  -1.771  -3.297  -3.240
  125   2HG1  ILE  16          1HG1      ILE  16  -1.578  -4.545  -4.470
  126   1HG2  ILE  16          1HG2      ILE  16  -3.950  -5.387  -1.052
  127   2HG2  ILE  16          2HG2      ILE  16  -4.689  -4.840  -2.558
  128   3HG2  ILE  16          3HG2      ILE  16  -3.695  -3.735  -1.610
  129   1HD1  ILE  16          1HD1      ILE  16  -4.226  -3.287  -3.680
  130   2HD1  ILE  16          2HD1      ILE  16  -3.977  -4.466  -4.968
  131   3HD1  ILE  16          3HD1      ILE  16  -3.291  -2.848  -5.108
  132    H    SER  17           H        SER  17  -0.311  -6.606  -3.643
  133    HA   SER  17           HA       SER  17  -0.752  -9.317  -2.958
  134   1HB   SER  17          2HB       SER  17   1.745  -8.718  -4.428
  135   2HB   SER  17          1HB       SER  17   0.412  -9.786  -4.857
  136    HG   SER  17           HG       SER  17  -0.216  -8.222  -6.098
  137    H    SER  18           H        SER  18   1.943  -7.173  -2.056
  138    HA   SER  18           HA       SER  18   3.414  -9.408  -0.853
  139   1HB   SER  18          2HB       SER  18   4.282  -7.096  -1.882
  140   2HB   SER  18          1HB       SER  18   4.118  -6.586  -0.204
  141    HG   SER  18           HG       SER  18   5.300  -8.661   0.223
  142    H    ALA  19           H        ALA  19   0.760  -7.615   0.152
  143    HA   ALA  19           HA       ALA  19   1.580  -7.645   3.011
  144   1HB   ALA  19          1HB       ALA  19  -0.018  -6.055   3.361
  145   2HB   ALA  19          2HB       ALA  19  -1.184  -6.858   2.308
  146   3HB   ALA  19          3HB       ALA  19   0.079  -5.843   1.614
  147    H    GLN  20           H        GLN  20   0.297  -8.834   4.588
  148    HA   GLN  20           HA       GLN  20  -0.323 -11.476   3.999
  149   1HB   GLN  20          2HB       GLN  20  -0.309 -10.487   6.308
  150   2HB   GLN  20          1HB       GLN  20  -1.882  -9.766   5.965
  151   1HG   GLN  20          2HG       GLN  20  -2.614 -12.177   5.340
  152   2HG   GLN  20          1HG       GLN  20  -1.171 -12.685   6.217
  153   1HE2  GLN  20          1HE2      GLN  20  -4.333 -11.109   6.583
  154   2HE2  GLN  20          2HE2      GLN  20  -4.377 -11.206   8.277
  155    H    ASP  21           H        ASP  21  -2.601  -8.731   3.998
  156    HA   ASP  21           HA       ASP  21  -4.598 -10.394   2.591
  157   1HB   ASP  21          2HB       ASP  21  -4.617  -7.858   4.106
  158   2HB   ASP  21          1HB       ASP  21  -5.661  -7.868   2.683
  159    H    ARG  22           H        ARG  22  -4.620 -10.406   0.366
  160    HA   ARG  22           HA       ARG  22  -2.832  -8.779  -1.183
  161   1HB   ARG  22          2HB       ARG  22  -3.989  -9.751  -3.134
  162   2HB   ARG  22          1HB       ARG  22  -3.611 -10.995  -1.941
  163   1HG   ARG  22          2HG       ARG  22  -5.866 -11.041  -1.137
  164   2HG   ARG  22          1HG       ARG  22  -6.282  -9.578  -2.029
  165   1HD   ARG  22          2HD       ARG  22  -6.501 -10.689  -4.022
  166   2HD   ARG  22          1HD       ARG  22  -5.222 -11.841  -3.638
  167    HE   ARG  22           HE       ARG  22  -7.018 -13.267  -3.106
  168   1HH1  ARG  22          1HH2      ARG  22  -7.211 -12.211  -0.375
  169   2HH1  ARG  22          2HH2      ARG  22  -8.847 -11.656  -0.278
  170   1HH2  ARG  22          1HH1      ARG  22  -9.321 -11.621  -3.712
  171   2HH2  ARG  22          2HH1      ARG  22 -10.042 -11.323  -2.166
  172    H    GLN  23           H        GLN  23  -5.693  -7.914   0.324
  173    HA   GLN  23           HA       GLN  23  -6.261  -5.857  -1.761
  174   1HB   GLN  23          2HB       GLN  23  -8.508  -5.703  -0.505
  175   2HB   GLN  23          1HB       GLN  23  -8.236  -7.144  -1.484
  176   1HG   GLN  23          2HG       GLN  23  -7.499  -8.375   0.518
  177   2HG   GLN  23          1HG       GLN  23  -7.758  -6.935   1.503
  178   1HE2  GLN  23          1HE2      GLN  23  -9.284  -8.770   2.526
  179   2HE2  GLN  23          2HE2      GLN  23 -10.883  -8.761   1.959
  180    H    LEU  24           H        LEU  24  -5.935  -3.767  -1.213
  181    HA   LEU  24           HA       LEU  24  -5.551  -3.112   1.676
  182   1HB   LEU  24          2HB       LEU  24  -4.100  -2.119  -0.789
  183   2HB   LEU  24          1HB       LEU  24  -4.033  -1.278   0.754
  184    HG   LEU  24           HG       LEU  24  -3.171  -4.133   0.230
  185   1HD1  LEU  24          1HD1      LEU  24  -1.480  -2.631  -0.524
  186   2HD1  LEU  24          2HD1      LEU  24  -0.973  -3.135   1.088
  187   3HD1  LEU  24          3HD1      LEU  24  -1.719  -1.555   0.853
  188   1HD2  LEU  24          1HD2      LEU  24  -4.060  -4.194   2.407
  189   2HD2  LEU  24          2HD2      LEU  24  -3.564  -2.538   2.756
  190   3HD2  LEU  24          3HD2      LEU  24  -2.358  -3.823   2.688
  191    H    THR  25           H        THR  25  -6.251  -0.946   2.283
  192    HA   THR  25           HA       THR  25  -8.610  -0.069   0.780
  193    HB   THR  25           HB       THR  25  -8.791   1.642   2.590
  194    HG1  THR  25           HG1      THR  25  -7.177   1.967   3.907
  195   1HG2  THR  25          1HG2      THR  25  -8.850  -0.110   4.514
  196   2HG2  THR  25          2HG2      THR  25  -8.404  -1.266   3.259
  197   3HG2  THR  25          3HG2      THR  25  -9.907  -0.353   3.121
  198    H    LEU  26           H        LEU  26  -8.721   2.486   0.453
  199    HA   LEU  26           HA       LEU  26  -6.786   3.162  -1.517
  200   1HB   LEU  26          2HB       LEU  26  -9.154   4.207  -0.958
  201   2HB   LEU  26          1HB       LEU  26  -8.193   5.326   0.010
  202    HG   LEU  26           HG       LEU  26  -7.419   4.722  -2.836
  203   1HD1  LEU  26          1HD1      LEU  26  -8.713   6.925  -3.310
  204   2HD1  LEU  26          2HD1      LEU  26  -9.592   6.553  -1.827
  205   3HD1  LEU  26          3HD1      LEU  26  -9.640   5.430  -3.186
  206   1HD2  LEU  26          1HD2      LEU  26  -5.743   6.046  -2.036
  207   2HD2  LEU  26          2HD2      LEU  26  -6.723   6.645  -0.699
  208   3HD2  LEU  26          3HD2      LEU  26  -6.896   7.353  -2.305
  209    H    SER  27           H        SER  27  -6.994   4.035   1.930
  210    HA   SER  27           HA       SER  27  -4.338   5.348   1.714
  211   1HB   SER  27          2HB       SER  27  -6.544   5.403   3.750
  212   2HB   SER  27          1HB       SER  27  -4.911   5.879   4.207
  213    HG   SER  27           HG       SER  27  -6.726   7.316   2.953
  214    H    GLY  28           H        GLY  28  -4.799   2.360   1.662
  215   1HA   GLY  28          2HA       GLY  28  -3.430   1.594   4.206
  216   2HA   GLY  28          1HA       GLY  28  -4.231   0.466   3.107
  217    H    ILE  29           H        ILE  29  -3.231   1.454   0.728
  218    HA   ILE  29           HA       ILE  29  -0.843   0.045   0.340
  219    HB   ILE  29           HB       ILE  29  -2.468   0.826  -1.377
  220   1HG1  ILE  29          2HG1      ILE  29   0.487   1.321  -1.649
  221   2HG1  ILE  29          1HG1      ILE  29  -0.477  -0.004  -2.306
  222   1HG2  ILE  29          1HG2      ILE  29  -1.040   3.439  -1.451
  223   2HG2  ILE  29          2HG2      ILE  29  -2.346   3.223  -0.286
  224   3HG2  ILE  29          3HG2      ILE  29  -2.661   3.037  -2.008
  225   1HD1  ILE  29          1HD1      ILE  29  -0.360   2.856  -3.233
  226   2HD1  ILE  29          2HD1      ILE  29  -1.705   1.802  -3.660
  227   3HD1  ILE  29          3HD1      ILE  29  -0.067   1.393  -4.171
  228    H    TYR  30           H        TYR  30  -1.386   3.389   1.217
  229    HA   TYR  30           HA       TYR  30   1.321   4.267   0.841
  230   1HB   TYR  30          2HB       TYR  30  -0.632   5.441   2.823
  231   2HB   TYR  30          1HB       TYR  30   0.651   6.271   1.938
  232    HD1  TYR  30           HD1      TYR  30   0.324   5.128  -0.767
  233    HD2  TYR  30           HD2      TYR  30  -2.626   6.467   2.047
  234    HE1  TYR  30           HE1      TYR  30  -1.251   5.549  -2.629
  235    HE2  TYR  30           HE2      TYR  30  -4.204   6.890   0.187
  236    HH   TYR  30           HH       TYR  30  -3.252   6.322  -3.203
  237    H    ALA  31           H        ALA  31  -0.458   3.398   3.824
  238    HA   ALA  31           HA       ALA  31   1.845   3.529   5.523
  239   1HB   ALA  31          1HB       ALA  31  -0.606   3.450   6.240
  240   2HB   ALA  31          2HB       ALA  31   0.494   2.431   7.170
  241   3HB   ALA  31          3HB       ALA  31  -0.543   1.715   5.936
  242    H    HIS  32           H        HIS  32   0.946   1.281   3.108
  243    HA   HIS  32           HA       HIS  32   2.247  -1.040   4.294
  244   1HB   HIS  32          2HB       HIS  32   0.458  -1.342   2.657
  245   2HB   HIS  32          1HB       HIS  32   1.388  -0.467   1.441
  246    HD1  HIS  32           HD1      HIS  32   0.640  -3.802   2.371
  247    HD2  HIS  32           HD2      HIS  32   4.157  -1.878   1.225
  248    HE1  HIS  32           HE1      HIS  32   2.243  -5.619   1.632
  249    H    ILE  33           H        ILE  33   3.084   0.687   1.263
  250    HA   ILE  33           HA       ILE  33   5.780  -0.273   1.258
  251    HB   ILE  33           HB       ILE  33   6.171   1.458  -0.462
  252   1HG1  ILE  33          2HG1      ILE  33   3.684   2.544  -0.960
  253   2HG1  ILE  33          1HG1      ILE  33   3.787   2.608   0.798
  254   1HG2  ILE  33          1HG2      ILE  33   3.683  -0.236  -0.562
  255   2HG2  ILE  33          2HG2      ILE  33   5.235  -0.506  -1.357
  256   3HG2  ILE  33          3HG2      ILE  33   4.151   0.755  -1.944
  257   1HD1  ILE  33          1HD1      ILE  33   6.151   3.458  -0.836
  258   2HD1  ILE  33          2HD1      ILE  33   5.663   3.989   0.773
  259   3HD1  ILE  33          3HD1      ILE  33   4.797   4.570  -0.648
  260    H    THR  34           H        THR  34   4.360   2.728   2.509
  261    HA   THR  34           HA       THR  34   6.760   4.123   3.066
  262    HB   THR  34           HB       THR  34   5.434   5.299   4.832
  263    HG1  THR  34           HG1      THR  34   3.701   4.406   5.587
  264   1HG2  THR  34          1HG2      THR  34   4.776   6.480   3.035
  265   2HG2  THR  34          2HG2      THR  34   3.344   5.453   2.968
  266   3HG2  THR  34          3HG2      THR  34   4.772   5.036   2.022
  267    H    LYS  35           H        LYS  35   5.384   1.331   4.604
  268    HA   LYS  35           HA       LYS  35   6.582   1.574   7.181
  269   1HB   LYS  35          2HB       LYS  35   5.083  -0.369   5.780
  270   2HB   LYS  35          1HB       LYS  35   6.571  -1.170   6.288
  271   1HG   LYS  35          2HG       LYS  35   6.140  -0.847   8.545
  272   2HG   LYS  35          1HG       LYS  35   5.140   0.577   8.255
  273   1HD   LYS  35          2HD       LYS  35   3.270  -0.693   7.654
  274   2HD   LYS  35          1HD       LYS  35   4.242  -2.109   7.248
  275   1HE   LYS  35          2HE       LYS  35   4.738  -2.500   9.599
  276   2HE   LYS  35          1HE       LYS  35   3.901  -1.016  10.055
  277   1HZ   LYS  35          1HZ       LYS  35   2.693  -3.312  10.148
  278   2HZ   LYS  35          2HZ       LYS  35   2.450  -3.025   8.491
  279   3HZ   LYS  35          3HZ       LYS  35   1.866  -1.921   9.643
  280    H    HIS  36           H        HIS  36   7.806   0.109   4.166
  281    HA   HIS  36           HA       HIS  36  10.473  -0.108   5.486
  282   1HB   HIS  36          2HB       HIS  36  10.893  -1.485   3.259
  283   2HB   HIS  36          1HB       HIS  36  10.072  -2.225   4.634
  284    HD1  HIS  36           HD1      HIS  36   9.562  -1.185   1.122
  285    HD2  HIS  36           HD2      HIS  36   7.171  -2.337   4.336
  286    HE1  HIS  36           HE1      HIS  36   7.278  -1.714   0.163
  287    H    TYR  37           H        TYR  37   8.843   2.080   3.686
  288    HA   TYR  37           HA       TYR  37  11.276   2.805   2.110
  289   1HB   TYR  37          2HB       TYR  37   8.428   2.762   1.432
  290   2HB   TYR  37          1HB       TYR  37   9.201   4.301   1.052
  291    HD1  TYR  37           HD1      TYR  37   9.730   4.351  -1.223
  292    HD2  TYR  37           HD2      TYR  37  10.436   0.764   1.031
  293    HE1  TYR  37           HE1      TYR  37  10.793   3.313  -3.206
  294    HE2  TYR  37           HE2      TYR  37  11.499  -0.275  -0.951
  295    HH   TYR  37           HH       TYR  37  12.765   0.894  -3.174
  296    HA   PRO  38           HA       PRO  38  11.187   6.178   5.074
  297   1HB   PRO  38          2HB       PRO  38  13.718   7.065   4.466
  298   2HB   PRO  38          1HB       PRO  38  13.390   5.705   5.554
  299   1HG   PRO  38          2HG       PRO  38  14.423   5.664   2.760
  300   2HG   PRO  38          1HG       PRO  38  14.645   4.477   4.055
  301   1HD   PRO  38          2HD       PRO  38  12.840   4.251   1.880
  302   2HD   PRO  38          1HD       PRO  38  12.859   3.234   3.337
  303    H    TYR  39           H        TYR  39  11.871   6.340   1.631
  304    HA   TYR  39           HA       TYR  39  11.950   9.205   1.404
  305   1HB   TYR  39          2HB       TYR  39  12.801   7.973  -0.448
  306   2HB   TYR  39          1HB       TYR  39  11.343   6.990  -0.563
  307    HD1  TYR  39           HD1      TYR  39   9.603   7.622  -2.011
  308    HD2  TYR  39           HD2      TYR  39  12.524  10.535  -0.813
  309    HE1  TYR  39           HE1      TYR  39   8.612   9.263  -3.584
  310    HE2  TYR  39           HE2      TYR  39  11.533  12.174  -2.386
  311    HH   TYR  39           HH       TYR  39   9.012  12.414  -3.447
  312    H    TYR  40           H        TYR  40   9.312   6.872   1.533
  313    HA   TYR  40           HA       TYR  40   7.352   8.950   0.797
  314   1HB   TYR  40          2HB       TYR  40   7.323   6.003   1.137
  315   2HB   TYR  40          1HB       TYR  40   5.822   6.847   1.527
  316    HD1  TYR  40           HD1      TYR  40   5.791   9.100  -0.296
  317    HD2  TYR  40           HD2      TYR  40   7.055   5.059  -1.001
  318    HE1  TYR  40           HE1      TYR  40   5.305   9.372  -2.714
  319    HE2  TYR  40           HE2      TYR  40   6.561   5.326  -3.420
  320    HH   TYR  40           HH       TYR  40   4.688   7.362  -4.697
  321    H    ARG  41           H        ARG  41   8.948   8.060   3.598
  322    HA   ARG  41           HA       ARG  41   6.776   8.235   5.498
  323   1HB   ARG  41          2HB       ARG  41   9.133   7.288   5.902
  324   2HB   ARG  41          1HB       ARG  41   9.656   8.965   6.062
  325   1HG   ARG  41          2HG       ARG  41   8.907   9.005   8.182
  326   2HG   ARG  41          1HG       ARG  41   7.279   8.630   7.616
  327   1HD   ARG  41          2HD       ARG  41   7.637   6.777   8.939
  328   2HD   ARG  41          1HD       ARG  41   8.318   6.175   7.427
  329    HE   ARG  41           HE       ARG  41  10.441   7.440   8.740
  330   1HH1  ARG  41          1HH1      ARG  41   9.326   4.402   8.258
  331   2HH1  ARG  41          2HH1      ARG  41   9.900   3.720   9.742
  332   1HH2  ARG  41          1HH2      ARG  41  10.707   6.787  11.146
  333   2HH2  ARG  41          2HH2      ARG  41  10.683   5.070  11.377
  334    H    THR  42           H        THR  42   8.375  10.534   3.555
  335    HA   THR  42           HA       THR  42   6.772  12.708   4.551
  336    HB   THR  42           HB       THR  42   9.512  13.580   4.995
  337    HG1  THR  42           HG1      THR  42   9.982  12.315   6.720
  338   1HG2  THR  42          1HG2      THR  42   8.539  14.710   6.779
  339   2HG2  THR  42          2HG2      THR  42   7.379  13.419   7.096
  340   3HG2  THR  42          3HG2      THR  42   7.147  14.494   5.718
  341    H    ALA  43           H        ALA  43   7.241  11.594   2.017
  342    HA   ALA  43           HA       ALA  43   9.170  13.295   0.598
  343   1HB   ALA  43          1HB       ALA  43   7.429  10.982  -0.064
  344   2HB   ALA  43          2HB       ALA  43   9.093  11.313  -0.547
  345   3HB   ALA  43          3HB       ALA  43   7.756  12.106  -1.382
  346    H    ASP  44           H        ASP  44   5.956  12.677  -0.691
  347    HA   ASP  44           HA       ASP  44   5.122  15.472  -0.242
  348   1HB   ASP  44          2HB       ASP  44   5.952  14.358  -2.904
  349   2HB   ASP  44          1HB       ASP  44   4.644  15.538  -2.836
  350    H    LYS  45           H        LYS  45   2.851  15.778  -0.698
  351    HA   LYS  45           HA       LYS  45   1.314  13.268  -0.518
  352   1HB   LYS  45          2HB       LYS  45   0.622  16.197  -0.262
  353   2HB   LYS  45          1HB       LYS  45  -0.634  14.962  -0.358
  354   1HG   LYS  45          2HG       LYS  45   0.702  13.778   1.536
  355   2HG   LYS  45          1HG       LYS  45   1.461  15.352   1.770
  356   1HD   LYS  45          2HD       LYS  45  -1.536  14.890   1.762
  357   2HD   LYS  45          1HD       LYS  45  -0.552  15.015   3.221
  358   1HE   LYS  45          2HE       LYS  45   0.201  17.275   2.472
  359   2HE   LYS  45          1HE       LYS  45  -0.899  17.153   1.099
  360   1HZ   LYS  45          1HZ       LYS  45  -2.143  18.272   2.668
  361   2HZ   LYS  45          2HZ       LYS  45  -1.535  17.365   3.969
  362   3HZ   LYS  45          3HZ       LYS  45  -2.652  16.670   2.893
  363    H    GLY  46           H        GLY  46   2.485  13.325  -2.981
  364   1HA   GLY  46          2HA       GLY  46   0.392  14.350  -4.847
  365   2HA   GLY  46          1HA       GLY  46   2.046  13.939  -5.312
  366    H    TRP  47           H        TRP  47   2.445  11.456  -4.358
  367    HA   TRP  47           HA       TRP  47   0.942   9.800  -6.138
  368   1HB   TRP  47          2HB       TRP  47   2.173   7.947  -5.213
  369   2HB   TRP  47          1HB       TRP  47   3.268   9.319  -5.335
  370    HD1  TRP  47           HD1      TRP  47   3.147  10.890  -2.856
  371    HE1  TRP  47           HE1      TRP  47   3.503   9.929  -0.502
  372    HE3  TRP  47           HE3      TRP  47   2.088   5.962  -3.740
  373    HZ2  TRP  47           HZ2      TRP  47   3.372   7.419   0.837
  374    HZ3  TRP  47           HZ3      TRP  47   2.228   4.312  -1.895
  375    HH2  TRP  47           HH2      TRP  47   2.870   5.036   0.387
  376    H    GLN  48           H        GLN  48  -0.031  11.098  -3.204
  377    HA   GLN  48           HA       GLN  48  -1.380   8.912  -1.976
  378   1HB   GLN  48          2HB       GLN  48  -2.743  11.567  -1.980
  379   2HB   GLN  48          1HB       GLN  48  -2.434  10.470  -0.640
  380   1HG   GLN  48          2HG       GLN  48  -0.490  12.374  -1.955
  381   2HG   GLN  48          1HG       GLN  48  -1.023  12.360  -0.275
  382   1HE2  GLN  48          1HE2      GLN  48  -0.815   9.350  -0.132
  383   2HE2  GLN  48          2HE2      GLN  48   0.849   9.026  -0.033
  384    H    ASN  49           H        ASN  49  -2.970  11.467  -3.919
  385    HA   ASN  49           HA       ASN  49  -5.238   9.765  -4.531
  386   1HB   ASN  49          2HB       ASN  49  -4.308  12.495  -5.332
  387   2HB   ASN  49          1HB       ASN  49  -5.534  11.705  -6.325
  388   1HD2  ASN  49          1HD2      ASN  49  -6.984  13.511  -5.453
  389   2HD2  ASN  49          2HD2      ASN  49  -7.714  13.287  -3.937
  390    H    SER  50           H        SER  50  -2.150  10.359  -6.027
  391    HA   SER  50           HA       SER  50  -2.766   9.595  -8.696
  392   1HB   SER  50          2HB       SER  50  -0.566  10.558  -7.749
  393   2HB   SER  50          1HB       SER  50  -0.171   8.895  -7.323
  394    HG   SER  50           HG       SER  50   0.558   9.600  -9.440
  395    H    ILE  51           H        ILE  51  -1.869   7.626  -5.867
  396    HA   ILE  51           HA       ILE  51  -1.698   5.130  -7.225
  397    HB   ILE  51           HB       ILE  51  -1.884   6.068  -4.437
  398   1HG1  ILE  51          2HG1      ILE  51  -0.135   4.402  -4.149
  399   2HG1  ILE  51          1HG1      ILE  51  -0.497   3.700  -5.717
  400   1HG2  ILE  51          1HG2      ILE  51  -3.667   4.634  -4.005
  401   2HG2  ILE  51          2HG2      ILE  51  -2.296   3.553  -3.761
  402   3HG2  ILE  51          3HG2      ILE  51  -3.199   3.502  -5.274
  403   1HD1  ILE  51          1HD1      ILE  51  -0.069   6.148  -6.578
  404   2HD1  ILE  51          2HD1      ILE  51   1.286   5.066  -6.260
  405   3HD1  ILE  51          3HD1      ILE  51   0.838   6.292  -5.075
  406    H    ARG  52           H        ARG  52  -4.479   6.591  -5.497
  407    HA   ARG  52           HA       ARG  52  -6.347   4.533  -6.010
  408   1HB   ARG  52          2HB       ARG  52  -6.842   6.415  -4.512
  409   2HB   ARG  52          1HB       ARG  52  -6.824   7.527  -5.880
  410   1HG   ARG  52          2HG       ARG  52  -8.595   5.609  -6.740
  411   2HG   ARG  52          1HG       ARG  52  -8.929   5.661  -5.009
  412   1HD   ARG  52          2HD       ARG  52  -8.707   8.334  -5.628
  413   2HD   ARG  52          1HD       ARG  52  -9.466   7.681  -7.079
  414    HE   ARG  52           HE       ARG  52 -11.235   6.735  -5.550
  415   1HH1  ARG  52          1HH1      ARG  52 -10.046   9.840  -5.304
  416   2HH1  ARG  52          2HH1      ARG  52 -10.728  10.180  -3.749
  417   1HH2  ARG  52          1HH2      ARG  52 -11.745   6.915  -3.184
  418   2HH2  ARG  52          2HH2      ARG  52 -11.692   8.526  -2.551
  419    H    HIS  53           H        HIS  53  -5.729   7.475  -7.943
  420    HA   HIS  53           HA       HIS  53  -7.500   6.726 -10.081
  421   1HB   HIS  53          2HB       HIS  53  -6.410   9.036  -9.466
  422   2HB   HIS  53          1HB       HIS  53  -5.093   8.476 -10.496
  423    HD1  HIS  53           HD1      HIS  53  -5.857  10.445 -12.166
  424    HD2  HIS  53           HD2      HIS  53  -8.585   7.328 -11.701
  425    HE1  HIS  53           HE1      HIS  53  -7.499  10.635 -14.087
  426    H    ASN  54           H        ASN  54  -4.290   5.775  -9.238
  427    HA   ASN  54           HA       ASN  54  -3.396   4.998 -11.877
  428   1HB   ASN  54          2HB       ASN  54  -2.472   4.651  -9.081
  429   2HB   ASN  54          1HB       ASN  54  -1.966   3.388 -10.207
  430   1HD2  ASN  54          1HD2      ASN  54  -0.904   6.260  -8.960
  431   2HD2  ASN  54          2HD2      ASN  54   0.014   6.831 -10.269
  432    H    LEU  55           H        LEU  55  -4.891   3.275  -9.164
  433    HA   LEU  55           HA       LEU  55  -4.893   0.704 -10.445
  434   1HB   LEU  55          2HB       LEU  55  -6.767   1.715  -8.295
  435   2HB   LEU  55          1HB       LEU  55  -6.355   0.034  -8.633
  436    HG   LEU  55           HG       LEU  55  -4.381   2.165  -7.760
  437   1HD1  LEU  55          1HD1      LEU  55  -5.350  -0.214  -6.168
  438   2HD1  LEU  55          2HD1      LEU  55  -6.112   1.371  -6.044
  439   3HD1  LEU  55          3HD1      LEU  55  -4.418   1.170  -5.599
  440   1HD2  LEU  55          1HD2      LEU  55  -3.644  -0.639  -7.454
  441   2HD2  LEU  55          2HD2      LEU  55  -2.761   0.668  -8.243
  442   3HD2  LEU  55          3HD2      LEU  55  -3.986  -0.231  -9.133
  443    H    SER  56           H        SER  56  -6.606   3.497 -11.170
  444    HA   SER  56           HA       SER  56  -9.092   2.171 -11.999
  445   1HB   SER  56          2HB       SER  56  -9.406   4.428 -11.341
  446   2HB   SER  56          1HB       SER  56  -8.004   4.977 -12.256
  447    HG   SER  56           HG       SER  56  -9.129   4.565 -14.151
  448    H    LEU  57           H        LEU  57  -6.079   3.274 -13.453
  449    HA   LEU  57           HA       LEU  57  -7.033   2.603 -16.167
  450   1HB   LEU  57          2HB       LEU  57  -4.299   3.509 -15.210
  451   2HB   LEU  57          1HB       LEU  57  -4.817   3.386 -16.891
  452    HG   LEU  57           HG       LEU  57  -6.815   4.927 -15.849
  453   1HD1  LEU  57          1HD1      LEU  57  -4.681   6.495 -14.695
  454   2HD1  LEU  57          2HD1      LEU  57  -4.787   4.935 -13.877
  455   3HD1  LEU  57          3HD1      LEU  57  -6.201   5.985 -13.958
  456   1HD2  LEU  57          1HD2      LEU  57  -4.240   6.211 -16.739
  457   2HD2  LEU  57          2HD2      LEU  57  -5.896   6.648 -17.157
  458   3HD2  LEU  57          3HD2      LEU  57  -5.159   5.208 -17.859
  459    H    ASN  58           H        ASN  58  -4.856   1.353 -13.681
  460    HA   ASN  58           HA       ASN  58  -3.643  -0.697 -15.272
  461   1HB   ASN  58          2HB       ASN  58  -4.011  -0.250 -12.326
  462   2HB   ASN  58          1HB       ASN  58  -3.438  -1.815 -12.899
  463   1HD2  ASN  58          1HD2      ASN  58  -2.703   1.697 -13.144
  464   2HD2  ASN  58          2HD2      ASN  58  -1.040   1.484 -13.412
  465    H    ARG  59           H        ARG  59  -4.258  -2.830 -15.649
  466    HA   ARG  59           HA       ARG  59  -7.130  -3.391 -15.264
  467   1HB   ARG  59          2HB       ARG  59  -6.292  -3.834 -17.471
  468   2HB   ARG  59          1HB       ARG  59  -4.950  -4.785 -16.832
  469   1HG   ARG  59          2HG       ARG  59  -6.236  -6.638 -16.549
  470   2HG   ARG  59          1HG       ARG  59  -7.612  -5.706 -15.960
  471   1HD   ARG  59          2HD       ARG  59  -8.407  -5.266 -18.116
  472   2HD   ARG  59          1HD       ARG  59  -6.835  -5.557 -18.860
  473    HE   ARG  59           HE       ARG  59  -8.544  -7.752 -17.753
  474   1HH1  ARG  59          1HH1      ARG  59  -8.714  -7.268 -20.679
  475   2HH1  ARG  59          2HH1      ARG  59  -7.510  -8.343 -21.309
  476   1HH2  ARG  59          1HH2      ARG  59  -5.928  -8.788 -18.256
  477   2HH2  ARG  59          2HH2      ARG  59  -5.934  -9.203 -19.938
  478    H    TYR  60           H        TYR  60  -4.043  -4.446 -13.951
  479    HA   TYR  60           HA       TYR  60  -5.256  -6.873 -12.842
  480   1HB   TYR  60          2HB       TYR  60  -3.056  -7.181 -11.705
  481   2HB   TYR  60          1HB       TYR  60  -2.965  -7.094 -13.456
  482    HD1  TYR  60           HD1      TYR  60  -0.492  -6.688 -12.783
  483    HD2  TYR  60           HD2      TYR  60  -3.628  -3.841 -12.068
  484    HE1  TYR  60           HE1      TYR  60   1.192  -4.884 -12.629
  485    HE2  TYR  60           HE2      TYR  60  -1.927  -2.039 -11.917
  486    HH   TYR  60           HH       TYR  60   1.352  -2.502 -12.830
  487    H    PHE  61           H        PHE  61  -6.063  -4.000 -11.995
  488    HA   PHE  61           HA       PHE  61  -5.894  -4.612  -9.072
  489   1HB   PHE  61          2HB       PHE  61  -5.626  -1.980 -10.505
  490   2HB   PHE  61          1HB       PHE  61  -6.213  -2.039  -8.843
  491    HD1  PHE  61           HD1      PHE  61  -4.744  -3.598  -7.206
  492    HD2  PHE  61           HD2      PHE  61  -3.361  -1.835 -10.854
  493    HE1  PHE  61           HE1      PHE  61  -2.408  -3.787  -6.425
  494    HE2  PHE  61           HE2      PHE  61  -1.028  -2.013 -10.069
  495    HZ   PHE  61           HZ       PHE  61  -0.556  -2.984  -7.840
  496    H    ILE  62           H        ILE  62  -7.875  -5.336  -8.548
  497    HA   ILE  62           HA       ILE  62 -10.242  -4.354 -10.000
  498    HB   ILE  62           HB       ILE  62 -11.421  -6.137  -9.029
  499   1HG1  ILE  62          2HG1      ILE  62  -9.322  -6.095  -6.839
  500   2HG1  ILE  62          1HG1      ILE  62 -11.022  -5.647  -6.684
  501   1HG2  ILE  62          1HG2      ILE  62 -10.190  -7.873  -9.821
  502   2HG2  ILE  62          2HG2      ILE  62  -8.856  -7.550  -8.714
  503   3HG2  ILE  62          3HG2      ILE  62  -8.995  -6.637 -10.216
  504   1HD1  ILE  62          1HD1      ILE  62 -10.705  -7.911  -5.823
  505   2HD1  ILE  62          2HD1      ILE  62  -9.949  -8.407  -7.338
  506   3HD1  ILE  62          3HD1      ILE  62 -11.658  -7.976  -7.305
  507    H    LYS  63           H        LYS  63 -12.216  -3.753  -8.576
  508    HA   LYS  63           HA       LYS  63 -11.377  -2.268  -6.137
  509   1HB   LYS  63          2HB       LYS  63 -11.598  -0.922  -8.468
  510   2HB   LYS  63          1HB       LYS  63 -13.279  -0.869  -7.939
  511   1HG   LYS  63          2HG       LYS  63 -12.131  -0.215  -5.615
  512   2HG   LYS  63          1HG       LYS  63 -10.861   0.362  -6.696
  513   1HD   LYS  63          2HD       LYS  63 -12.207   1.983  -7.644
  514   2HD   LYS  63          1HD       LYS  63 -13.689   1.069  -7.357
  515   1HE   LYS  63          2HE       LYS  63 -13.658   1.610  -5.011
  516   2HE   LYS  63          1HE       LYS  63 -12.045   2.310  -5.138
  517   1HZ   LYS  63          1HZ       LYS  63 -13.149   4.220  -5.403
  518   2HZ   LYS  63          2HZ       LYS  63 -14.608   3.450  -5.808
  519   3HZ   LYS  63          3HZ       LYS  63 -13.414   3.691  -6.992
  520    H    VAL  64           H        VAL  64 -12.940  -2.239  -4.552
  521    HA   VAL  64           HA       VAL  64 -15.230  -4.011  -4.896
  522    HB   VAL  64           HB       VAL  64 -13.694  -3.418  -2.770
  523   1HG1  VAL  64          1HG1      VAL  64 -16.147  -1.795  -2.138
  524   2HG1  VAL  64          2HG1      VAL  64 -14.736  -1.032  -2.868
  525   3HG1  VAL  64          3HG1      VAL  64 -14.595  -1.830  -1.303
  526   1HG2  VAL  64          1HG2      VAL  64 -15.789  -5.030  -3.195
  527   2HG2  VAL  64          2HG2      VAL  64 -16.560  -3.882  -2.101
  528   3HG2  VAL  64          3HG2      VAL  64 -15.125  -4.766  -1.583
  529    HA   PRO  65           HA       PRO  65 -18.076  -0.884  -6.111
  530   1HB   PRO  65          2HB       PRO  65 -20.404  -2.164  -5.389
  531   2HB   PRO  65          1HB       PRO  65 -19.464  -2.566  -6.836
  532   1HG   PRO  65          2HG       PRO  65 -19.675  -4.055  -4.259
  533   2HG   PRO  65          1HG       PRO  65 -19.305  -4.664  -5.881
  534   1HD   PRO  65          2HD       PRO  65 -17.427  -4.202  -3.825
  535   2HD   PRO  65          1HD       PRO  65 -17.044  -4.468  -5.538
  536    H    ARG  66           H        ARG  66 -19.635   0.645  -5.187
  537    HA   ARG  66           HA       ARG  66 -19.014   1.371  -2.464
  538   1HB   ARG  66          2HB       ARG  66 -19.957   2.748  -4.599
  539   2HB   ARG  66          1HB       ARG  66 -21.460   2.499  -3.710
  540   1HG   ARG  66          2HG       ARG  66 -20.229   3.339  -1.643
  541   2HG   ARG  66          1HG       ARG  66 -18.934   3.842  -2.728
  542   1HD   ARG  66          2HD       ARG  66 -21.088   4.890  -4.018
  543   2HD   ARG  66          1HD       ARG  66 -21.630   5.005  -2.344
  544    HE   ARG  66           HE       ARG  66 -18.935   5.982  -2.575
  545   1HH1  ARG  66          1HH2      ARG  66 -21.518   7.152  -1.249
  546   2HH1  ARG  66          2HH2      ARG  66 -21.608   8.668  -2.079
  547   1HH2  ARG  66          1HH1      ARG  66 -19.343   7.763  -4.541
  548   2HH2  ARG  66          2HH1      ARG  66 -20.379   9.015  -3.943
  549    H    SER  67           H        SER  67 -21.719   2.201  -1.688
  550    HA   SER  67           HA       SER  67 -22.593  -0.392  -0.565
  551   1HB   SER  67          2HB       SER  67 -22.310   1.703   0.849
  552   2HB   SER  67          1HB       SER  67 -23.715   2.361   0.017
  553    HG   SER  67           HG       SER  67 -24.049  -0.201   0.965
  554    H    GLN  68           H        GLN  68 -23.079   0.234  -3.409
  555    HA   GLN  68           HA       GLN  68 -26.008   0.675  -3.497
  556   1HB   GLN  68          2HB       GLN  68 -23.808   0.974  -5.386
  557   2HB   GLN  68          1HB       GLN  68 -25.131   0.039  -6.080
  558   1HG   GLN  68          2HG       GLN  68 -26.700   1.853  -5.233
  559   2HG   GLN  68          1HG       GLN  68 -25.263   2.813  -4.880
  560   1HE2  GLN  68          1HE2      GLN  68 -25.509   4.403  -6.541
  561   2HE2  GLN  68          2HE2      GLN  68 -25.474   4.025  -8.195
  562    H    GLU  69           H        GLU  69 -24.185  -1.862  -2.715
  563    HA   GLU  69           HA       GLU  69 -25.948  -3.798  -4.161
  564   1HB   GLU  69          2HB       GLU  69 -23.221  -3.701  -4.339
  565   2HB   GLU  69          1HB       GLU  69 -23.434  -4.827  -2.997
  566   1HG   GLU  69          2HG       GLU  69 -23.677  -6.370  -4.659
  567   2HG   GLU  69          1HG       GLU  69 -25.326  -5.750  -4.725
  568    H    GLU  70           H        GLU  70 -26.126  -5.915  -2.810
  569    HA   GLU  70           HA       GLU  70 -27.097  -5.142  -0.170
  570   1HB   GLU  70          2HB       GLU  70 -27.253  -7.546  -1.909
  571   2HB   GLU  70          1HB       GLU  70 -27.377  -7.826  -0.171
  572   1HG   GLU  70          2HG       GLU  70 -29.597  -7.395  -0.655
  573   2HG   GLU  70          1HG       GLU  70 -29.043  -5.753  -0.321
  574    HA   PRO  71           HA       PRO  71 -23.538  -8.005   1.235
  575   1HB   PRO  71          2HB       PRO  71 -21.730  -8.810  -0.672
  576   2HB   PRO  71          1HB       PRO  71 -23.188  -9.727  -0.254
  577   1HG   PRO  71          2HG       PRO  71 -22.638  -8.076  -2.672
  578   2HG   PRO  71          1HG       PRO  71 -23.746  -9.443  -2.477
  579   1HD   PRO  71          2HD       PRO  71 -24.464  -6.703  -2.516
  580   2HD   PRO  71          1HD       PRO  71 -25.508  -8.053  -2.028
  581    H    GLY  72           H        GLY  72 -22.933  -5.573  -1.214
  582   1HA   GLY  72          2HA       GLY  72 -20.223  -4.939  -0.527
  583   2HA   GLY  72          1HA       GLY  72 -21.351  -3.843  -1.330
  584    H    LYS  73           H        LYS  73 -19.839  -2.517   0.341
  585    HA   LYS  73           HA       LYS  73 -21.643  -1.592   2.400
  586   1HB   LYS  73          2HB       LYS  73 -20.322  -3.784   3.241
  587   2HB   LYS  73          1HB       LYS  73 -19.108  -2.562   3.626
  588   1HG   LYS  73          2HG       LYS  73 -20.706  -1.313   4.959
  589   2HG   LYS  73          1HG       LYS  73 -22.013  -2.393   4.472
  590   1HD   LYS  73          2HD       LYS  73 -20.028  -4.093   5.480
  591   2HD   LYS  73          1HD       LYS  73 -20.056  -2.726   6.594
  592   1HE   LYS  73          2HE       LYS  73 -21.780  -3.905   7.534
  593   2HE   LYS  73          1HE       LYS  73 -22.714  -3.100   6.273
  594   1HZ   LYS  73          1HZ       LYS  73 -22.424  -5.005   4.853
  595   2HZ   LYS  73          2HZ       LYS  73 -23.096  -5.502   6.332
  596   3HZ   LYS  73          3HZ       LYS  73 -21.450  -5.774   6.009
  597    H    GLY  74           H        GLY  74 -18.070  -1.752   2.252
  598   1HA   GLY  74          2HA       GLY  74 -18.094   1.224   1.937
  599   2HA   GLY  74          1HA       GLY  74 -16.883   0.372   2.894
  600    H    SER  75           H        SER  75 -15.321   1.476   1.426
  601    HA   SER  75           HA       SER  75 -15.190   0.241  -1.286
  602   1HB   SER  75          2HB       SER  75 -13.260   2.366  -0.601
  603   2HB   SER  75          1HB       SER  75 -14.259   2.177  -2.039
  604    HG   SER  75           HG       SER  75 -14.665   3.881  -0.187
  605    H    PHE  76           H        PHE  76 -13.010  -0.468  -2.016
  606    HA   PHE  76           HA       PHE  76 -10.874  -0.817  -0.094
  607   1HB   PHE  76          2HB       PHE  76 -12.889  -2.626   0.271
  608   2HB   PHE  76          1HB       PHE  76 -11.867  -3.486  -0.882
  609    HD1  PHE  76           HD1      PHE  76 -11.903  -1.799   2.432
  610    HD2  PHE  76           HD2      PHE  76  -9.736  -4.350  -0.255
  611    HE1  PHE  76           HE1      PHE  76 -10.307  -2.356   4.248
  612    HE2  PHE  76           HE2      PHE  76  -8.139  -4.908   1.560
  613    HZ   PHE  76           HZ       PHE  76  -8.426  -3.911   3.812
  614    H    TRP  77           H        TRP  77  -9.127  -0.667  -1.396
  615    HA   TRP  77           HA       TRP  77  -9.316  -1.380  -4.244
  616   1HB   TRP  77          2HB       TRP  77  -7.489   0.159  -2.513
  617   2HB   TRP  77          1HB       TRP  77  -6.678  -0.761  -3.781
  618    HD1  TRP  77           HD1      TRP  77  -8.110   2.487  -3.262
  619    HE1  TRP  77           HE1      TRP  77  -8.810   3.600  -5.475
  620    HE3  TRP  77           HE3      TRP  77  -8.021  -1.576  -6.351
  621    HZ2  TRP  77           HZ2      TRP  77  -9.262   2.860  -8.203
  622    HZ3  TRP  77           HZ3      TRP  77  -8.593  -1.344  -8.751
  623    HH2  TRP  77           HH2      TRP  77  -9.217   0.868  -9.680
  624    H    ARG  78           H        ARG  78  -8.068  -3.072  -5.229
  625    HA   ARG  78           HA       ARG  78  -6.324  -4.725  -3.568
  626   1HB   ARG  78          2HB       ARG  78  -7.800  -6.802  -4.145
  627   2HB   ARG  78          1HB       ARG  78  -8.233  -5.796  -2.770
  628   1HG   ARG  78          2HG       ARG  78  -9.397  -4.776  -5.227
  629   2HG   ARG  78          1HG       ARG  78  -9.884  -6.443  -4.919
  630   1HD   ARG  78          2HD       ARG  78 -10.523  -5.793  -2.599
  631   2HD   ARG  78          1HD       ARG  78 -10.136  -4.118  -2.991
  632    HE   ARG  78           HE       ARG  78 -12.002  -4.155  -4.615
  633   1HH1  ARG  78          1HH2      ARG  78 -12.711  -5.303  -1.714
  634   2HH1  ARG  78          2HH2      ARG  78 -13.901  -6.471  -2.185
  635   1HH2  ARG  78          1HH1      ARG  78 -13.096  -6.317  -5.555
  636   2HH2  ARG  78          2HH1      ARG  78 -14.119  -7.044  -4.361
  637    H    ILE  79           H        ILE  79  -5.167  -6.282  -4.777
  638    HA   ILE  79           HA       ILE  79  -5.303  -5.897  -7.751
  639    HB   ILE  79           HB       ILE  79  -3.132  -5.479  -6.317
  640   1HG1  ILE  79          2HG1      ILE  79  -3.147  -7.144  -8.850
  641   2HG1  ILE  79          1HG1      ILE  79  -3.341  -5.390  -8.780
  642   1HG2  ILE  79          1HG2      ILE  79  -2.659  -8.363  -6.955
  643   2HG2  ILE  79          2HG2      ILE  79  -3.439  -7.945  -5.429
  644   3HG2  ILE  79          3HG2      ILE  79  -1.829  -7.323  -5.798
  645   1HD1  ILE  79          1HD1      ILE  79  -1.007  -6.050  -9.284
  646   2HD1  ILE  79          2HD1      ILE  79  -0.937  -6.903  -7.741
  647   3HD1  ILE  79          3HD1      ILE  79  -1.136  -5.154  -7.774
  648    H    ASP  80           H        ASP  80  -5.864  -7.671  -8.984
  649    HA   ASP  80           HA       ASP  80  -7.098  -9.896  -7.719
  650   1HB   ASP  80          2HB       ASP  80  -6.790  -9.018 -10.354
  651   2HB   ASP  80          1HB       ASP  80  -6.001 -10.596 -10.327
  652    HA   PRO  81           HA       PRO  81  -3.626 -12.314  -6.527
  653   1HB   PRO  81          2HB       PRO  81  -4.934 -14.722  -6.252
  654   2HB   PRO  81          1HB       PRO  81  -5.051 -13.405  -5.070
  655   1HG   PRO  81          2HG       PRO  81  -7.055 -14.289  -7.103
  656   2HG   PRO  81          1HG       PRO  81  -7.317 -13.507  -5.535
  657   1HD   PRO  81          2HD       PRO  81  -7.429 -12.218  -8.036
  658   2HD   PRO  81          1HD       PRO  81  -7.280 -11.404  -6.464
  659    H    ALA  82           H        ALA  82  -5.839 -13.720  -8.934
  660    HA   ALA  82           HA       ALA  82  -3.593 -15.150 -10.220
  661   1HB   ALA  82          1HB       ALA  82  -5.442 -15.900 -11.804
  662   2HB   ALA  82          2HB       ALA  82  -6.575 -15.044 -10.760
  663   3HB   ALA  82          3HB       ALA  82  -5.648 -16.404 -10.127
  664    H    SER  83           H        SER  83  -4.318 -12.065 -10.116
  665    HA   SER  83           HA       SER  83  -4.798 -11.287 -12.832
  666   1HB   SER  83          2HB       SER  83  -4.088  -9.915 -10.350
  667   2HB   SER  83          1HB       SER  83  -3.247  -9.241 -11.739
  668    HG   SER  83           HG       SER  83  -5.421  -9.325 -12.762
  669    H    GLU  84           H        GLU  84  -1.768 -11.688 -10.975
  670    HA   GLU  84           HA       GLU  84  -0.381 -12.620 -13.249
  671   1HB   GLU  84          2HB       GLU  84  -0.866 -10.017 -13.599
  672   2HB   GLU  84          1HB       GLU  84   0.670  -9.952 -12.763
  673   1HG   GLU  84          2HG       GLU  84   1.825 -10.855 -14.502
  674   2HG   GLU  84          1HG       GLU  84   0.527 -11.986 -14.884
  675    H    ALA  85           H        ALA  85   0.479 -14.097 -11.751
  676    HA   ALA  85           HA       ALA  85   1.827 -13.462  -9.350
  677   1HB   ALA  85          1HB       ALA  85   2.685 -15.606  -9.453
  678   2HB   ALA  85          2HB       ALA  85   3.140 -15.453 -11.150
  679   3HB   ALA  85          3HB       ALA  85   1.461 -15.776 -10.712
  680    H    LYS  86           H        LYS  86   2.582 -12.695 -12.633
  681    HA   LYS  86           HA       LYS  86   5.400 -12.084 -12.093
  682   1HB   LYS  86          2HB       LYS  86   4.061 -12.751 -14.380
  683   2HB   LYS  86          1HB       LYS  86   4.112 -10.993 -14.525
  684   1HG   LYS  86          2HG       LYS  86   6.633 -12.296 -13.661
  685   2HG   LYS  86          1HG       LYS  86   6.139 -12.599 -15.327
  686   1HD   LYS  86          2HD       LYS  86   6.448  -9.870 -14.041
  687   2HD   LYS  86          1HD       LYS  86   7.563 -10.595 -15.201
  688   1HE   LYS  86          2HE       LYS  86   5.067 -10.806 -16.434
  689   2HE   LYS  86          1HE       LYS  86   5.042  -9.211 -15.682
  690   1HZ   LYS  86          1HZ       LYS  86   7.027 -10.279 -17.605
  691   2HZ   LYS  86          2HZ       LYS  86   7.293  -8.867 -16.698
  692   3HZ   LYS  86          3HZ       LYS  86   6.003  -8.942 -17.801
  693    H    LEU  87           H        LEU  87   2.313 -10.322 -12.599
  694    HA   LEU  87           HA       LEU  87   3.406  -7.707 -12.541
  695   1HB   LEU  87          2HB       LEU  87   1.239  -6.845 -11.909
  696   2HB   LEU  87          1HB       LEU  87   0.968  -8.189 -13.000
  697    HG   LEU  87           HG       LEU  87   0.803  -9.594 -10.784
  698   1HD1  LEU  87          1HD1      LEU  87   1.311  -8.159  -9.068
  699   2HD1  LEU  87          2HD1      LEU  87  -0.447  -8.039  -9.119
  700   3HD1  LEU  87          3HD1      LEU  87   0.548  -6.788  -9.866
  701   1HD2  LEU  87          1HD2      LEU  87  -1.065  -8.534 -12.481
  702   2HD2  LEU  87          2HD2      LEU  87  -1.562  -7.871 -10.925
  703   3HD2  LEU  87          3HD2      LEU  87  -1.439  -9.614 -11.136
  704    H    VAL  88           H        VAL  88   2.807  -9.964 -10.039
  705    HA   VAL  88           HA       VAL  88   3.350  -8.065  -7.889
  706    HB   VAL  88           HB       VAL  88   3.287 -10.122  -6.524
  707   1HG1  VAL  88          1HG1      VAL  88   1.201  -8.837  -7.194
  708   2HG1  VAL  88          2HG1      VAL  88   0.920 -10.534  -6.807
  709   3HG1  VAL  88          3HG1      VAL  88   0.989 -10.014  -8.491
  710   1HG2  VAL  88          1HG2      VAL  88   4.216 -11.514  -8.432
  711   2HG2  VAL  88          2HG2      VAL  88   2.587 -11.503  -9.108
  712   3HG2  VAL  88          3HG2      VAL  88   2.889 -12.245  -7.538
  713    H    GLU  89           H        GLU  89   5.098 -10.460  -9.770
  714    HA   GLU  89           HA       GLU  89   7.369 -10.812  -8.118
  715   1HB   GLU  89          2HB       GLU  89   7.158 -12.163 -10.107
  716   2HB   GLU  89          1HB       GLU  89   7.126 -10.732 -11.140
  717   1HG   GLU  89          2HG       GLU  89   9.390 -10.485 -11.081
  718   2HG   GLU  89          1HG       GLU  89   9.489 -10.928  -9.376
  719    H    GLN  90           H        GLN  90   6.736  -8.359 -10.628
  720    HA   GLN  90           HA       GLN  90   9.166  -6.893 -10.201
  721   1HB   GLN  90          2HB       GLN  90   6.597  -6.471 -11.605
  722   2HB   GLN  90          1HB       GLN  90   7.376  -4.991 -11.044
  723   1HG   GLN  90          2HG       GLN  90   8.882  -7.124 -12.565
  724   2HG   GLN  90          1HG       GLN  90   8.043  -5.802 -13.379
  725   1HE2  GLN  90          1HE2      GLN  90   9.494  -4.164 -13.878
  726   2HE2  GLN  90          2HE2      GLN  90  10.778  -3.659 -12.889
  727    H    ALA  91           H        ALA  91   6.156  -7.107  -8.500
  728    HA   ALA  91           HA       ALA  91   6.299  -4.626  -7.081
  729   1HB   ALA  91          1HB       ALA  91   4.975  -6.364  -5.392
  730   2HB   ALA  91          2HB       ALA  91   4.655  -7.014  -7.001
  731   3HB   ALA  91          3HB       ALA  91   4.233  -5.345  -6.623
  732    H    PHE  92           H        PHE  92   7.341  -7.917  -6.218
  733    HA   PHE  92           HA       PHE  92   8.290  -7.330  -3.618
  734   1HB   PHE  92          2HB       PHE  92   9.619  -9.303  -5.478
  735   2HB   PHE  92          1HB       PHE  92   9.447  -9.401  -3.726
  736    HD1  PHE  92           HD1      PHE  92   6.589  -8.534  -3.456
  737    HD2  PHE  92           HD2      PHE  92   8.458 -11.259  -6.200
  738    HE1  PHE  92           HE1      PHE  92   4.437  -9.732  -3.731
  739    HE2  PHE  92           HE2      PHE  92   6.305 -12.458  -6.476
  740    HZ   PHE  92           HZ       PHE  92   4.295 -11.694  -5.241
  741    H    ARG  93           H        ARG  93  10.037  -7.162  -6.744
  742    HA   ARG  93           HA       ARG  93  12.088  -5.515  -5.314
  743   1HB   ARG  93          2HB       ARG  93  13.702  -6.436  -7.082
  744   2HB   ARG  93          1HB       ARG  93  13.196  -7.560  -5.821
  745   1HG   ARG  93          2HG       ARG  93  12.093  -8.887  -7.290
  746   2HG   ARG  93          1HG       ARG  93  11.387  -7.509  -8.135
  747   1HD   ARG  93          2HD       ARG  93  13.380  -7.173  -9.431
  748   2HD   ARG  93          1HD       ARG  93  14.286  -8.322  -8.447
  749    HE   ARG  93           HE       ARG  93  12.485  -8.997 -10.633
  750   1HH1  ARG  93          1HH2      ARG  93  11.259 -10.556  -8.485
  751   2HH1  ARG  93          2HH2      ARG  93  12.221 -11.994  -8.429
  752   1HH2  ARG  93          1HH1      ARG  93  14.862 -10.615 -10.205
  753   2HH2  ARG  93          2HH1      ARG  93  14.261 -12.028  -9.403
  754    H    LYS  94           H        LYS  94  12.892  -3.719  -6.461
  755    HA   LYS  94           HA       LYS  94  11.580  -3.142  -9.082
  756   1HB   LYS  94          2HB       LYS  94  10.954  -1.861  -6.703
  757   2HB   LYS  94          1HB       LYS  94  12.112  -0.767  -7.460
  758   1HG   LYS  94          2HG       LYS  94   9.688  -1.921  -8.869
  759   2HG   LYS  94          1HG       LYS  94   9.735  -0.319  -8.133
  760   1HD   LYS  94          2HD       LYS  94  11.677   0.252  -9.597
  761   2HD   LYS  94          1HD       LYS  94  11.504  -1.316 -10.386
  762   1HE   LYS  94          2HE       LYS  94   9.132  -0.689 -10.949
  763   2HE   LYS  94          1HE       LYS  94   9.468   0.927 -10.328
  764   1HZ   LYS  94          1HZ       LYS  94  10.704   1.449 -12.107
  765   2HZ   LYS  94          2HZ       LYS  94   9.856   0.188 -12.865
  766   3HZ   LYS  94          3HZ       LYS  94  11.403  -0.092 -12.223
  767    H    ARG  95           H        ARG  95  13.988  -1.618  -6.909
  768    HA   ARG  95           HA       ARG  95  16.254  -2.172  -8.533
  769   1HB   ARG  95          2HB       ARG  95  16.507   0.269  -9.394
  770   2HB   ARG  95          1HB       ARG  95  15.437  -0.816 -10.281
  771   1HG   ARG  95          2HG       ARG  95  13.487   0.100  -9.167
  772   2HG   ARG  95          1HG       ARG  95  14.504   1.078  -8.109
  773   1HD   ARG  95          2HD       ARG  95  13.617   2.448  -9.951
  774   2HD   ARG  95          1HD       ARG  95  15.370   2.300 -10.079
  775    HE   ARG  95           HE       ARG  95  14.805   0.383 -11.747
  776   1HH1  ARG  95          1HH1      ARG  95  13.484   3.513 -11.489
  777   2HH1  ARG  95          2HH1      ARG  95  12.483   3.372 -12.895
  778   1HH2  ARG  95          1HH2      ARG  95  13.238   0.027 -13.420
  779   2HH2  ARG  95          2HH2      ARG  95  12.342   1.397 -13.989
  780    H    ARG  96           H        ARG  96  18.154  -1.314  -7.567
  781    HA   ARG  96           HA       ARG  96  18.000   0.796  -5.565
  782   1HB   ARG  96          2HB       ARG  96  17.755  -2.019  -4.769
  783   2HB   ARG  96          1HB       ARG  96  19.070  -1.175  -3.951
  784   1HG   ARG  96          2HG       ARG  96  16.650   0.454  -4.117
  785   2HG   ARG  96          1HG       ARG  96  16.380  -1.059  -3.249
  786   1HD   ARG  96          2HD       ARG  96  17.349  -0.110  -1.451
  787   2HD   ARG  96          1HD       ARG  96  18.871  -0.125  -2.341
  788    HE   ARG  96           HE       ARG  96  17.310   2.166  -3.104
  789   1HH1  ARG  96          1HH1      ARG  96  17.516   1.656   0.045
  790   2HH1  ARG  96          2HH1      ARG  96  18.746   2.818   0.414
  791   1HH2  ARG  96          1HH2      ARG  96  19.635   3.322  -2.902
  792   2HH2  ARG  96          2HH2      ARG  96  19.947   3.762  -1.256
  793    H    GLN  97           H        GLN  97  19.596   1.147  -7.518
  794    HA   GLN  97           HA       GLN  97  22.290   0.228  -6.600
  795   1HB   GLN  97          2HB       GLN  97  21.069  -0.451  -9.025
  796   2HB   GLN  97          1HB       GLN  97  22.179   0.855  -9.444
  797   1HG   GLN  97          2HG       GLN  97  24.025  -0.398  -8.990
  798   2HG   GLN  97          1HG       GLN  97  23.282  -1.157  -7.583
  799   1HE2  GLN  97          1HE2      GLN  97  21.403  -2.770  -8.229
  800   2HE2  GLN  97          2HE2      GLN  97  21.715  -3.761  -9.571
  801    H    ARG  98           H        ARG  98  23.952   1.812  -6.779
  802    HA   ARG  98           HA       ARG  98  23.068   4.529  -7.646
  803   1HB   ARG  98          2HB       ARG  98  23.455   3.735  -4.968
  804   2HB   ARG  98          1HB       ARG  98  24.884   4.678  -5.396
  805   1HG   ARG  98          2HG       ARG  98  22.522   5.943  -6.471
  806   2HG   ARG  98          1HG       ARG  98  22.320   5.668  -4.740
  807   1HD   ARG  98          2HD       ARG  98  24.301   6.885  -4.215
  808   2HD   ARG  98          1HD       ARG  98  24.833   6.889  -5.896
  809    HE   ARG  98           HE       ARG  98  22.293   8.206  -5.688
  810   1HH1  ARG  98          1HH1      ARG  98  25.453   8.572  -4.411
  811   2HH1  ARG  98          2HH1      ARG  98  25.532  10.275  -4.713
  812   1HH2  ARG  98          1HH2      ARG  98  22.458  10.399  -6.317
  813   2HH2  ARG  98          2HH2      ARG  98  23.834  11.310  -5.792
  814    H    GLY  99           H        GLY  99  25.807   2.408  -6.806
  815   1HA   GLY  99          2HA       GLY  99  27.325   3.555  -9.051
  816   2HA   GLY  99          1HA       GLY  99  28.028   3.830  -7.458
  817    H    VAL 100           H        VAL 100  27.617   1.478  -6.144
  818    HA   VAL 100           HA       VAL 100  28.447  -0.754  -7.887
  819    HB   VAL 100           HB       VAL 100  30.504  -1.188  -6.619
  820   1HG1  VAL 100          1HG1      VAL 100  30.348   1.665  -7.642
  821   2HG1  VAL 100          2HG1      VAL 100  30.639   0.236  -8.633
  822   3HG1  VAL 100          3HG1      VAL 100  31.828   0.731  -7.429
  823   1HG2  VAL 100          1HG2      VAL 100  31.255   0.193  -4.855
  824   2HG2  VAL 100          2HG2      VAL 100  29.526   0.030  -4.544
  825   3HG2  VAL 100          3HG2      VAL 100  30.153   1.499  -5.292
  826    H    SER 101           HN       SER 101  26.196  -0.077  -6.043
  827    HA   SER 101           HA       SER 101  24.907  -1.180  -4.420
  828   1HB   SER 101          2HB       SER 101  26.795  -3.401  -5.238
  829   2HB   SER 101          1HB       SER 101  25.460  -3.641  -4.115
  830    HG   SER 101           HG       SER 101  25.332  -2.738  -6.806
  Start of MODEL    7
    1   1H    GLU   1          1HT       GLU   1  17.873  11.070  -8.271
    2   2H    GLU   1          2HT       GLU   1  16.220  11.363  -8.009
    3   3H    GLU   1          3HT       GLU   1  16.719  10.415  -9.328
    4    HA   GLU   1           HA       GLU   1  16.671   8.579  -8.118
    5   1HB   GLU   1          2HB       GLU   1  18.066   8.406  -6.069
    6   2HB   GLU   1          1HB       GLU   1  18.957   9.128  -7.409
    7   1HG   GLU   1          2HG       GLU   1  18.546  11.368  -6.521
    8   2HG   GLU   1          1HG       GLU   1  17.565  10.695  -5.220
    9    H    SER   2           H        SER   2  14.381   9.977  -7.957
   10    HA   SER   2           HA       SER   2  13.670  10.374  -5.116
   11   1HB   SER   2          2HB       SER   2  11.983  10.653  -7.621
   12   2HB   SER   2          1HB       SER   2  11.509  11.148  -5.999
   13    HG   SER   2           HG       SER   2  13.948  12.102  -6.913
   14    H    LYS   3           H        LYS   3  11.958   8.681  -7.768
   15    HA   LYS   3           HA       LYS   3  11.630   6.358  -5.921
   16   1HB   LYS   3          2HB       LYS   3   9.412   7.297  -7.743
   17   2HB   LYS   3          1HB       LYS   3   9.311   6.193  -6.371
   18   1HG   LYS   3          2HG       LYS   3   8.726   7.966  -5.108
   19   2HG   LYS   3          1HG       LYS   3  10.379   8.552  -5.303
   20   1HD   LYS   3          2HD       LYS   3   9.714   9.727  -7.376
   21   2HD   LYS   3          1HD       LYS   3   8.056   9.161  -7.156
   22   1HE   LYS   3          2HE       LYS   3   8.100  10.288  -4.875
   23   2HE   LYS   3          1HE       LYS   3   9.618  11.039  -5.368
   24   1HZ   LYS   3          1HZ       LYS   3   8.037  12.587  -5.983
   25   2HZ   LYS   3          2HZ       LYS   3   6.917  11.414  -6.488
   26   3HZ   LYS   3          3HZ       LYS   3   8.291  11.743  -7.432
   27    HA   PRO   4           HA       PRO   4  12.980   5.308 -10.272
   28   1HB   PRO   4          2HB       PRO   4  15.453   4.297  -9.585
   29   2HB   PRO   4          1HB       PRO   4  15.147   5.965 -10.102
   30   1HG   PRO   4          2HG       PRO   4  15.689   4.920  -7.361
   31   2HG   PRO   4          1HG       PRO   4  16.003   6.527  -8.033
   32   1HD   PRO   4          2HD       PRO   4  13.854   5.871  -6.329
   33   2HD   PRO   4          1HD       PRO   4  13.976   7.338  -7.325
   34    HA   PRO   5           HA       PRO   5  13.285   0.852  -8.498
   35   1HB   PRO   5          2HB       PRO   5  12.453   0.503  -5.905
   36   2HB   PRO   5          1HB       PRO   5  14.143   0.763  -6.358
   37   1HG   PRO   5          2HG       PRO   5  12.225   2.663  -5.094
   38   2HG   PRO   5          1HG       PRO   5  13.993   2.613  -4.985
   39   1HD   PRO   5          2HD       PRO   5  12.494   4.382  -6.593
   40   2HD   PRO   5          1HD       PRO   5  14.233   4.059  -6.733
   41    H    TYR   6           H        TYR   6  10.834   2.121  -6.252
   42    HA   TYR   6           HA       TYR   6   8.768   0.468  -7.496
   43   1HB   TYR   6          2HB       TYR   6   8.764   2.430  -5.202
   44   2HB   TYR   6          1HB       TYR   6   7.312   1.593  -5.752
   45    HD1  TYR   6           HD1      TYR   6  10.059  -0.501  -6.437
   46    HD2  TYR   6           HD2      TYR   6   7.608   0.874  -3.185
   47    HE1  TYR   6           HE1      TYR   6  10.702  -2.493  -5.107
   48    HE2  TYR   6           HE2      TYR   6   8.254  -1.120  -1.855
   49    HH   TYR   6           HH       TYR   6  10.622  -3.466  -3.099
   50    H    SER   7           H        SER   7   7.155   1.143  -8.813
   51    HA   SER   7           HA       SER   7   7.310   3.965  -9.766
   52   1HB   SER   7          2HB       SER   7   7.075   1.405 -11.078
   53   2HB   SER   7          1HB       SER   7   5.701   2.426 -11.503
   54    HG   SER   7           HG       SER   7   7.782   2.613 -12.750
   55    H    TYR   8           H        TYR   8   4.796   4.085 -10.997
   56    HA   TYR   8           HA       TYR   8   3.057   4.144  -8.587
   57   1HB   TYR   8          2HB       TYR   8   3.014   5.617 -11.220
   58   2HB   TYR   8          1HB       TYR   8   1.618   5.609 -10.141
   59    HD1  TYR   8           HD1      TYR   8   1.492   7.609  -8.950
   60    HD2  TYR   8           HD2      TYR   8   5.327   5.770  -9.548
   61    HE1  TYR   8           HE1      TYR   8   2.553   9.353  -7.549
   62    HE2  TYR   8           HE2      TYR   8   6.383   7.512  -8.145
   63    HH   TYR   8           HH       TYR   8   5.564  10.142  -7.552
   64    H    ALA   9           H        ALA   9   3.278   1.663  -9.328
   65    HA   ALA   9           HA       ALA   9   0.660   0.770  -9.978
   66   1HB   ALA   9          1HB       ALA   9   1.022  -0.186 -12.202
   67   2HB   ALA   9          2HB       ALA   9   2.666   0.450 -12.234
   68   3HB   ALA   9          3HB       ALA   9   1.292   1.555 -12.266
   69    H    GLN  10           H        GLN  10   4.115   0.102 -10.174
   70    HA   GLN  10           HA       GLN  10   3.782  -2.727  -9.390
   71   1HB   GLN  10          2HB       GLN  10   5.656  -2.267 -10.856
   72   2HB   GLN  10          1HB       GLN  10   6.196  -0.934  -9.837
   73   1HG   GLN  10          2HG       GLN  10   6.053  -3.159  -8.123
   74   2HG   GLN  10          1HG       GLN  10   6.793  -3.757  -9.606
   75   1HE2  GLN  10          1HE2      GLN  10   8.811  -2.689 -10.335
   76   2HE2  GLN  10          2HE2      GLN  10   9.754  -1.800  -9.238
   77    H    LEU  11           H        LEU  11   4.465   0.423  -8.114
   78    HA   LEU  11           HA       LEU  11   5.408  -0.272  -5.510
   79   1HB   LEU  11          2HB       LEU  11   5.584   2.005  -6.283
   80   2HB   LEU  11          1HB       LEU  11   3.857   2.086  -6.619
   81    HG   LEU  11           HG       LEU  11   4.007   1.372  -3.921
   82   1HD1  LEU  11          1HD1      LEU  11   6.438   2.025  -4.089
   83   2HD1  LEU  11          2HD1      LEU  11   5.513   2.986  -2.935
   84   3HD1  LEU  11          3HD1      LEU  11   5.909   3.652  -4.520
   85   1HD2  LEU  11          1HD2      LEU  11   2.526   3.014  -5.288
   86   2HD2  LEU  11          2HD2      LEU  11   3.766   4.209  -4.912
   87   3HD2  LEU  11          3HD2      LEU  11   2.876   3.420  -3.609
   88    H    ILE  12           H        ILE  12   2.218   0.110  -6.961
   89    HA   ILE  12           HA       ILE  12   0.680  -0.307  -4.544
   90    HB   ILE  12           HB       ILE  12  -0.329  -1.208  -7.206
   91   1HG1  ILE  12          2HG1      ILE  12   0.475   0.765  -8.116
   92   2HG1  ILE  12          1HG1      ILE  12  -1.013   1.371  -7.408
   93   1HG2  ILE  12          1HG2      ILE  12  -2.042   0.588  -5.815
   94   2HG2  ILE  12          2HG2      ILE  12  -1.385  -0.564  -4.652
   95   3HG2  ILE  12          3HG2      ILE  12  -2.244  -1.143  -6.080
   96   1HD1  ILE  12          1HD1      ILE  12   0.333   2.888  -6.393
   97   2HD1  ILE  12          2HD1      ILE  12   1.780   1.920  -6.668
   98   3HD1  ILE  12          3HD1      ILE  12   0.733   1.567  -5.297
   99    H    VAL  13           H        VAL  13   1.533  -2.416  -7.281
  100    HA   VAL  13           HA       VAL  13   0.459  -4.825  -6.334
  101    HB   VAL  13           HB       VAL  13   3.051  -4.361  -7.842
  102   1HG1  VAL  13          1HG1      VAL  13   1.363  -6.855  -7.483
  103   2HG1  VAL  13          2HG1      VAL  13   3.003  -6.607  -6.887
  104   3HG1  VAL  13          3HG1      VAL  13   2.703  -6.706  -8.620
  105   1HG2  VAL  13          1HG2      VAL  13   1.651  -4.771  -9.823
  106   2HG2  VAL  13          2HG2      VAL  13   1.009  -3.420  -8.892
  107   3HG2  VAL  13          3HG2      VAL  13   0.240  -5.000  -8.792
  108    H    GLN  14           H        GLN  14   3.260  -3.036  -5.283
  109    HA   GLN  14           HA       GLN  14   4.414  -5.211  -3.720
  110   1HB   GLN  14          2HB       GLN  14   4.867  -2.257  -4.002
  111   2HB   GLN  14          1HB       GLN  14   5.505  -3.073  -2.573
  112   1HG   GLN  14          2HG       GLN  14   5.989  -4.367  -5.216
  113   2HG   GLN  14          1HG       GLN  14   6.910  -2.909  -4.847
  114   1HE2  GLN  14          1HE2      GLN  14   7.383  -3.142  -2.120
  115   2HE2  GLN  14          2HE2      GLN  14   8.279  -4.546  -1.800
  116    H    ALA  15           H        ALA  15   2.276  -2.476  -3.177
  117    HA   ALA  15           HA       ALA  15   2.039  -2.659  -0.353
  118   1HB   ALA  15          1HB       ALA  15   0.299  -1.117  -0.568
  119   2HB   ALA  15          2HB       ALA  15  -0.253  -1.803  -2.096
  120   3HB   ALA  15          3HB       ALA  15   1.223  -0.838  -2.044
  121    H    ILE  16           H        ILE  16  -0.153  -4.050  -2.893
  122    HA   ILE  16           HA       ILE  16  -1.575  -5.463  -0.740
  123    HB   ILE  16           HB       ILE  16  -2.750  -6.548  -2.833
  124   1HG1  ILE  16          2HG1      ILE  16  -2.785  -5.039  -4.728
  125   2HG1  ILE  16          1HG1      ILE  16  -1.602  -3.990  -3.992
  126   1HG2  ILE  16          1HG2      ILE  16  -4.303  -4.643  -2.827
  127   2HG2  ILE  16          2HG2      ILE  16  -3.077  -3.639  -2.055
  128   3HG2  ILE  16          3HG2      ILE  16  -3.764  -5.012  -1.188
  129   1HD1  ILE  16          1HD1      ILE  16  -0.848  -6.844  -4.241
  130   2HD1  ILE  16          2HD1      ILE  16   0.122  -5.396  -4.516
  131   3HD1  ILE  16          3HD1      ILE  16  -0.994  -5.955  -5.755
  132    H    SER  17           H        SER  17   0.842  -6.335  -3.163
  133    HA   SER  17           HA       SER  17   0.522  -9.175  -2.964
  134   1HB   SER  17          2HB       SER  17   2.037  -7.871  -4.581
  135   2HB   SER  17          1HB       SER  17   3.184  -7.764  -3.255
  136    HG   SER  17           HG       SER  17   2.078 -10.260  -3.814
  137    H    SER  18           H        SER  18   1.851  -6.719  -0.982
  138    HA   SER  18           HA       SER  18   3.014  -8.707   0.905
  139   1HB   SER  18          2HB       SER  18   4.529  -6.929   0.607
  140   2HB   SER  18          1HB       SER  18   3.249  -5.722   0.584
  141    HG   SER  18           HG       SER  18   4.526  -6.960   2.714
  142    H    ALA  19           H        ALA  19   0.179  -6.826   0.394
  143    HA   ALA  19           HA       ALA  19  -0.592  -6.324   3.104
  144   1HB   ALA  19          1HB       ALA  19  -2.911  -6.247   2.191
  145   2HB   ALA  19          2HB       ALA  19  -2.307  -6.894   0.666
  146   3HB   ALA  19          3HB       ALA  19  -1.781  -5.304   1.220
  147    H    GLN  20           H        GLN  20  -2.435  -7.545   4.213
  148    HA   GLN  20           HA       GLN  20  -1.747 -10.136   4.911
  149   1HB   GLN  20          2HB       GLN  20  -4.430  -8.761   4.803
  150   2HB   GLN  20          1HB       GLN  20  -4.300 -10.435   5.344
  151   1HG   GLN  20          2HG       GLN  20  -3.614  -9.741   7.369
  152   2HG   GLN  20          1HG       GLN  20  -2.240  -8.920   6.629
  153   1HE2  GLN  20          1HE2      GLN  20  -4.629  -8.232   8.712
  154   2HE2  GLN  20          2HE2      GLN  20  -4.991  -6.632   8.272
  155    H    ASP  21           H        ASP  21  -4.775  -9.929   3.105
  156    HA   ASP  21           HA       ASP  21  -4.143 -12.407   1.701
  157   1HB   ASP  21          2HB       ASP  21  -6.477 -11.617   2.446
  158   2HB   ASP  21          1HB       ASP  21  -6.430 -10.530   1.061
  159    H    ARG  22           H        ARG  22  -5.277  -9.339   0.298
  160    HA   ARG  22           HA       ARG  22  -2.992  -8.783  -1.289
  161   1HB   ARG  22          2HB       ARG  22  -4.875 -10.810  -2.374
  162   2HB   ARG  22          1HB       ARG  22  -4.388  -9.535  -3.491
  163   1HG   ARG  22          2HG       ARG  22  -2.345 -10.444  -3.739
  164   2HG   ARG  22          1HG       ARG  22  -2.101 -10.491  -1.992
  165   1HD   ARG  22          2HD       ARG  22  -3.910 -12.516  -2.331
  166   2HD   ARG  22          1HD       ARG  22  -2.980 -12.631  -3.825
  167    HE   ARG  22           HE       ARG  22  -2.054 -13.505  -1.295
  168   1HH1  ARG  22          1HH1      ARG  22  -0.814 -13.732  -4.150
  169   2HH1  ARG  22          2HH1      ARG  22   0.752 -13.057  -3.845
  170   1HH2  ARG  22          1HH2      ARG  22  -0.144 -11.675  -0.795
  171   2HH2  ARG  22          2HH2      ARG  22   1.131 -11.893  -1.947
  172    H    GLN  23           H        GLN  23  -5.243  -7.529   0.202
  173    HA   GLN  23           HA       GLN  23  -6.126  -5.687  -1.964
  174   1HB   GLN  23          2HB       GLN  23  -8.298  -5.537  -0.470
  175   2HB   GLN  23          1HB       GLN  23  -8.128  -6.825  -1.662
  176   1HG   GLN  23          2HG       GLN  23  -7.792  -8.450  -0.068
  177   2HG   GLN  23          1HG       GLN  23  -7.018  -7.333   1.057
  178   1HE2  GLN  23          1HE2      GLN  23  -8.398  -7.761   2.876
  179   2HE2  GLN  23          2HE2      GLN  23 -10.054  -7.386   2.877
  180    H    LEU  24           H        LEU  24  -6.003  -3.544  -1.412
  181    HA   LEU  24           HA       LEU  24  -5.431  -2.888   1.445
  182   1HB   LEU  24          2HB       LEU  24  -4.109  -1.923  -1.095
  183   2HB   LEU  24          1HB       LEU  24  -4.086  -0.948   0.368
  184    HG   LEU  24           HG       LEU  24  -3.110  -3.809   0.188
  185   1HD1  LEU  24          1HD1      LEU  24  -0.902  -2.445   0.757
  186   2HD1  LEU  24          2HD1      LEU  24  -1.767  -1.144  -0.061
  187   3HD1  LEU  24          3HD1      LEU  24  -1.430  -2.651  -0.912
  188   1HD2  LEU  24          1HD2      LEU  24  -3.532  -1.862   2.399
  189   2HD2  LEU  24          2HD2      LEU  24  -2.030  -2.783   2.445
  190   3HD2  LEU  24          3HD2      LEU  24  -3.580  -3.624   2.429
  191    H    THR  25           H        THR  25  -6.304  -0.841   2.138
  192    HA   THR  25           HA       THR  25  -8.718  -0.052   0.679
  193    HB   THR  25           HB       THR  25  -8.560   1.814   2.601
  194    HG1  THR  25           HG1      THR  25  -7.545   0.549   4.409
  195   1HG2  THR  25          1HG2      THR  25  -9.120  -0.905   3.664
  196   2HG2  THR  25          2HG2      THR  25 -10.023  -0.417   2.230
  197   3HG2  THR  25          3HG2      THR  25 -10.120   0.547   3.703
  198    H    LEU  26           H        LEU  26  -8.966   2.521   0.463
  199    HA   LEU  26           HA       LEU  26  -7.125   3.355  -1.529
  200   1HB   LEU  26          2HB       LEU  26  -9.491   4.322  -0.809
  201   2HB   LEU  26          1HB       LEU  26  -8.499   5.418   0.155
  202    HG   LEU  26           HG       LEU  26  -7.938   4.932  -2.772
  203   1HD1  LEU  26          1HD1      LEU  26 -10.328   5.842  -2.137
  204   2HD1  LEU  26          2HD1      LEU  26  -9.399   6.635  -3.409
  205   3HD1  LEU  26          3HD1      LEU  26  -9.454   7.333  -1.790
  206   1HD2  LEU  26          1HD2      LEU  26  -6.123   5.982  -1.607
  207   2HD2  LEU  26          2HD2      LEU  26  -7.217   7.054  -0.734
  208   3HD2  LEU  26          3HD2      LEU  26  -6.963   7.274  -2.465
  209    H    SER  27           H        SER  27  -7.247   4.099   1.951
  210    HA   SER  27           HA       SER  27  -4.599   5.431   1.727
  211   1HB   SER  27          2HB       SER  27  -6.434   5.209   4.120
  212   2HB   SER  27          1HB       SER  27  -5.014   6.239   3.979
  213    HG   SER  27           HG       SER  27  -7.383   6.362   2.412
  214    H    GLY  28           H        GLY  28  -4.901   2.500   1.487
  215   1HA   GLY  28          2HA       GLY  28  -3.636   1.573   4.028
  216   2HA   GLY  28          1HA       GLY  28  -4.317   0.513   2.790
  217    H    ILE  29           H        ILE  29  -3.232   1.653   0.547
  218    HA   ILE  29           HA       ILE  29  -0.715   0.433   0.279
  219    HB   ILE  29           HB       ILE  29  -2.235   1.111  -1.539
  220   1HG1  ILE  29          2HG1      ILE  29   0.530   2.308  -1.708
  221   2HG1  ILE  29          1HG1      ILE  29   0.102   0.636  -2.072
  222   1HG2  ILE  29          1HG2      ILE  29  -2.837   3.242  -1.939
  223   2HG2  ILE  29          2HG2      ILE  29  -1.216   3.854  -1.617
  224   3HG2  ILE  29          3HG2      ILE  29  -2.317   3.524  -0.283
  225   1HD1  ILE  29          1HD1      ILE  29   0.157   2.623  -3.924
  226   2HD1  ILE  29          2HD1      ILE  29  -1.540   2.655  -3.450
  227   3HD1  ILE  29          3HD1      ILE  29  -0.824   1.168  -4.071
  228    H    TYR  30           H        TYR  30  -1.606   3.615   1.324
  229    HA   TYR  30           HA       TYR  30   1.013   4.801   1.138
  230   1HB   TYR  30          2HB       TYR  30  -1.261   5.628   2.947
  231   2HB   TYR  30          1HB       TYR  30   0.046   6.646   2.332
  232    HD1  TYR  30           HD1      TYR  30  -3.157   6.700   1.936
  233    HD2  TYR  30           HD2      TYR  30   0.196   5.524  -0.463
  234    HE1  TYR  30           HE1      TYR  30  -4.472   7.133  -0.119
  235    HE2  TYR  30           HE2      TYR  30  -1.109   5.960  -2.518
  236    HH   TYR  30           HH       TYR  30  -4.358   7.375  -2.357
  237    H    ALA  31           H        ALA  31  -0.833   3.482   3.893
  238    HA   ALA  31           HA       ALA  31   1.385   3.811   5.730
  239   1HB   ALA  31          1HB       ALA  31  -1.355   3.035   5.886
  240   2HB   ALA  31          2HB       ALA  31  -0.252   3.381   7.216
  241   3HB   ALA  31          3HB       ALA  31  -0.396   1.736   6.596
  242    H    HIS  32           H        HIS  32   0.638   1.533   3.274
  243    HA   HIS  32           HA       HIS  32   2.030  -0.729   4.474
  244   1HB   HIS  32          2HB       HIS  32   0.241  -1.006   2.772
  245   2HB   HIS  32          1HB       HIS  32   1.284  -0.231   1.579
  246    HD1  HIS  32           HD1      HIS  32   0.395  -3.486   2.754
  247    HD2  HIS  32           HD2      HIS  32   3.961  -1.732   1.498
  248    HE1  HIS  32           HE1      HIS  32   1.964  -5.383   2.176
  249    H    ILE  33           H        ILE  33   2.803   1.050   1.464
  250    HA   ILE  33           HA       ILE  33   5.514   0.194   1.377
  251    HB   ILE  33           HB       ILE  33   5.832   2.078  -0.220
  252   1HG1  ILE  33          2HG1      ILE  33   3.370   3.141  -0.665
  253   2HG1  ILE  33          1HG1      ILE  33   3.313   2.945   1.087
  254   1HG2  ILE  33          1HG2      ILE  33   3.285   1.221  -1.235
  255   2HG2  ILE  33          2HG2      ILE  33   4.051  -0.130  -0.399
  256   3HG2  ILE  33          3HG2      ILE  33   4.894   0.684  -1.716
  257   1HD1  ILE  33          1HD1      ILE  33   4.243   5.116   0.705
  258   2HD1  ILE  33          2HD1      ILE  33   5.330   4.506  -0.541
  259   3HD1  ILE  33          3HD1      ILE  33   5.602   4.085   1.149
  260    H    THR  34           H        THR  34   4.100   3.184   2.749
  261    HA   THR  34           HA       THR  34   6.545   4.449   3.415
  262    HB   THR  34           HB       THR  34   5.258   5.668   5.119
  263    HG1  THR  34           HG1      THR  34   2.950   4.913   5.204
  264   1HG2  THR  34          1HG2      THR  34   3.825   5.082   2.524
  265   2HG2  THR  34          2HG2      THR  34   4.886   6.442   2.890
  266   3HG2  THR  34          3HG2      THR  34   3.294   6.339   3.641
  267    H    LYS  35           H        LYS  35   5.039   1.638   4.737
  268    HA   LYS  35           HA       LYS  35   6.589   1.735   7.237
  269   1HB   LYS  35          2HB       LYS  35   4.204   0.531   6.505
  270   2HB   LYS  35          1HB       LYS  35   5.334  -0.822   6.553
  271   1HG   LYS  35          2HG       LYS  35   6.080   0.419   8.818
  272   2HG   LYS  35          1HG       LYS  35   4.396   0.942   8.762
  273   1HD   LYS  35          2HD       LYS  35   3.650  -1.385   8.580
  274   2HD   LYS  35          1HD       LYS  35   5.326  -1.938   8.559
  275   1HE   LYS  35          2HE       LYS  35   4.374  -2.173  10.816
  276   2HE   LYS  35          1HE       LYS  35   5.665  -0.972  10.812
  277   1HZ   LYS  35          1HZ       LYS  35   3.666  -0.241  12.017
  278   2HZ   LYS  35          2HZ       LYS  35   2.774  -0.339  10.576
  279   3HZ   LYS  35          3HZ       LYS  35   4.048   0.776  10.715
  280    H    HIS  36           H        HIS  36   6.576  -0.131   4.197
  281    HA   HIS  36           HA       HIS  36   9.103  -1.444   5.065
  282   1HB   HIS  36          2HB       HIS  36   7.039  -2.069   2.966
  283   2HB   HIS  36          1HB       HIS  36   8.653  -2.773   2.868
  284    HD1  HIS  36           HD1      HIS  36   9.391  -4.340   4.862
  285    HD2  HIS  36           HD2      HIS  36   5.395  -3.158   4.977
  286    HE1  HIS  36           HE1      HIS  36   8.246  -5.849   6.542
  287    H    TYR  37           H        TYR  37   8.594   1.405   3.823
  288    HA   TYR  37           HA       TYR  37  10.856   1.167   1.895
  289   1HB   TYR  37          2HB       TYR  37   8.183   1.824   1.210
  290   2HB   TYR  37          1HB       TYR  37   9.112   3.318   1.104
  291    HD1  TYR  37           HD1      TYR  37   9.260   3.579  -1.261
  292    HD2  TYR  37           HD2      TYR  37  10.378  -0.133   0.581
  293    HE1  TYR  37           HE1      TYR  37  10.205   2.796  -3.414
  294    HE2  TYR  37           HE2      TYR  37  11.325  -0.919  -1.567
  295    HH   TYR  37           HH       TYR  37  12.289   0.267  -3.694
  296    HA   PRO  38           HA       PRO  38  12.222   4.402   4.642
  297   1HB   PRO  38          2HB       PRO  38  14.701   4.696   3.493
  298   2HB   PRO  38          1HB       PRO  38  14.289   3.389   4.616
  299   1HG   PRO  38          2HG       PRO  38  14.645   3.278   1.658
  300   2HG   PRO  38          1HG       PRO  38  14.863   1.998   2.863
  301   1HD   PRO  38          2HD       PRO  38  12.622   2.306   1.161
  302   2HD   PRO  38          1HD       PRO  38  12.714   1.249   2.587
  303    H    TYR  39           H        TYR  39  12.761   4.668   1.110
  304    HA   TYR  39           HA       TYR  39  13.171   7.481   1.032
  305   1HB   TYR  39          2HB       TYR  39  13.602   6.009  -0.904
  306   2HB   TYR  39          1HB       TYR  39  11.870   5.709  -1.059
  307    HD1  TYR  39           HD1      TYR  39  14.450   8.403  -1.126
  308    HD2  TYR  39           HD2      TYR  39  10.459   7.232  -2.201
  309    HE1  TYR  39           HE1      TYR  39  14.207  10.470  -2.473
  310    HE2  TYR  39           HE2      TYR  39  10.217   9.299  -3.550
  311    HH   TYR  39           HH       TYR  39  11.537  11.794  -3.340
  312    H    TYR  40           H        TYR  40  10.206   5.563   1.109
  313    HA   TYR  40           HA       TYR  40   8.545   7.980   0.787
  314   1HB   TYR  40          2HB       TYR  40   8.120   5.060   0.729
  315   2HB   TYR  40          1HB       TYR  40   6.819   5.967   1.502
  316    HD1  TYR  40           HD1      TYR  40   7.618   4.580  -1.491
  317    HD2  TYR  40           HD2      TYR  40   6.548   8.420   0.112
  318    HE1  TYR  40           HE1      TYR  40   6.777   5.276  -3.718
  319    HE2  TYR  40           HE2      TYR  40   5.708   9.115  -2.116
  320    HH   TYR  40           HH       TYR  40   5.314   8.490  -4.209
  321    H    ARG  41           H        ARG  41   9.838   8.700   2.884
  322    HA   ARG  41           HA       ARG  41   8.054   8.068   5.187
  323   1HB   ARG  41          2HB       ARG  41  11.032   7.804   5.032
  324   2HB   ARG  41          1HB       ARG  41  10.321   8.368   6.545
  325   1HG   ARG  41          2HG       ARG  41   8.670   6.287   6.005
  326   2HG   ARG  41          1HG       ARG  41  10.156   5.700   5.256
  327   1HD   ARG  41          2HD       ARG  41  10.776   5.049   7.330
  328   2HD   ARG  41          1HD       ARG  41  11.036   6.761   7.666
  329    HE   ARG  41           HE       ARG  41   8.270   6.123   8.069
  330   1HH1  ARG  41          1HH1      ARG  41  11.339   6.457   9.502
  331   2HH1  ARG  41          2HH1      ARG  41  10.832   5.936  11.074
  332   1HH2  ARG  41          1HH2      ARG  41   7.627   5.094  10.052
  333   2HH2  ARG  41          2HH2      ARG  41   8.731   5.165  11.385
  334    H    THR  42           H        THR  42   8.979  10.389   3.160
  335    HA   THR  42           HA       THR  42   8.326  12.522   5.024
  336    HB   THR  42           HB       THR  42  10.971  13.044   3.801
  337    HG1  THR  42           HG1      THR  42  11.861  11.362   4.649
  338   1HG2  THR  42          1HG2      THR  42   9.362  14.273   5.633
  339   2HG2  THR  42          2HG2      THR  42  11.098  14.552   5.496
  340   3HG2  THR  42          3HG2      THR  42  10.480  13.409   6.687
  341    H    ALA  43           H        ALA  43   7.461  11.444   2.405
  342    HA   ALA  43           HA       ALA  43   7.120  13.976   1.043
  343   1HB   ALA  43          1HB       ALA  43   8.989  11.911  -0.149
  344   2HB   ALA  43          2HB       ALA  43   9.343  13.602   0.206
  345   3HB   ALA  43          3HB       ALA  43   8.234  13.190  -1.101
  346    H    ASP  44           H        ASP  44   4.905  13.431   1.083
  347    HA   ASP  44           HA       ASP  44   4.145  11.273  -0.819
  348   1HB   ASP  44          2HB       ASP  44   2.266  10.662   0.751
  349   2HB   ASP  44          1HB       ASP  44   3.872  10.258   1.360
  350    H    LYS  45           H        LYS  45   4.189  14.342  -0.718
  351    HA   LYS  45           HA       LYS  45   1.305  14.950  -0.924
  352   1HB   LYS  45          2HB       LYS  45   2.032  17.269  -1.236
  353   2HB   LYS  45          1HB       LYS  45   2.854  16.572   0.161
  354   1HG   LYS  45          2HG       LYS  45   4.900  16.431  -0.939
  355   2HG   LYS  45          1HG       LYS  45   4.152  16.374  -2.536
  356   1HD   LYS  45          2HD       LYS  45   3.373  18.781  -2.077
  357   2HD   LYS  45          1HD       LYS  45   4.520  18.771  -0.736
  358   1HE   LYS  45          2HE       LYS  45   5.996  17.733  -2.848
  359   2HE   LYS  45          1HE       LYS  45   5.026  18.994  -3.609
  360   1HZ   LYS  45          1HZ       LYS  45   6.139  19.768  -1.073
  361   2HZ   LYS  45          2HZ       LYS  45   6.151  20.588  -2.561
  362   3HZ   LYS  45          3HZ       LYS  45   7.319  19.400  -2.234
  363    H    GLY  46           H        GLY  46   1.992  13.084  -2.831
  364   1HA   GLY  46          2HA       GLY  46   1.337  14.497  -5.283
  365   2HA   GLY  46          1HA       GLY  46   2.990  13.875  -5.300
  366    H    TRP  47           H        TRP  47   2.958  11.431  -4.311
  367    HA   TRP  47           HA       TRP  47   1.405   9.921  -6.243
  368   1HB   TRP  47          2HB       TRP  47   2.558   7.997  -5.439
  369   2HB   TRP  47          1HB       TRP  47   3.725   9.315  -5.382
  370    HD1  TRP  47           HD1      TRP  47   3.736  10.636  -2.847
  371    HE1  TRP  47           HE1      TRP  47   3.811   9.493  -0.539
  372    HE3  TRP  47           HE3      TRP  47   1.980   6.001  -4.090
  373    HZ2  TRP  47           HZ2      TRP  47   3.218   6.954   0.624
  374    HZ3  TRP  47           HZ3      TRP  47   1.751   4.244  -2.364
  375    HH2  TRP  47           HH2      TRP  47   2.365   4.717  -0.015
  376    H    GLN  48           H        GLN  48   0.467  11.296  -3.408
  377    HA   GLN  48           HA       GLN  48  -0.987   9.176  -2.138
  378   1HB   GLN  48          2HB       GLN  48  -0.469  11.737  -1.471
  379   2HB   GLN  48          1HB       GLN  48  -2.113  11.929  -2.074
  380   1HG   GLN  48          2HG       GLN  48  -2.070  11.439   0.363
  381   2HG   GLN  48          1HG       GLN  48  -2.907  10.183  -0.548
  382   1HE2  GLN  48          1HE2      GLN  48   0.579  10.313  -0.825
  383   2HE2  GLN  48          2HE2      GLN  48   0.904   8.958   0.144
  384    H    ASN  49           H        ASN  49  -2.307  11.844  -4.140
  385    HA   ASN  49           HA       ASN  49  -4.770  10.396  -4.649
  386   1HB   ASN  49          2HB       ASN  49  -5.161  12.255  -6.314
  387   2HB   ASN  49          1HB       ASN  49  -4.827  12.811  -4.674
  388   1HD2  ASN  49          1HD2      ASN  49  -3.817  14.825  -5.246
  389   2HD2  ASN  49          2HD2      ASN  49  -2.353  14.905  -6.100
  390    H    SER  50           H        SER  50  -1.639  10.354  -6.054
  391    HA   SER  50           HA       SER  50  -2.411   9.589  -8.738
  392   1HB   SER  50          2HB       SER  50   0.201   8.790  -7.485
  393   2HB   SER  50          1HB       SER  50  -0.127   9.292  -9.139
  394    HG   SER  50           HG       SER  50   0.902  10.919  -7.847
  395    H    ILE  51           H        ILE  51  -1.874   7.831  -5.740
  396    HA   ILE  51           HA       ILE  51  -1.670   5.218  -6.956
  397    HB   ILE  51           HB       ILE  51  -1.625   6.365  -4.300
  398   1HG1  ILE  51          2HG1      ILE  51  -0.171   4.509  -3.883
  399   2HG1  ILE  51          1HG1      ILE  51  -0.873   3.588  -5.211
  400   1HG2  ILE  51          1HG2      ILE  51  -3.902   5.177  -4.203
  401   2HG2  ILE  51          2HG2      ILE  51  -2.713   4.697  -3.001
  402   3HG2  ILE  51          3HG2      ILE  51  -3.003   3.672  -4.406
  403   1HD1  ILE  51          1HD1      ILE  51   1.415   4.875  -5.544
  404   2HD1  ILE  51          2HD1      ILE  51   0.351   6.257  -5.807
  405   3HD1  ILE  51          3HD1      ILE  51   0.218   4.832  -6.839
  406    H    ARG  52           H        ARG  52  -4.408   6.958  -5.427
  407    HA   ARG  52           HA       ARG  52  -6.311   4.864  -5.839
  408   1HB   ARG  52          2HB       ARG  52  -8.013   6.707  -5.616
  409   2HB   ARG  52          1HB       ARG  52  -6.829   6.665  -4.311
  410   1HG   ARG  52          2HG       ARG  52  -6.589   8.880  -4.786
  411   2HG   ARG  52          1HG       ARG  52  -5.559   8.290  -6.089
  412   1HD   ARG  52          2HD       ARG  52  -7.388   9.948  -6.766
  413   2HD   ARG  52          1HD       ARG  52  -7.321   8.447  -7.688
  414    HE   ARG  52           HE       ARG  52  -9.177   8.562  -5.375
  415   1HH1  ARG  52          1HH2      ARG  52  -9.463   9.991  -8.274
  416   2HH1  ARG  52          2HH2      ARG  52 -10.693   8.958  -8.921
  417   1HH2  ARG  52          1HH1      ARG  52 -10.391   6.583  -6.413
  418   2HH2  ARG  52          2HH1      ARG  52 -11.219   7.029  -7.867
  419    H    HIS  53           H        HIS  53  -5.228   7.519  -7.910
  420    HA   HIS  53           HA       HIS  53  -7.245   7.049  -9.944
  421   1HB   HIS  53          2HB       HIS  53  -6.005   9.221  -9.598
  422   2HB   HIS  53          1HB       HIS  53  -4.572   8.438 -10.265
  423    HD1  HIS  53           HD1      HIS  53  -5.105   7.229 -12.737
  424    HD2  HIS  53           HD2      HIS  53  -7.538  10.405 -11.561
  425    HE1  HIS  53           HE1      HIS  53  -6.228   8.089 -14.839
  426    H    ASN  54           H        ASN  54  -3.974   5.863  -9.343
  427    HA   ASN  54           HA       ASN  54  -3.569   4.691 -11.944
  428   1HB   ASN  54          2HB       ASN  54  -2.305   4.455  -9.255
  429   2HB   ASN  54          1HB       ASN  54  -2.023   3.129 -10.390
  430   1HD2  ASN  54          1HD2      ASN  54  -0.660   5.982  -9.407
  431   2HD2  ASN  54          2HD2      ASN  54   0.114   6.446 -10.845
  432    H    LEU  55           H        LEU  55  -4.810   3.390  -8.874
  433    HA   LEU  55           HA       LEU  55  -5.123   0.702  -9.647
  434   1HB   LEU  55          2HB       LEU  55  -6.921   2.370  -7.868
  435   2HB   LEU  55          1HB       LEU  55  -6.874   0.607  -7.908
  436    HG   LEU  55           HG       LEU  55  -4.501   2.375  -7.262
  437   1HD1  LEU  55          1HD1      LEU  55  -4.888   1.959  -4.983
  438   2HD1  LEU  55          2HD1      LEU  55  -5.963   0.600  -5.318
  439   3HD1  LEU  55          3HD1      LEU  55  -6.510   2.251  -5.608
  440   1HD2  LEU  55          1HD2      LEU  55  -4.705  -0.333  -8.075
  441   2HD2  LEU  55          2HD2      LEU  55  -4.364  -0.357  -6.345
  442   3HD2  LEU  55          3HD2      LEU  55  -3.279   0.491  -7.446
  443    H    SER  56           H        SER  56  -6.786   3.485 -10.811
  444    HA   SER  56           HA       SER  56  -9.101   1.917 -11.771
  445   1HB   SER  56          2HB       SER  56  -8.339   4.831 -11.839
  446   2HB   SER  56          1HB       SER  56  -9.623   4.219 -12.877
  447    HG   SER  56           HG       SER  56 -10.740   4.599 -11.104
  448    H    LEU  57           H        LEU  57  -6.171   3.454 -13.030
  449    HA   LEU  57           HA       LEU  57  -6.887   2.718 -15.793
  450   1HB   LEU  57          2HB       LEU  57  -4.803   3.852 -16.395
  451   2HB   LEU  57          1HB       LEU  57  -5.751   4.873 -15.316
  452    HG   LEU  57           HG       LEU  57  -4.368   3.722 -13.422
  453   1HD1  LEU  57          1HD1      LEU  57  -3.046   2.087 -14.317
  454   2HD1  LEU  57          2HD1      LEU  57  -1.961   3.437 -14.653
  455   3HD1  LEU  57          3HD1      LEU  57  -3.034   2.833 -15.915
  456   1HD2  LEU  57          1HD2      LEU  57  -4.246   6.133 -14.361
  457   2HD2  LEU  57          2HD2      LEU  57  -2.820   5.575 -15.235
  458   3HD2  LEU  57          3HD2      LEU  57  -2.844   5.536 -13.472
  459    H    ASN  58           H        ASN  58  -5.671   1.041 -13.222
  460    HA   ASN  58           HA       ASN  58  -3.612  -0.431 -14.752
  461   1HB   ASN  58          2HB       ASN  58  -4.471  -0.327 -11.900
  462   2HB   ASN  58          1HB       ASN  58  -3.808  -1.855 -12.477
  463   1HD2  ASN  58          1HD2      ASN  58  -2.954   1.284 -11.375
  464   2HD2  ASN  58          2HD2      ASN  58  -1.312   1.234 -11.796
  465    H    ARG  59           H        ARG  59  -3.837  -2.645 -15.338
  466    HA   ARG  59           HA       ARG  59  -6.648  -3.446 -15.738
  467   1HB   ARG  59          2HB       ARG  59  -5.705  -5.191 -17.208
  468   2HB   ARG  59          1HB       ARG  59  -5.112  -3.589 -17.643
  469   1HG   ARG  59          2HG       ARG  59  -3.043  -4.011 -16.355
  470   2HG   ARG  59          1HG       ARG  59  -3.630  -5.625 -15.952
  471   1HD   ARG  59          2HD       ARG  59  -3.115  -6.449 -18.003
  472   2HD   ARG  59          1HD       ARG  59  -3.732  -5.018 -18.828
  473    HE   ARG  59           HE       ARG  59  -1.188  -4.579 -17.449
  474   1HH1  ARG  59          1HH2      ARG  59  -1.262  -6.849 -19.645
  475   2HH1  ARG  59          2HH2      ARG  59  -0.608  -5.961 -20.981
  476   1HH2  ARG  59          1HH1      ARG  59  -1.006  -2.869 -19.466
  477   2HH2  ARG  59          2HH1      ARG  59  -0.464  -3.710 -20.879
  478    H    TYR  60           H        TYR  60  -4.232  -4.066 -13.418
  479    HA   TYR  60           HA       TYR  60  -5.441  -6.730 -12.819
  480   1HB   TYR  60          2HB       TYR  60  -3.407  -6.615 -11.062
  481   2HB   TYR  60          1HB       TYR  60  -3.210  -7.220 -12.701
  482    HD1  TYR  60           HD1      TYR  60  -3.275  -3.859 -10.960
  483    HD2  TYR  60           HD2      TYR  60  -1.404  -6.421 -13.855
  484    HE1  TYR  60           HE1      TYR  60  -1.614  -2.094 -11.470
  485    HE2  TYR  60           HE2      TYR  60   0.253  -4.659 -14.360
  486    HH   TYR  60           HH       TYR  60   1.156  -2.696 -13.523
  487    H    PHE  61           H        PHE  61  -4.990  -3.489 -11.553
  488    HA   PHE  61           HA       PHE  61  -5.892  -4.247  -8.887
  489   1HB   PHE  61          2HB       PHE  61  -5.413  -1.578 -10.218
  490   2HB   PHE  61          1HB       PHE  61  -5.991  -1.736  -8.553
  491    HD1  PHE  61           HD1      PHE  61  -3.101  -1.323 -10.422
  492    HD2  PHE  61           HD2      PHE  61  -4.657  -3.739  -7.233
  493    HE1  PHE  61           HE1      PHE  61  -0.806  -1.834  -9.695
  494    HE2  PHE  61           HE2      PHE  61  -2.364  -4.246  -6.501
  495    HZ   PHE  61           HZ       PHE  61  -0.427  -3.290  -7.716
  496    H    ILE  62           H        ILE  62  -7.874  -5.066  -8.860
  497    HA   ILE  62           HA       ILE  62 -10.072  -3.790 -10.371
  498    HB   ILE  62           HB       ILE  62 -11.342  -5.732  -9.869
  499   1HG1  ILE  62          2HG1      ILE  62  -9.327  -6.243  -7.655
  500   2HG1  ILE  62          1HG1      ILE  62 -11.012  -5.765  -7.446
  501   1HG2  ILE  62          1HG2      ILE  62 -10.049  -7.343 -10.877
  502   2HG2  ILE  62          2HG2      ILE  62  -8.690  -7.084  -9.784
  503   3HG2  ILE  62          3HG2      ILE  62  -8.968  -5.972 -11.126
  504   1HD1  ILE  62          1HD1      ILE  62 -10.074  -8.376  -7.514
  505   2HD1  ILE  62          2HD1      ILE  62 -10.718  -8.135  -9.137
  506   3HD1  ILE  62          3HD1      ILE  62 -11.753  -7.883  -7.733
  507    H    LYS  63           H        LYS  63 -12.203  -3.568  -9.037
  508    HA   LYS  63           HA       LYS  63 -11.529  -2.330  -6.398
  509   1HB   LYS  63          2HB       LYS  63 -12.641  -1.099  -8.658
  510   2HB   LYS  63          1HB       LYS  63 -14.007  -1.366  -7.576
  511   1HG   LYS  63          2HG       LYS  63 -12.830  -0.246  -5.751
  512   2HG   LYS  63          1HG       LYS  63 -11.397  -0.053  -6.763
  513   1HD   LYS  63          2HD       LYS  63 -12.238   1.810  -7.707
  514   2HD   LYS  63          1HD       LYS  63 -13.737   0.978  -8.121
  515   1HE   LYS  63          2HE       LYS  63 -13.602   1.471  -5.268
  516   2HE   LYS  63          1HE       LYS  63 -13.407   2.975  -6.169
  517   1HZ   LYS  63          1HZ       LYS  63 -15.631   1.025  -6.359
  518   2HZ   LYS  63          2HZ       LYS  63 -15.392   2.269  -7.492
  519   3HZ   LYS  63          3HZ       LYS  63 -15.712   2.646  -5.867
  520    H    VAL  64           H        VAL  64 -12.632  -3.157  -4.672
  521    HA   VAL  64           HA       VAL  64 -15.102  -4.740  -5.239
  522    HB   VAL  64           HB       VAL  64 -13.220  -6.284  -4.855
  523   1HG1  VAL  64          1HG1      VAL  64 -11.596  -5.733  -3.401
  524   2HG1  VAL  64          2HG1      VAL  64 -12.754  -5.826  -2.074
  525   3HG1  VAL  64          3HG1      VAL  64 -12.507  -4.300  -2.924
  526   1HG2  VAL  64          1HG2      VAL  64 -14.971  -7.438  -3.976
  527   2HG2  VAL  64          2HG2      VAL  64 -15.552  -6.040  -3.072
  528   3HG2  VAL  64          3HG2      VAL  64 -14.255  -7.036  -2.416
  529    HA   PRO  65           HA       PRO  65 -16.058  -1.688  -1.987
  530   1HB   PRO  65          2HB       PRO  65 -18.560  -1.133  -2.986
  531   2HB   PRO  65          1HB       PRO  65 -17.087  -0.307  -3.523
  532   1HG   PRO  65          2HG       PRO  65 -18.687  -2.394  -4.928
  533   2HG   PRO  65          1HG       PRO  65 -17.647  -1.132  -5.607
  534   1HD   PRO  65          2HD       PRO  65 -16.966  -3.865  -5.320
  535   2HD   PRO  65          1HD       PRO  65 -15.838  -2.540  -5.682
  536    H    ARG  66           H        ARG  66 -18.738  -1.650  -1.118
  537    HA   ARG  66           HA       ARG  66 -19.977  -4.207  -0.895
  538   1HB   ARG  66          2HB       ARG  66 -17.703  -4.497   0.368
  539   2HB   ARG  66          1HB       ARG  66 -18.487  -3.553   1.636
  540   1HG   ARG  66          2HG       ARG  66 -18.907  -5.867   2.136
  541   2HG   ARG  66          1HG       ARG  66 -20.417  -5.192   1.521
  542   1HD   ARG  66          2HD       ARG  66 -20.294  -7.117   0.241
  543   2HD   ARG  66          1HD       ARG  66 -19.429  -5.996  -0.810
  544    HE   ARG  66           HE       ARG  66 -17.322  -6.980  -0.008
  545   1HH1  ARG  66          1HH2      ARG  66 -19.897  -8.998  -0.451
  546   2HH1  ARG  66          2HH2      ARG  66 -19.311 -10.294   0.537
  547   1HH2  ARG  66          1HH1      ARG  66 -16.701  -8.448   1.878
  548   2HH2  ARG  66          2HH1      ARG  66 -17.503  -9.984   1.854
  549    H    SER  67           H        SER  67 -22.027  -3.603  -0.446
  550    HA   SER  67           HA       SER  67 -22.433  -1.283   1.402
  551   1HB   SER  67          2HB       SER  67 -24.482  -2.234  -0.592
  552   2HB   SER  67          1HB       SER  67 -24.334  -0.651   0.164
  553    HG   SER  67           HG       SER  67 -23.159  -0.110  -1.478
  554    H    GLN  68           H        GLN  68 -22.201  -4.290   1.888
  555    HA   GLN  68           HA       GLN  68 -24.904  -4.743   3.075
  556   1HB   GLN  68          2HB       GLN  68 -24.056  -6.475   1.487
  557   2HB   GLN  68          1HB       GLN  68 -22.688  -6.752   2.567
  558   1HG   GLN  68          2HG       GLN  68 -24.041  -7.657   4.257
  559   2HG   GLN  68          1HG       GLN  68 -25.505  -6.909   3.618
  560   1HE2  GLN  68          1HE2      GLN  68 -23.162  -9.543   3.032
  561   2HE2  GLN  68          2HE2      GLN  68 -24.184 -10.446   2.021
  562    H    GLU  69           H        GLU  69 -21.427  -5.220   3.819
  563    HA   GLU  69           HA       GLU  69 -21.965  -5.633   6.645
  564   1HB   GLU  69          2HB       GLU  69 -19.943  -6.474   5.273
  565   2HB   GLU  69          1HB       GLU  69 -19.294  -4.847   5.481
  566   1HG   GLU  69          2HG       GLU  69 -18.405  -5.935   7.343
  567   2HG   GLU  69          1HG       GLU  69 -19.883  -5.244   8.014
  568    H    GLU  70           H        GLU  70 -20.076  -3.044   5.028
  569    HA   GLU  70           HA       GLU  70 -20.154  -1.291   7.278
  570   1HB   GLU  70          2HB       GLU  70 -19.906  -0.536   4.351
  571   2HB   GLU  70          1HB       GLU  70 -19.398   0.439   5.730
  572   1HG   GLU  70          2HG       GLU  70 -17.952  -1.630   6.367
  573   2HG   GLU  70          1HG       GLU  70 -18.196  -2.117   4.689
  574    HA   PRO  71           HA       PRO  71 -24.190   0.412   7.010
  575   1HB   PRO  71          2HB       PRO  71 -23.704   2.838   8.209
  576   2HB   PRO  71          1HB       PRO  71 -23.800   1.309   9.099
  577   1HG   PRO  71          2HG       PRO  71 -21.394   2.926   8.405
  578   2HG   PRO  71          1HG       PRO  71 -21.639   1.797   9.748
  579   1HD   PRO  71          2HD       PRO  71 -20.212   1.256   7.361
  580   2HD   PRO  71          1HD       PRO  71 -20.736   0.057   8.562
  581    H    GLY  72           H        GLY  72 -21.698   1.437   5.087
  582   1HA   GLY  72          2HA       GLY  72 -23.507   3.145   3.493
  583   2HA   GLY  72          1HA       GLY  72 -22.010   3.901   4.049
  584    H    LYS  73           H        LYS  73 -21.656   4.036   1.619
  585    HA   LYS  73           HA       LYS  73 -21.179   1.633   0.099
  586   1HB   LYS  73          2HB       LYS  73 -20.058   3.149  -1.511
  587   2HB   LYS  73          1HB       LYS  73 -21.620   3.792  -0.999
  588   1HG   LYS  73          2HG       LYS  73 -20.366   5.119   0.771
  589   2HG   LYS  73          1HG       LYS  73 -18.876   4.638  -0.041
  590   1HD   LYS  73          2HD       LYS  73 -19.311   5.927  -1.911
  591   2HD   LYS  73          1HD       LYS  73 -21.060   5.814  -1.708
  592   1HE   LYS  73          2HE       LYS  73 -20.934   7.908  -0.858
  593   2HE   LYS  73          1HE       LYS  73 -20.268   7.143   0.585
  594   1HZ   LYS  73          1HZ       LYS  73 -18.505   8.427   0.184
  595   2HZ   LYS  73          2HZ       LYS  73 -18.958   8.737  -1.425
  596   3HZ   LYS  73          3HZ       LYS  73 -18.122   7.310  -1.034
  597    H    GLY  74           H        GLY  74 -19.569   0.221   0.568
  598   1HA   GLY  74          2HA       GLY  74 -17.193   1.125   2.053
  599   2HA   GLY  74          1HA       GLY  74 -17.569  -0.542   1.617
  600    H    SER  75           H        SER  75 -15.077   1.121   1.213
  601    HA   SER  75           HA       SER  75 -14.816   0.581  -1.711
  602   1HB   SER  75          2HB       SER  75 -13.653   2.984  -0.274
  603   2HB   SER  75          1HB       SER  75 -13.493   2.614  -1.989
  604    HG   SER  75           HG       SER  75 -15.560   3.127  -2.306
  605    H    PHE  76           H        PHE  76 -13.464  -1.177  -1.655
  606    HA   PHE  76           HA       PHE  76 -10.941  -0.880  -0.075
  607   1HB   PHE  76          2HB       PHE  76 -12.833  -2.711   0.547
  608   2HB   PHE  76          1HB       PHE  76 -11.928  -3.622  -0.664
  609    HD1  PHE  76           HD1      PHE  76 -12.149  -3.063   2.738
  610    HD2  PHE  76           HD2      PHE  76  -9.221  -3.171  -0.403
  611    HE1  PHE  76           HE1      PHE  76 -10.375  -3.525   4.408
  612    HE2  PHE  76           HE2      PHE  76  -7.447  -3.634   1.267
  613    HZ   PHE  76           HZ       PHE  76  -8.025  -3.812   3.673
  614    H    TRP  77           H        TRP  77  -9.222  -0.800  -1.429
  615    HA   TRP  77           HA       TRP  77  -9.509  -1.555  -4.237
  616   1HB   TRP  77          2HB       TRP  77  -7.553  -0.124  -2.563
  617   2HB   TRP  77          1HB       TRP  77  -6.834  -1.067  -3.870
  618    HD1  TRP  77           HD1      TRP  77  -8.186   2.231  -3.256
  619    HE1  TRP  77           HE1      TRP  77  -8.902   3.386  -5.446
  620    HE3  TRP  77           HE3      TRP  77  -8.197  -1.783  -6.408
  621    HZ2  TRP  77           HZ2      TRP  77  -9.411   2.697  -8.177
  622    HZ3  TRP  77           HZ3      TRP  77  -8.800  -1.508  -8.792
  623    HH2  TRP  77           HH2      TRP  77  -9.400   0.723  -9.679
  624    H    ARG  78           H        ARG  78  -8.380  -3.258  -5.289
  625    HA   ARG  78           HA       ARG  78  -6.686  -5.089  -3.760
  626   1HB   ARG  78          2HB       ARG  78  -9.028  -5.757  -3.115
  627   2HB   ARG  78          1HB       ARG  78  -9.336  -6.098  -4.818
  628   1HG   ARG  78          2HG       ARG  78  -7.584  -7.781  -4.855
  629   2HG   ARG  78          1HG       ARG  78  -7.128  -7.388  -3.198
  630   1HD   ARG  78          2HD       ARG  78  -8.729  -8.736  -2.371
  631   2HD   ARG  78          1HD       ARG  78  -9.963  -7.941  -3.348
  632    HE   ARG  78           HE       ARG  78  -8.310  -9.819  -4.860
  633   1HH1  ARG  78          1HH1      ARG  78  -9.656 -11.227  -2.482
  634   2HH1  ARG  78          2HH1      ARG  78 -11.114 -11.793  -3.227
  635   1HH2  ARG  78          1HH2      ARG  78 -10.811  -9.736  -6.001
  636   2HH2  ARG  78          2HH2      ARG  78 -11.767 -10.950  -5.217
  637    H    ILE  79           H        ILE  79  -5.717  -6.701  -5.157
  638    HA   ILE  79           HA       ILE  79  -5.947  -6.006  -8.059
  639    HB   ILE  79           HB       ILE  79  -3.702  -5.671  -6.944
  640   1HG1  ILE  79          2HG1      ILE  79  -3.170  -7.839  -8.865
  641   2HG1  ILE  79          1HG1      ILE  79  -4.330  -6.640  -9.440
  642   1HG2  ILE  79          1HG2      ILE  79  -4.165  -7.944  -5.630
  643   2HG2  ILE  79          2HG2      ILE  79  -2.524  -7.419  -6.015
  644   3HG2  ILE  79          3HG2      ILE  79  -3.324  -8.630  -7.020
  645   1HD1  ILE  79          1HD1      ILE  79  -2.791  -4.902  -9.345
  646   2HD1  ILE  79          2HD1      ILE  79  -1.741  -6.248  -9.784
  647   3HD1  ILE  79          3HD1      ILE  79  -1.815  -5.699  -8.112
  648    H    ASP  80           H        ASP  80  -5.697  -7.923  -9.551
  649    HA   ASP  80           HA       ASP  80  -7.503 -10.015  -8.800
  650   1HB   ASP  80          2HB       ASP  80  -5.656  -9.557 -11.123
  651   2HB   ASP  80          1HB       ASP  80  -6.430 -11.129 -10.924
  652    HA   PRO  81           HA       PRO  81  -4.763 -12.791  -6.789
  653   1HB   PRO  81          2HB       PRO  81  -6.275 -15.069  -7.067
  654   2HB   PRO  81          1HB       PRO  81  -6.659 -13.775  -5.919
  655   1HG   PRO  81          2HG       PRO  81  -7.997 -14.454  -8.492
  656   2HG   PRO  81          1HG       PRO  81  -8.653 -13.623  -7.073
  657   1HD   PRO  81          2HD       PRO  81  -7.793 -12.395  -9.487
  658   2HD   PRO  81          1HD       PRO  81  -8.189 -11.563  -7.968
  659    H    ALA  82           H        ALA  82  -5.976 -13.576 -10.021
  660    HA   ALA  82           HA       ALA  82  -3.843 -15.574 -10.435
  661   1HB   ALA  82          1HB       ALA  82  -5.246 -14.905 -12.853
  662   2HB   ALA  82          2HB       ALA  82  -6.414 -15.109 -11.547
  663   3HB   ALA  82          3HB       ALA  82  -5.292 -16.412 -11.937
  664    H    SER  83           H        SER  83  -4.408 -12.206 -10.996
  665    HA   SER  83           HA       SER  83  -2.348 -12.044 -13.110
  666   1HB   SER  83          2HB       SER  83  -3.915  -9.871 -11.689
  667   2HB   SER  83          1HB       SER  83  -2.827  -9.606 -13.048
  668    HG   SER  83           HG       SER  83  -4.223 -10.586 -14.368
  669    H    GLU  84           H        GLU  84  -2.501 -12.045  -9.715
  670    HA   GLU  84           HA       GLU  84  -0.529 -10.140  -9.027
  671   1HB   GLU  84          2HB       GLU  84  -1.524 -12.664  -7.769
  672   2HB   GLU  84          1HB       GLU  84  -0.032 -11.960  -7.147
  673   1HG   GLU  84          2HG       GLU  84  -1.120 -10.230  -6.175
  674   2HG   GLU  84          1HG       GLU  84  -2.144  -9.972  -7.588
  675    H    ALA  85           H        ALA  85   0.063 -13.664  -9.305
  676    HA   ALA  85           HA       ALA  85   2.781 -13.788  -9.190
  677   1HB   ALA  85          1HB       ALA  85   0.768 -15.235 -10.808
  678   2HB   ALA  85          2HB       ALA  85   2.018 -15.868  -9.737
  679   3HB   ALA  85          3HB       ALA  85   2.431 -15.373 -11.379
  680    H    LYS  86           H        LYS  86   0.965 -12.292 -11.806
  681    HA   LYS  86           HA       LYS  86   3.350 -11.958 -13.480
  682   1HB   LYS  86          2HB       LYS  86   1.059 -12.203 -14.454
  683   2HB   LYS  86          1HB       LYS  86   0.626 -10.651 -13.736
  684   1HG   LYS  86          2HG       LYS  86   2.528  -9.603 -14.989
  685   2HG   LYS  86          1HG       LYS  86   2.793 -11.149 -15.797
  686   1HD   LYS  86          2HD       LYS  86   1.416  -9.832 -17.262
  687   2HD   LYS  86          1HD       LYS  86   0.369 -11.054 -16.540
  688   1HE   LYS  86          2HE       LYS  86  -0.946  -9.212 -16.138
  689   2HE   LYS  86          1HE       LYS  86   0.067  -9.124 -14.698
  690   1HZ   LYS  86          1HZ       LYS  86   1.178  -7.342 -15.475
  691   2HZ   LYS  86          2HZ       LYS  86  -0.239  -7.103 -16.381
  692   3HZ   LYS  86          3HZ       LYS  86   1.113  -7.847 -17.092
  693    H    LEU  87           H        LEU  87   1.092  -9.553 -12.054
  694    HA   LEU  87           HA       LEU  87   2.782  -7.338 -12.352
  695   1HB   LEU  87          2HB       LEU  87   1.566  -6.610 -10.074
  696   2HB   LEU  87          1HB       LEU  87   0.749  -6.594 -11.619
  697    HG   LEU  87           HG       LEU  87   0.603  -9.223 -10.385
  698   1HD1  LEU  87          1HD1      LEU  87   0.529  -8.348  -8.240
  699   2HD1  LEU  87          2HD1      LEU  87  -1.170  -8.220  -8.698
  700   3HD1  LEU  87          3HD1      LEU  87  -0.125  -6.804  -8.782
  701   1HD2  LEU  87          1HD2      LEU  87  -0.890  -8.615 -12.172
  702   2HD2  LEU  87          2HD2      LEU  87  -1.368  -7.132 -11.350
  703   3HD2  LEU  87          3HD2      LEU  87  -1.875  -8.695 -10.712
  704    H    VAL  88           H        VAL  88   2.369  -9.194  -9.363
  705    HA   VAL  88           HA       VAL  88   4.262  -8.085  -7.739
  706    HB   VAL  88           HB       VAL  88   4.694 -10.372  -6.902
  707   1HG1  VAL  88          1HG1      VAL  88   2.476  -8.886  -6.635
  708   2HG1  VAL  88          2HG1      VAL  88   2.624 -10.479  -5.892
  709   3HG1  VAL  88          3HG1      VAL  88   1.768 -10.296  -7.423
  710   1HG2  VAL  88          1HG2      VAL  88   4.573 -12.033  -8.421
  711   2HG2  VAL  88          2HG2      VAL  88   3.731 -10.985  -9.563
  712   3HG2  VAL  88          3HG2      VAL  88   2.820 -11.865  -8.337
  713    H    GLU  89           H        GLU  89   4.909  -9.985 -10.619
  714    HA   GLU  89           HA       GLU  89   7.598 -10.699 -10.198
  715   1HB   GLU  89          2HB       GLU  89   6.318  -9.715 -12.770
  716   2HB   GLU  89          1HB       GLU  89   7.851 -10.580 -12.668
  717   1HG   GLU  89          2HG       GLU  89   6.173 -12.215 -11.224
  718   2HG   GLU  89          1HG       GLU  89   5.103 -11.611 -12.489
  719    H    GLN  90           H        GLN  90   6.369  -7.699 -11.715
  720    HA   GLN  90           HA       GLN  90   8.976  -6.428 -11.660
  721   1HB   GLN  90          2HB       GLN  90   6.157  -5.417 -12.087
  722   2HB   GLN  90          1HB       GLN  90   7.539  -4.322 -12.042
  723   1HG   GLN  90          2HG       GLN  90   7.420  -6.735 -13.865
  724   2HG   GLN  90          1HG       GLN  90   6.873  -5.133 -14.360
  725   1HE2  GLN  90          1HE2      GLN  90   8.697  -3.356 -13.595
  726   2HE2  GLN  90          2HE2      GLN  90  10.271  -3.761 -14.085
  727    H    ALA  91           H        ALA  91   6.506  -7.000  -9.351
  728    HA   ALA  91           HA       ALA  91   6.963  -4.725  -7.641
  729   1HB   ALA  91          1HB       ALA  91   5.833  -7.455  -7.013
  730   2HB   ALA  91          2HB       ALA  91   4.907  -6.024  -7.464
  731   3HB   ALA  91          3HB       ALA  91   5.774  -6.066  -5.930
  732    H    PHE  92           H        PHE  92   7.602  -8.080  -6.653
  733    HA   PHE  92           HA       PHE  92   9.522  -7.537  -4.721
  734   1HB   PHE  92          2HB       PHE  92   9.607  -9.885  -6.640
  735   2HB   PHE  92          1HB       PHE  92  10.347  -9.816  -5.042
  736    HD1  PHE  92           HD1      PHE  92   8.318 -11.901  -5.907
  737    HD2  PHE  92           HD2      PHE  92   7.845  -8.078  -4.003
  738    HE1  PHE  92           HE1      PHE  92   6.193 -12.671  -4.889
  739    HE2  PHE  92           HE2      PHE  92   5.719  -8.849  -2.986
  740    HZ   PHE  92           HZ       PHE  92   4.893 -11.146  -3.429
  741    H    ARG  93           H        ARG  93  10.001  -7.757  -8.228
  742    HA   ARG  93           HA       ARG  93  12.892  -7.186  -7.879
  743   1HB   ARG  93          2HB       ARG  93  12.069  -8.912  -9.540
  744   2HB   ARG  93          1HB       ARG  93  11.358  -7.587 -10.461
  745   1HG   ARG  93          2HG       ARG  93  13.654  -6.511 -10.490
  746   2HG   ARG  93          1HG       ARG  93  14.287  -8.019  -9.828
  747   1HD   ARG  93          2HD       ARG  93  12.562  -8.078 -12.290
  748   2HD   ARG  93          1HD       ARG  93  14.271  -7.666 -12.428
  749    HE   ARG  93           HE       ARG  93  14.632  -9.981 -12.278
  750   1HH1  ARG  93          1HH2      ARG  93  11.488 -10.179 -11.952
  751   2HH1  ARG  93          2HH2      ARG  93  11.425 -11.238 -10.584
  752   1HH2  ARG  93          1HH1      ARG  93  14.776 -10.853  -9.791
  753   2HH2  ARG  93          2HH1      ARG  93  13.284 -11.620  -9.361
  754    H    LYS  94           H        LYS  94  13.165  -5.024  -7.421
  755    HA   LYS  94           HA       LYS  94  11.483  -2.913  -8.337
  756   1HB   LYS  94          2HB       LYS  94  14.434  -2.666  -7.697
  757   2HB   LYS  94          1HB       LYS  94  13.197  -1.417  -7.555
  758   1HG   LYS  94          2HG       LYS  94  12.716  -2.092  -5.466
  759   2HG   LYS  94          1HG       LYS  94  12.366  -3.719  -6.052
  760   1HD   LYS  94          2HD       LYS  94  14.212  -4.423  -4.969
  761   2HD   LYS  94          1HD       LYS  94  15.168  -3.498  -6.126
  762   1HE   LYS  94          2HE       LYS  94  14.077  -2.499  -3.480
  763   2HE   LYS  94          1HE       LYS  94  15.769  -2.797  -3.874
  764   1HZ   LYS  94          1HZ       LYS  94  15.590  -0.552  -4.231
  765   2HZ   LYS  94          2HZ       LYS  94  13.995  -0.648  -4.807
  766   3HZ   LYS  94          3HZ       LYS  94  15.288  -1.145  -5.791
  767    H    ARG  95           H        ARG  95  12.061  -1.229  -9.948
  768    HA   ARG  95           HA       ARG  95  13.535  -2.424 -12.260
  769   1HB   ARG  95          2HB       ARG  95  12.143  -0.742 -13.603
  770   2HB   ARG  95          1HB       ARG  95  11.260  -2.098 -12.900
  771   1HG   ARG  95          2HG       ARG  95  10.259  -0.780 -11.269
  772   2HG   ARG  95          1HG       ARG  95  11.553   0.417 -11.298
  773   1HD   ARG  95          2HD       ARG  95  10.063   0.112 -13.837
  774   2HD   ARG  95          1HD       ARG  95   9.135   0.785 -12.496
  775    HE   ARG  95           HE       ARG  95  11.435   2.267 -12.403
  776   1HH1  ARG  95          1HH2      ARG  95  10.767   1.106 -15.407
  777   2HH1  ARG  95          2HH2      ARG  95  10.389   2.629 -16.140
  778   1HH2  ARG  95          1HH1      ARG  95  10.305   4.357 -13.134
  779   2HH2  ARG  95          2HH1      ARG  95  10.127   4.470 -14.853
  780    H    ARG  96           H        ARG  96  15.598  -1.580 -11.899
  781    HA   ARG  96           HA       ARG  96  16.019   1.183 -11.104
  782   1HB   ARG  96          2HB       ARG  96  17.795  -1.063 -12.035
  783   2HB   ARG  96          1HB       ARG  96  18.434   0.577 -11.910
  784   1HG   ARG  96          2HG       ARG  96  17.685   0.673  -9.546
  785   2HG   ARG  96          1HG       ARG  96  17.107  -0.988  -9.678
  786   1HD   ARG  96          2HD       ARG  96  19.531  -0.480  -8.730
  787   2HD   ARG  96          1HD       ARG  96  19.247  -1.875  -9.771
  788    HE   ARG  96           HE       ARG  96  20.336  -0.703 -11.577
  789   1HH1  ARG  96          1HH1      ARG  96  19.281   1.878  -9.874
  790   2HH1  ARG  96          2HH1      ARG  96  20.792   2.722  -9.796
  791   1HH2  ARG  96          1HH2      ARG  96  22.655   0.039 -10.953
  792   2HH2  ARG  96          2HH2      ARG  96  22.701   1.682 -10.407
  793    H    GLN  97           H        GLN  97  17.827   2.308 -12.714
  794    HA   GLN  97           HA       GLN  97  16.503   2.380 -15.396
  795   1HB   GLN  97          2HB       GLN  97  16.494   4.432 -13.645
  796   2HB   GLN  97          1HB       GLN  97  18.034   4.748 -14.444
  797   1HG   GLN  97          2HG       GLN  97  16.885   4.630 -16.649
  798   2HG   GLN  97          1HG       GLN  97  15.349   4.407 -15.812
  799   1HE2  GLN  97          1HE2      GLN  97  18.108   6.620 -15.098
  800   2HE2  GLN  97          2HE2      GLN  97  17.172   8.035 -15.136
  801    H    ARG  98           H        ARG  98  19.599   3.232 -13.791
  802    HA   ARG  98           HA       ARG  98  21.012   2.621 -16.327
  803   1HB   ARG  98          2HB       ARG  98  21.916   3.850 -13.707
  804   2HB   ARG  98          1HB       ARG  98  23.019   3.481 -15.034
  805   1HG   ARG  98          2HG       ARG  98  21.854   4.983 -16.518
  806   2HG   ARG  98          1HG       ARG  98  20.557   5.219 -15.345
  807   1HD   ARG  98          2HD       ARG  98  21.703   6.894 -14.377
  808   2HD   ARG  98          1HD       ARG  98  23.069   5.816 -14.085
  809    HE   ARG  98           HE       ARG  98  22.786   7.050 -16.775
  810   1HH1  ARG  98          1HH1      ARG  98  23.774   9.124 -14.973
  811   2HH1  ARG  98          2HH1      ARG  98  25.486   8.859 -14.951
  812   1HH2  ARG  98          1HH2      ARG  98  25.272   5.645 -16.232
  813   2HH2  ARG  98          2HH2      ARG  98  26.334   6.890 -15.663
  814    H    GLY  99           H        GLY  99  20.083   0.287 -15.590
  815   1HA   GLY  99          2HA       GLY  99  22.265  -1.030 -14.021
  816   2HA   GLY  99          1HA       GLY  99  20.603  -1.618 -14.048
  817    H    VAL 100           H        VAL 100  22.456  -0.451 -16.840
  818    HA   VAL 100           HA       VAL 100  21.798  -2.893 -18.304
  819    HB   VAL 100           HB       VAL 100  23.700  -0.703 -19.168
  820   1HG1  VAL 100          1HG1      VAL 100  22.159  -1.601 -21.306
  821   2HG1  VAL 100          2HG1      VAL 100  22.489  -3.069 -20.385
  822   3HG1  VAL 100          3HG1      VAL 100  23.824  -2.073 -20.963
  823   1HG2  VAL 100          1HG2      VAL 100  20.981  -0.492 -20.182
  824   2HG2  VAL 100          2HG2      VAL 100  21.980   0.738 -19.408
  825   3HG2  VAL 100          3HG2      VAL 100  21.019  -0.365 -18.422
  826    H    SER 101           HN       SER 101  22.963  -4.719 -17.972
  827    HA   SER 101           HA       SER 101  25.848  -4.720 -18.251
  828   1HB   SER 101          2HB       SER 101  24.916  -4.195 -15.666
  829   2HB   SER 101          1HB       SER 101  25.299  -5.914 -15.650
  830    HG   SER 101           HG       SER 101  27.171  -4.822 -15.194
  Start of MODEL    8
    1   1H    GLU   1          1HT       GLU   1  18.255   8.259  -6.316
    2   2H    GLU   1          2HT       GLU   1  19.517   8.260  -7.454
    3   3H    GLU   1          3HT       GLU   1  18.484   9.602  -7.326
    4    HA   GLU   1           HA       GLU   1  20.386   8.669  -5.245
    5   1HB   GLU   1          2HB       GLU   1  21.545   9.720  -7.113
    6   2HB   GLU   1          1HB       GLU   1  20.401  11.063  -7.107
    7   1HG   GLU   1          2HG       GLU   1  21.297  12.004  -5.197
    8   2HG   GLU   1          1HG       GLU   1  21.838  10.451  -4.560
    9    H    SER   2           H        SER   2  17.357   9.875  -5.726
   10    HA   SER   2           HA       SER   2  17.533  11.549  -3.251
   11   1HB   SER   2          2HB       SER   2  17.063  13.093  -5.010
   12   2HB   SER   2          1HB       SER   2  15.922  11.990  -5.774
   13    HG   SER   2           HG       SER   2  15.568  13.758  -3.717
   14    H    LYS   3           H        LYS   3  14.900  10.190  -5.259
   15    HA   LYS   3           HA       LYS   3  14.167   8.306  -3.148
   16   1HB   LYS   3          2HB       LYS   3  13.161  10.304  -2.199
   17   2HB   LYS   3          1HB       LYS   3  12.417  10.710  -3.744
   18   1HG   LYS   3          2HG       LYS   3  10.785   9.649  -2.216
   19   2HG   LYS   3          1HG       LYS   3  11.055   8.653  -3.636
   20   1HD   LYS   3          2HD       LYS   3  12.975   8.008  -1.564
   21   2HD   LYS   3          1HD       LYS   3  11.324   7.860  -0.960
   22   1HE   LYS   3          2HE       LYS   3  10.893   6.050  -2.252
   23   2HE   LYS   3          1HE       LYS   3  11.669   6.770  -3.663
   24   1HZ   LYS   3          1HZ       LYS   3  13.094   5.064  -3.196
   25   2HZ   LYS   3          2HZ       LYS   3  12.841   5.146  -1.518
   26   3HZ   LYS   3          3HZ       LYS   3  13.816   6.304  -2.292
   27    HA   PRO   4           HA       PRO   4  12.682   7.121  -7.353
   28   1HB   PRO   4          2HB       PRO   4  14.355   4.966  -7.646
   29   2HB   PRO   4          1HB       PRO   4  14.818   6.610  -8.123
   30   1HG   PRO   4          2HG       PRO   4  15.767   5.004  -5.814
   31   2HG   PRO   4          1HG       PRO   4  16.533   6.392  -6.602
   32   1HD   PRO   4          2HD       PRO   4  15.043   6.395  -4.140
   33   2HD   PRO   4          1HD       PRO   4  15.739   7.797  -4.983
   34    HA   PRO   5           HA       PRO   5  10.621   3.992  -4.706
   35   1HB   PRO   5          2HB       PRO   5   8.071   4.811  -5.304
   36   2HB   PRO   5          1HB       PRO   5   9.064   5.556  -4.046
   37   1HG   PRO   5          2HG       PRO   5   8.255   6.659  -6.661
   38   2HG   PRO   5          1HG       PRO   5   8.928   7.506  -5.260
   39   1HD   PRO   5          2HD       PRO   5  10.309   6.652  -7.674
   40   2HD   PRO   5          1HD       PRO   5  10.944   7.596  -6.327
   41    H    TYR   6           H        TYR   6   8.514   2.642  -5.370
   42    HA   TYR   6           HA       TYR   6   9.131   1.336  -7.908
   43   1HB   TYR   6          2HB       TYR   6   6.764   0.835  -6.105
   44   2HB   TYR   6          1HB       TYR   6   7.541  -0.293  -7.213
   45    HD1  TYR   6           HD1      TYR   6  10.383   0.180  -6.703
   46    HD2  TYR   6           HD2      TYR   6   7.094  -0.077  -3.957
   47    HE1  TYR   6           HE1      TYR   6  11.937  -0.557  -4.913
   48    HE2  TYR   6           HE2      TYR   6   8.645  -0.813  -2.165
   49    HH   TYR   6           HH       TYR   6  12.113  -1.298  -2.835
   50    H    SER   7           H        SER   7   7.702   1.312  -9.731
   51    HA   SER   7           HA       SER   7   6.477   3.712 -10.453
   52   1HB   SER   7          2HB       SER   7   6.116   0.868 -11.298
   53   2HB   SER   7          1HB       SER   7   4.902   2.033 -11.826
   54    HG   SER   7           HG       SER   7   7.655   1.909 -12.382
   55    H    TYR   8           H        TYR   8   4.027   4.127 -10.636
   56    HA   TYR   8           HA       TYR   8   2.873   3.575  -8.000
   57   1HB   TYR   8          2HB       TYR   8   1.760   5.126 -10.354
   58   2HB   TYR   8          1HB       TYR   8   1.057   5.070  -8.736
   59    HD1  TYR   8           HD1      TYR   8   2.438   7.415 -10.494
   60    HD2  TYR   8           HD2      TYR   8   3.588   5.044  -7.101
   61    HE1  TYR   8           HE1      TYR   8   3.981   9.210  -9.761
   62    HE2  TYR   8           HE2      TYR   8   5.130   6.841  -6.370
   63    HH   TYR   8           HH       TYR   8   5.606   9.079  -6.658
   64    H    ALA   9           H        ALA   9   3.165   1.576 -10.413
   65    HA   ALA   9           HA       ALA   9   0.377   0.515 -10.215
   66   1HB   ALA   9          1HB       ALA   9   2.341  -0.220 -12.389
   67   2HB   ALA   9          2HB       ALA   9   1.314   1.206 -12.536
   68   3HB   ALA   9          3HB       ALA   9   0.586  -0.394 -12.394
   69    H    GLN  10           H        GLN  10   3.817  -0.161 -10.075
   70    HA   GLN  10           HA       GLN  10   3.365  -2.984  -9.265
   71   1HB   GLN  10          2HB       GLN  10   5.803  -3.169  -9.324
   72   2HB   GLN  10          1HB       GLN  10   5.266  -2.388 -10.809
   73   1HG   GLN  10          2HG       GLN  10   5.741  -0.175  -9.802
   74   2HG   GLN  10          1HG       GLN  10   6.349  -0.988  -8.361
   75   1HE2  GLN  10          1HE2      GLN  10   8.595  -1.247  -8.386
   76   2HE2  GLN  10          2HE2      GLN  10   9.539  -1.409  -9.785
   77    H    LEU  11           H        LEU  11   4.282   0.150  -8.087
   78    HA   LEU  11           HA       LEU  11   5.243  -0.457  -5.506
   79   1HB   LEU  11          2HB       LEU  11   5.247   1.813  -6.481
   80   2HB   LEU  11          1HB       LEU  11   3.487   1.851  -6.415
   81    HG   LEU  11           HG       LEU  11   4.123   1.199  -3.833
   82   1HD1  LEU  11          1HD1      LEU  11   6.359   1.579  -3.638
   83   2HD1  LEU  11          2HD1      LEU  11   5.890   3.277  -3.620
   84   3HD1  LEU  11          3HD1      LEU  11   6.422   2.526  -5.124
   85   1HD2  LEU  11          1HD2      LEU  11   4.086   3.980  -3.863
   86   2HD2  LEU  11          2HD2      LEU  11   2.667   2.933  -3.811
   87   3HD2  LEU  11          3HD2      LEU  11   3.260   3.539  -5.358
   88    H    ILE  12           H        ILE  12   1.955  -0.056  -6.751
   89    HA   ILE  12           HA       ILE  12   0.582  -0.488  -4.252
   90    HB   ILE  12           HB       ILE  12  -0.441  -1.333  -6.958
   91   1HG1  ILE  12          2HG1      ILE  12   0.556   1.210  -6.426
   92   2HG1  ILE  12          1HG1      ILE  12  -0.609   0.810  -7.679
   93   1HG2  ILE  12          1HG2      ILE  12  -1.564  -0.682  -4.271
   94   2HG2  ILE  12          2HG2      ILE  12  -1.980  -1.991  -5.377
   95   3HG2  ILE  12          3HG2      ILE  12  -2.550  -0.356  -5.692
   96   1HD1  ILE  12          1HD1      ILE  12  -2.435   1.180  -5.955
   97   2HD1  ILE  12          2HD1      ILE  12  -1.537   2.626  -6.411
   98   3HD1  ILE  12          3HD1      ILE  12  -1.185   1.814  -4.887
   99    H    VAL  13           H        VAL  13   1.572  -2.662  -6.869
  100    HA   VAL  13           HA       VAL  13   0.466  -5.067  -6.013
  101    HB   VAL  13           HB       VAL  13   3.270  -4.687  -7.092
  102   1HG1  VAL  13          1HG1      VAL  13   3.242  -6.929  -6.632
  103   2HG1  VAL  13          2HG1      VAL  13   2.358  -6.991  -8.157
  104   3HG1  VAL  13          3HG1      VAL  13   1.481  -7.011  -6.627
  105   1HG2  VAL  13          1HG2      VAL  13   1.551  -3.542  -8.452
  106   2HG2  VAL  13          2HG2      VAL  13   0.620  -5.034  -8.531
  107   3HG2  VAL  13          3HG2      VAL  13   2.206  -4.937  -9.298
  108    H    GLN  14           H        GLN  14   3.802  -4.003  -5.128
  109    HA   GLN  14           HA       GLN  14   4.186  -6.042  -3.193
  110   1HB   GLN  14          2HB       GLN  14   6.011  -4.553  -3.975
  111   2HB   GLN  14          1HB       GLN  14   5.262  -3.204  -3.120
  112   1HG   GLN  14          2HG       GLN  14   5.428  -4.571  -0.999
  113   2HG   GLN  14          1HG       GLN  14   6.394  -5.737  -1.906
  114   1HE2  GLN  14          1HE2      GLN  14   7.664  -3.579  -3.563
  115   2HE2  GLN  14          2HE2      GLN  14   8.776  -2.817  -2.535
  116    H    ALA  15           H        ALA  15   2.347  -3.103  -3.120
  117    HA   ALA  15           HA       ALA  15   2.057  -2.886  -0.268
  118   1HB   ALA  15          1HB       ALA  15   1.034  -0.973  -0.877
  119   2HB   ALA  15          2HB       ALA  15  -0.253  -1.888  -1.662
  120   3HB   ALA  15          3HB       ALA  15   1.199  -1.458  -2.565
  121    H    ILE  16           H        ILE  16  -0.629  -3.541  -2.460
  122    HA   ILE  16           HA       ILE  16  -2.070  -5.041  -0.472
  123    HB   ILE  16           HB       ILE  16  -3.279  -5.782  -2.834
  124   1HG1  ILE  16          2HG1      ILE  16  -2.084  -3.015  -3.213
  125   2HG1  ILE  16          1HG1      ILE  16  -1.810  -4.424  -4.243
  126   1HG2  ILE  16          1HG2      ILE  16  -4.893  -4.058  -2.290
  127   2HG2  ILE  16          2HG2      ILE  16  -3.691  -3.191  -1.339
  128   3HG2  ILE  16          3HG2      ILE  16  -4.274  -4.763  -0.799
  129   1HD1  ILE  16          1HD1      ILE  16  -4.358  -4.463  -4.567
  130   2HD1  ILE  16          2HD1      ILE  16  -3.485  -3.149  -5.354
  131   3HD1  ILE  16          3HD1      ILE  16  -4.360  -2.852  -3.854
  132    H    SER  17           H        SER  17  -0.364  -6.056  -3.435
  133    HA   SER  17           HA       SER  17  -0.882  -8.819  -3.258
  134   1HB   SER  17          2HB       SER  17   0.443  -7.437  -5.053
  135   2HB   SER  17          1HB       SER  17   1.845  -7.836  -4.062
  136    HG   SER  17           HG       SER  17  -0.044  -9.722  -5.020
  137    H    SER  18           H        SER  18   1.764  -6.960  -1.736
  138    HA   SER  18           HA       SER  18   2.708  -9.361  -0.325
  139   1HB   SER  18          2HB       SER  18   3.975  -7.089  -1.156
  140   2HB   SER  18          1HB       SER  18   3.699  -6.716   0.542
  141    HG   SER  18           HG       SER  18   5.674  -7.978  -0.145
  142    H    ALA  19           H        ALA  19   0.250  -7.126   0.165
  143    HA   ALA  19           HA       ALA  19   0.446  -6.775   3.025
  144   1HB   ALA  19          1HB       ALA  19  -1.943  -6.093   2.857
  145   2HB   ALA  19          2HB       ALA  19  -1.957  -6.633   1.178
  146   3HB   ALA  19          3HB       ALA  19  -0.935  -5.279   1.660
  147    H    GLN  20           H        GLN  20  -1.881  -7.612   4.149
  148    HA   GLN  20           HA       GLN  20  -1.488 -10.244   4.906
  149   1HB   GLN  20          2HB       GLN  20  -4.145 -10.234   5.111
  150   2HB   GLN  20          1HB       GLN  20  -3.145  -9.243   6.171
  151   1HG   GLN  20          2HG       GLN  20  -3.695  -7.854   3.676
  152   2HG   GLN  20          1HG       GLN  20  -5.190  -8.338   4.476
  153   1HE2  GLN  20          1HE2      GLN  20  -3.633  -5.629   4.243
  154   2HE2  GLN  20          2HE2      GLN  20  -3.602  -5.070   5.846
  155    H    ASP  21           H        ASP  21  -4.480  -9.918   3.112
  156    HA   ASP  21           HA       ASP  21  -3.834 -12.373   1.632
  157   1HB   ASP  21          2HB       ASP  21  -6.209 -11.090   2.514
  158   2HB   ASP  21          1HB       ASP  21  -6.279 -11.135   0.753
  159    H    ARG  22           H        ARG  22  -5.341  -9.360   0.437
  160    HA   ARG  22           HA       ARG  22  -3.271  -8.635  -1.371
  161   1HB   ARG  22          2HB       ARG  22  -4.328  -9.453  -3.503
  162   2HB   ARG  22          1HB       ARG  22  -3.682 -10.747  -2.493
  163   1HG   ARG  22          2HG       ARG  22  -5.907 -11.218  -1.604
  164   2HG   ARG  22          1HG       ARG  22  -6.583  -9.861  -2.506
  165   1HD   ARG  22          2HD       ARG  22  -7.076 -11.599  -3.958
  166   2HD   ARG  22          1HD       ARG  22  -5.492 -11.123  -4.570
  167    HE   ARG  22           HE       ARG  22  -4.534 -13.038  -3.322
  168   1HH1  ARG  22          1HH1      ARG  22  -7.806 -12.787  -2.540
  169   2HH1  ARG  22          2HH1      ARG  22  -8.149 -14.476  -2.711
  170   1HH2  ARG  22          1HH2      ARG  22  -5.030 -15.250  -4.013
  171   2HH2  ARG  22          2HH2      ARG  22  -6.579 -15.870  -3.544
  172    H    GLN  23           H        GLN  23  -5.262  -7.395   0.336
  173    HA   GLN  23           HA       GLN  23  -6.417  -5.547  -1.664
  174   1HB   GLN  23          2HB       GLN  23  -8.642  -5.644  -0.433
  175   2HB   GLN  23          1HB       GLN  23  -8.258  -7.064  -1.407
  176   1HG   GLN  23          2HG       GLN  23  -7.547  -8.299   0.539
  177   2HG   GLN  23          1HG       GLN  23  -7.652  -6.860   1.555
  178   1HE2  GLN  23          1HE2      GLN  23  -9.828  -6.051   2.095
  179   2HE2  GLN  23          2HE2      GLN  23 -11.190  -7.051   1.927
  180    H    LEU  24           H        LEU  24  -6.112  -3.492  -0.946
  181    HA   LEU  24           HA       LEU  24  -5.875  -3.029   1.991
  182   1HB   LEU  24          2HB       LEU  24  -4.274  -1.822  -0.288
  183   2HB   LEU  24          1HB       LEU  24  -4.262  -1.199   1.354
  184    HG   LEU  24           HG       LEU  24  -3.662  -4.097   0.810
  185   1HD1  LEU  24          1HD1      LEU  24  -1.702  -1.779   0.837
  186   2HD1  LEU  24          2HD1      LEU  24  -2.087  -2.786  -0.557
  187   3HD1  LEU  24          3HD1      LEU  24  -1.255  -3.484   0.831
  188   1HD2  LEU  24          1HD2      LEU  24  -3.729  -3.990   3.075
  189   2HD2  LEU  24          2HD2      LEU  24  -3.638  -2.229   3.078
  190   3HD2  LEU  24          3HD2      LEU  24  -2.165  -3.188   2.939
  191    H    THR  25           H        THR  25  -6.449  -0.741   2.573
  192    HA   THR  25           HA       THR  25  -8.803   0.127   1.056
  193    HB   THR  25           HB       THR  25  -9.167   1.682   2.833
  194    HG1  THR  25           HG1      THR  25  -7.470   2.734   3.437
  195   1HG2  THR  25          1HG2      THR  25  -9.329  -0.766   3.438
  196   2HG2  THR  25          2HG2      THR  25  -9.047   0.309   4.807
  197   3HG2  THR  25          3HG2      THR  25  -7.715  -0.632   4.136
  198    H    LEU  26           H        LEU  26  -8.795   2.751   0.730
  199    HA   LEU  26           HA       LEU  26  -6.829   3.231  -1.303
  200   1HB   LEU  26          2HB       LEU  26  -9.160   4.438  -0.742
  201   2HB   LEU  26          1HB       LEU  26  -8.075   5.573   0.065
  202    HG   LEU  26           HG       LEU  26  -7.301   4.670  -2.668
  203   1HD1  LEU  26          1HD1      LEU  26  -9.534   6.652  -2.129
  204   2HD1  LEU  26          2HD1      LEU  26  -9.701   5.097  -2.944
  205   3HD1  LEU  26          3HD1      LEU  26  -8.766   6.390  -3.694
  206   1HD2  LEU  26          1HD2      LEU  26  -6.972   7.019  -0.862
  207   2HD2  LEU  26          2HD2      LEU  26  -6.984   7.345  -2.595
  208   3HD2  LEU  26          3HD2      LEU  26  -5.793   6.237  -1.915
  209    H    SER  27           H        SER  27  -6.980   3.979   2.129
  210    HA   SER  27           HA       SER  27  -4.346   5.343   1.973
  211   1HB   SER  27          2HB       SER  27  -6.205   6.400   3.268
  212   2HB   SER  27          1HB       SER  27  -6.202   5.003   4.340
  213    HG   SER  27           HG       SER  27  -4.261   5.578   5.105
  214    H    GLY  28           H        GLY  28  -4.814   2.385   1.679
  215   1HA   GLY  28          2HA       GLY  28  -3.372   1.377   4.093
  216   2HA   GLY  28          1HA       GLY  28  -4.223   0.360   2.922
  217    H    ILE  29           H        ILE  29  -3.352   1.468   0.604
  218    HA   ILE  29           HA       ILE  29  -0.917   0.193   0.041
  219    HB   ILE  29           HB       ILE  29  -2.733   1.028  -1.524
  220   1HG1  ILE  29          2HG1      ILE  29  -0.222   0.300  -2.023
  221   2HG1  ILE  29          1HG1      ILE  29  -1.279   0.886  -3.302
  222   1HG2  ILE  29          1HG2      ILE  29  -2.715   3.347  -0.548
  223   2HG2  ILE  29          2HG2      ILE  29  -2.627   3.301  -2.305
  224   3HG2  ILE  29          3HG2      ILE  29  -1.176   3.609  -1.360
  225   1HD1  ILE  29          1HD1      ILE  29  -0.388   3.165  -2.976
  226   2HD1  ILE  29          2HD1      ILE  29   0.886   2.023  -3.405
  227   3HD1  ILE  29          3HD1      ILE  29   0.698   2.550  -1.732
  228    H    TYR  30           H        TYR  30  -1.641   3.403   1.195
  229    HA   TYR  30           HA       TYR  30   1.053   4.435   0.824
  230   1HB   TYR  30          2HB       TYR  30  -1.080   5.505   2.685
  231   2HB   TYR  30          1HB       TYR  30   0.281   6.392   1.991
  232    HD1  TYR  30           HD1      TYR  30   0.307   5.388  -0.764
  233    HD2  TYR  30           HD2      TYR  30  -2.992   6.519   1.729
  234    HE1  TYR  30           HE1      TYR  30  -1.044   5.854  -2.780
  235    HE2  TYR  30           HE2      TYR  30  -4.355   6.984  -0.288
  236    HH   TYR  30           HH       TYR  30  -4.066   5.933  -2.989
  237    H    ALA  31           H        ALA  31  -0.804   3.421   3.714
  238    HA   ALA  31           HA       ALA  31   1.400   3.698   5.522
  239   1HB   ALA  31          1HB       ALA  31  -0.307   3.289   6.936
  240   2HB   ALA  31          2HB       ALA  31  -0.236   1.593   6.459
  241   3HB   ALA  31          3HB       ALA  31  -1.313   2.703   5.611
  242    H    HIS  32           H        HIS  32   0.717   1.398   3.075
  243    HA   HIS  32           HA       HIS  32   2.201  -0.812   4.258
  244   1HB   HIS  32          2HB       HIS  32   0.429  -1.227   2.605
  245   2HB   HIS  32          1HB       HIS  32   1.321  -0.300   1.398
  246    HD1  HIS  32           HD1      HIS  32   0.734  -3.665   2.190
  247    HD2  HIS  32           HD2      HIS  32   4.221  -1.534   1.364
  248    HE1  HIS  32           HE1      HIS  32   2.466  -5.371   1.480
  249    H    ILE  33           H        ILE  33   2.865   0.936   1.219
  250    HA   ILE  33           HA       ILE  33   5.608   0.278   1.049
  251    HB   ILE  33           HB       ILE  33   4.053   1.430  -0.661
  252   1HG1  ILE  33          2HG1      ILE  33   6.615   0.964  -0.752
  253   2HG1  ILE  33          1HG1      ILE  33   5.925   2.100  -1.905
  254   1HG2  ILE  33          1HG2      ILE  33   5.152   3.884   0.738
  255   2HG2  ILE  33          2HG2      ILE  33   3.474   3.348   0.809
  256   3HG2  ILE  33          3HG2      ILE  33   4.167   3.869  -0.725
  257   1HD1  ILE  33          1HD1      ILE  33   8.061   2.629  -0.239
  258   2HD1  ILE  33          2HD1      ILE  33   6.713   3.366   0.622
  259   3HD1  ILE  33          3HD1      ILE  33   7.072   3.849  -1.035
  260    H    THR  34           H        THR  34   4.047   3.042   2.638
  261    HA   THR  34           HA       THR  34   6.397   4.455   3.364
  262    HB   THR  34           HB       THR  34   5.016   5.450   5.168
  263    HG1  THR  34           HG1      THR  34   3.946   3.289   5.472
  264   1HG2  THR  34          1HG2      THR  34   4.114   5.170   2.360
  265   2HG2  THR  34          2HG2      THR  34   4.465   6.626   3.291
  266   3HG2  THR  34          3HG2      THR  34   2.915   5.807   3.485
  267    H    LYS  35           H        LYS  35   4.870   1.630   4.829
  268    HA   LYS  35           HA       LYS  35   6.385   1.700   7.281
  269   1HB   LYS  35          2HB       LYS  35   4.259   0.306   6.665
  270   2HB   LYS  35          1HB       LYS  35   5.419  -0.857   6.020
  271   1HG   LYS  35          2HG       LYS  35   6.106  -1.494   8.085
  272   2HG   LYS  35          1HG       LYS  35   6.131   0.164   8.685
  273   1HD   LYS  35          2HD       LYS  35   3.418  -0.802   8.151
  274   2HD   LYS  35          1HD       LYS  35   4.258  -1.763   9.369
  275   1HE   LYS  35          2HE       LYS  35   4.958   0.686  10.225
  276   2HE   LYS  35          1HE       LYS  35   3.427   1.096   9.453
  277   1HZ   LYS  35          1HZ       LYS  35   2.521  -0.899  10.739
  278   2HZ   LYS  35          2HZ       LYS  35   2.835   0.527  11.607
  279   3HZ   LYS  35          3HZ       LYS  35   3.925  -0.773  11.683
  280    H    HIS  36           H        HIS  36   6.906   0.105   4.140
  281    HA   HIS  36           HA       HIS  36   9.490  -0.976   5.081
  282   1HB   HIS  36          2HB       HIS  36   7.865  -1.253   2.559
  283   2HB   HIS  36          1HB       HIS  36   9.549  -1.773   2.606
  284    HD1  HIS  36           HD1      HIS  36  10.118  -3.869   3.974
  285    HD2  HIS  36           HD2      HIS  36   6.105  -2.774   4.256
  286    HE1  HIS  36           HE1      HIS  36   8.927  -5.798   5.103
  287    H    TYR  37           H        TYR  37   8.428   1.952   3.862
  288    HA   TYR  37           HA       TYR  37  11.141   2.507   2.749
  289   1HB   TYR  37          2HB       TYR  37   8.477   2.951   1.572
  290   2HB   TYR  37          1HB       TYR  37   9.537   4.363   1.511
  291    HD1  TYR  37           HD1      TYR  37  10.478   4.498  -0.634
  292    HD2  TYR  37           HD2      TYR  37  10.195   0.691   1.323
  293    HE1  TYR  37           HE1      TYR  37  11.714   3.441  -2.504
  294    HE2  TYR  37           HE2      TYR  37  11.435  -0.368  -0.531
  295    HH   TYR  37           HH       TYR  37  12.855   1.567  -3.129
  296    HA   PRO  38           HA       PRO  38  10.925   5.535   6.021
  297   1HB   PRO  38          2HB       PRO  38  13.487   6.464   5.669
  298   2HB   PRO  38          1HB       PRO  38  13.097   4.967   6.533
  299   1HG   PRO  38          2HG       PRO  38  14.248   5.313   3.802
  300   2HG   PRO  38          1HG       PRO  38  14.431   3.963   4.935
  301   1HD   PRO  38          2HD       PRO  38  12.723   4.004   2.685
  302   2HD   PRO  38          1HD       PRO  38  12.660   2.833   4.019
  303    H    TYR  39           H        TYR  39  12.545   6.455   2.948
  304    HA   TYR  39           HA       TYR  39  12.079   9.250   3.184
  305   1HB   TYR  39          2HB       TYR  39  13.624   8.221   1.521
  306   2HB   TYR  39          1HB       TYR  39  12.227   7.606   0.639
  307    HD1  TYR  39           HD1      TYR  39  14.519  10.267   0.855
  308    HD2  TYR  39           HD2      TYR  39  10.366   9.463   0.103
  309    HE1  TYR  39           HE1      TYR  39  14.306  12.437  -0.322
  310    HE2  TYR  39           HE2      TYR  39  10.154  11.632  -1.067
  311    HH   TYR  39           HH       TYR  39  12.923  13.867  -1.304
  312    H    TYR  40           H        TYR  40  10.124   6.687   1.678
  313    HA   TYR  40           HA       TYR  40   8.031   8.547   0.884
  314   1HB   TYR  40          2HB       TYR  40   8.612   5.703   0.578
  315   2HB   TYR  40          1HB       TYR  40   6.906   6.001   0.917
  316    HD1  TYR  40           HD1      TYR  40   9.412   8.112  -0.884
  317    HD2  TYR  40           HD2      TYR  40   5.794   5.814  -1.143
  318    HE1  TYR  40           HE1      TYR  40   9.074   8.908  -3.211
  319    HE2  TYR  40           HE2      TYR  40   5.454   6.608  -3.472
  320    HH   TYR  40           HH       TYR  40   6.466   9.019  -4.750
  321    H    ARG  41           H        ARG  41   7.432   9.607   2.835
  322    HA   ARG  41           HA       ARG  41   5.599   8.018   4.529
  323   1HB   ARG  41          2HB       ARG  41   7.933   8.048   5.583
  324   2HB   ARG  41          1HB       ARG  41   7.702   9.783   5.797
  325   1HG   ARG  41          2HG       ARG  41   6.462   9.417   7.637
  326   2HG   ARG  41          1HG       ARG  41   5.344   8.419   6.706
  327   1HD   ARG  41          2HD       ARG  41   6.513   6.438   7.184
  328   2HD   ARG  41          1HD       ARG  41   7.990   7.302   7.611
  329    HE   ARG  41           HE       ARG  41   5.544   7.415   9.331
  330   1HH1  ARG  41          1HH1      ARG  41   8.251   5.594   9.232
  331   2HH1  ARG  41          2HH1      ARG  41   8.949   6.152  10.716
  332   1HH2  ARG  41          1HH2      ARG  41   6.728   8.792  11.076
  333   2HH2  ARG  41          2HH2      ARG  41   8.087   7.963  11.759
  334    H    THR  42           H        THR  42   7.128  11.255   4.423
  335    HA   THR  42           HA       THR  42   4.487  12.477   3.934
  336    HB   THR  42           HB       THR  42   5.658  14.014   6.027
  337    HG1  THR  42           HG1      THR  42   6.512  12.535   7.221
  338   1HG2  THR  42          1HG2      THR  42   3.258  12.170   6.132
  339   2HG2  THR  42          2HG2      THR  42   3.240  13.764   5.377
  340   3HG2  THR  42          3HG2      THR  42   3.535  13.611   7.110
  341    H    ALA  43           H        ALA  43   6.921  12.266   2.395
  342    HA   ALA  43           HA       ALA  43   8.122  14.971   2.569
  343   1HB   ALA  43          1HB       ALA  43   8.969  13.164   0.392
  344   2HB   ALA  43          2HB       ALA  43   9.238  12.537   2.019
  345   3HB   ALA  43          3HB       ALA  43   9.946  14.079   1.539
  346    H    ASP  44           H        ASP  44   6.979  12.933  -0.157
  347    HA   ASP  44           HA       ASP  44   5.919  15.447  -1.381
  348   1HB   ASP  44          2HB       ASP  44   6.123  14.083  -3.553
  349   2HB   ASP  44          1HB       ASP  44   7.628  14.622  -2.807
  350    H    LYS  45           H        LYS  45   3.707  15.527  -1.480
  351    HA   LYS  45           HA       LYS  45   2.165  13.040  -1.064
  352   1HB   LYS  45          2HB       LYS  45   1.585  15.152   0.161
  353   2HB   LYS  45          1HB       LYS  45   1.176  15.889  -1.387
  354   1HG   LYS  45          2HG       LYS  45  -0.180  13.429  -1.366
  355   2HG   LYS  45          1HG       LYS  45  -0.406  14.096   0.251
  356   1HD   LYS  45          2HD       LYS  45  -0.771  16.313  -1.341
  357   2HD   LYS  45          1HD       LYS  45  -1.477  15.030  -2.323
  358   1HE   LYS  45          2HE       LYS  45  -2.274  14.651   0.409
  359   2HE   LYS  45          1HE       LYS  45  -2.625  16.313  -0.062
  360   1HZ   LYS  45          1HZ       LYS  45  -4.459  14.845  -0.606
  361   2HZ   LYS  45          2HZ       LYS  45  -3.435  13.877  -1.556
  362   3HZ   LYS  45          3HZ       LYS  45  -3.768  15.477  -2.020
  363    H    GLY  46           H        GLY  46   3.625  13.452  -3.586
  364   1HA   GLY  46          2HA       GLY  46   1.603  14.145  -5.590
  365   2HA   GLY  46          1HA       GLY  46   3.240  13.572  -5.921
  366    H    TRP  47           H        TRP  47   3.422  11.144  -4.819
  367    HA   TRP  47           HA       TRP  47   1.833   9.491  -6.527
  368   1HB   TRP  47          2HB       TRP  47   2.869   7.612  -5.460
  369   2HB   TRP  47          1HB       TRP  47   4.084   8.881  -5.572
  370    HD1  TRP  47           HD1      TRP  47   4.114  10.531  -3.237
  371    HE1  TRP  47           HE1      TRP  47   4.186   9.708  -0.802
  372    HE3  TRP  47           HE3      TRP  47   2.260   5.793  -3.845
  373    HZ2  TRP  47           HZ2      TRP  47   3.557   7.363   0.694
  374    HZ3  TRP  47           HZ3      TRP  47   2.025   4.295  -1.891
  375    HH2  TRP  47           HH2      TRP  47   2.668   5.074   0.373
  376    H    GLN  48           H        GLN  48   0.956  11.035  -3.658
  377    HA   GLN  48           HA       GLN  48  -0.655   9.067  -2.393
  378   1HB   GLN  48          2HB       GLN  48  -0.085  11.627  -1.807
  379   2HB   GLN  48          1HB       GLN  48  -1.677  11.866  -2.526
  380   1HG   GLN  48          2HG       GLN  48  -1.772  11.491  -0.054
  381   2HG   GLN  48          1HG       GLN  48  -2.671  10.281  -0.968
  382   1HE2  GLN  48          1HE2      GLN  48   0.821  10.091  -1.076
  383   2HE2  GLN  48          2HE2      GLN  48   0.976   8.752  -0.045
  384    H    ASN  49           H        ASN  49  -1.836  11.692  -4.522
  385    HA   ASN  49           HA       ASN  49  -4.312  10.291  -5.098
  386   1HB   ASN  49          2HB       ASN  49  -3.276  12.443  -6.903
  387   2HB   ASN  49          1HB       ASN  49  -4.912  12.185  -6.293
  388   1HD2  ASN  49          1HD2      ASN  49  -5.322  12.794  -3.986
  389   2HD2  ASN  49          2HD2      ASN  49  -4.340  13.962  -3.242
  390    H    SER  50           H        SER  50  -1.142   9.946  -6.248
  391    HA   SER  50           HA       SER  50  -1.734   9.250  -8.992
  392   1HB   SER  50          2HB       SER  50   0.525   8.680  -9.166
  393   2HB   SER  50          1HB       SER  50   0.553   9.850  -7.849
  394    HG   SER  50           HG       SER  50   1.032   7.140  -7.844
  395    H    ILE  51           H        ILE  51  -1.145   7.304  -6.059
  396    HA   ILE  51           HA       ILE  51  -1.471   4.746  -7.234
  397    HB   ILE  51           HB       ILE  51  -1.763   5.873  -4.471
  398   1HG1  ILE  51          2HG1      ILE  51   0.144   4.619  -4.013
  399   2HG1  ILE  51          1HG1      ILE  51  -0.210   3.430  -5.247
  400   1HG2  ILE  51          1HG2      ILE  51  -3.057   3.408  -5.446
  401   2HG2  ILE  51          2HG2      ILE  51  -3.369   4.340  -3.982
  402   3HG2  ILE  51          3HG2      ILE  51  -2.037   3.187  -4.026
  403   1HD1  ILE  51          1HD1      ILE  51   1.700   4.855  -5.891
  404   2HD1  ILE  51          2HD1      ILE  51   0.660   6.276  -5.787
  405   3HD1  ILE  51          3HD1      ILE  51   0.346   5.040  -7.005
  406    H    ARG  52           H        ARG  52  -3.928   6.809  -5.645
  407    HA   ARG  52           HA       ARG  52  -6.133   5.090  -5.951
  408   1HB   ARG  52          2HB       ARG  52  -6.410   7.085  -4.663
  409   2HB   ARG  52          1HB       ARG  52  -5.949   8.108  -6.022
  410   1HG   ARG  52          2HG       ARG  52  -7.977   7.244  -7.254
  411   2HG   ARG  52          1HG       ARG  52  -8.468   6.446  -5.759
  412   1HD   ARG  52          2HD       ARG  52  -9.155   8.389  -4.815
  413   2HD   ARG  52          1HD       ARG  52  -7.744   9.271  -5.398
  414    HE   ARG  52           HE       ARG  52 -10.318   9.345  -6.613
  415   1HH1  ARG  52          1HH2      ARG  52  -6.947   9.564  -7.160
  416   2HH1  ARG  52          2HH2      ARG  52  -7.099   9.952  -8.841
  417   1HH2  ARG  52          1HH1      ARG  52 -10.545   9.574  -8.892
  418   2HH2  ARG  52          2HH1      ARG  52  -9.134   9.958  -9.821
  419    H    HIS  53           H        HIS  53  -5.164   7.700  -8.207
  420    HA   HIS  53           HA       HIS  53  -7.077   6.978 -10.215
  421   1HB   HIS  53          2HB       HIS  53  -5.630   9.153  -9.862
  422   2HB   HIS  53          1HB       HIS  53  -4.486   8.317 -10.912
  423    HD1  HIS  53           HD1      HIS  53  -4.855   9.643 -13.058
  424    HD2  HIS  53           HD2      HIS  53  -8.413   8.186 -11.445
  425    HE1  HIS  53           HE1      HIS  53  -6.655  10.070 -14.789
  426    H    ASN  54           H        ASN  54  -3.908   5.722  -9.471
  427    HA   ASN  54           HA       ASN  54  -3.392   4.545 -12.064
  428   1HB   ASN  54          2HB       ASN  54  -2.249   4.224  -9.305
  429   2HB   ASN  54          1HB       ASN  54  -1.824   3.061 -10.562
  430   1HD2  ASN  54          1HD2      ASN  54  -0.586   5.743  -9.173
  431   2HD2  ASN  54          2HD2      ASN  54   0.185   6.459 -10.505
  432    H    LEU  55           H        LEU  55  -4.639   3.256  -9.004
  433    HA   LEU  55           HA       LEU  55  -4.962   0.574  -9.818
  434   1HB   LEU  55          2HB       LEU  55  -6.611   2.177  -7.845
  435   2HB   LEU  55          1HB       LEU  55  -6.537   0.416  -7.929
  436    HG   LEU  55           HG       LEU  55  -4.136   2.208  -7.456
  437   1HD1  LEU  55          1HD1      LEU  55  -4.557   2.148  -5.240
  438   2HD1  LEU  55          2HD1      LEU  55  -4.965   0.433  -5.290
  439   3HD1  LEU  55          3HD1      LEU  55  -6.192   1.642  -5.671
  440   1HD2  LEU  55          1HD2      LEU  55  -4.094  -0.632  -6.684
  441   2HD2  LEU  55          2HD2      LEU  55  -2.880   0.317  -7.542
  442   3HD2  LEU  55          3HD2      LEU  55  -4.246  -0.370  -8.419
  443    H    SER  56           H        SER  56  -6.641   3.339 -10.900
  444    HA   SER  56           HA       SER  56  -9.098   1.843 -11.559
  445   1HB   SER  56          2HB       SER  56  -8.632   4.496 -11.015
  446   2HB   SER  56          1HB       SER  56  -8.707   4.500 -12.775
  447    HG   SER  56           HG       SER  56 -10.746   4.656 -11.411
  448    H    LEU  57           H        LEU  57  -6.443   3.488 -13.302
  449    HA   LEU  57           HA       LEU  57  -7.339   2.256 -15.828
  450   1HB   LEU  57          2HB       LEU  57  -5.442   3.559 -16.802
  451   2HB   LEU  57          1HB       LEU  57  -6.601   4.564 -15.939
  452    HG   LEU  57           HG       LEU  57  -4.733   3.733 -14.001
  453   1HD1  LEU  57          1HD1      LEU  57  -3.452   3.346 -16.355
  454   2HD1  LEU  57          2HD1      LEU  57  -2.627   3.881 -14.891
  455   3HD1  LEU  57          3HD1      LEU  57  -3.114   5.060 -16.109
  456   1HD2  LEU  57          1HD2      LEU  57  -5.841   5.888 -13.989
  457   2HD2  LEU  57          2HD2      LEU  57  -5.102   6.326 -15.530
  458   3HD2  LEU  57          3HD2      LEU  57  -4.104   6.177 -14.083
  459    H    ASN  58           H        ASN  58  -5.861   0.891 -13.360
  460    HA   ASN  58           HA       ASN  58  -3.487  -0.162 -14.759
  461   1HB   ASN  58          2HB       ASN  58  -4.478  -0.204 -11.990
  462   2HB   ASN  58          1HB       ASN  58  -3.822  -1.749 -12.526
  463   1HD2  ASN  58          1HD2      ASN  58  -2.898   1.705 -13.104
  464   2HD2  ASN  58          2HD2      ASN  58  -1.262   1.475 -12.716
  465    H    ARG  59           H        ARG  59  -3.240  -2.401 -15.311
  466    HA   ARG  59           HA       ARG  59  -5.777  -3.622 -16.168
  467   1HB   ARG  59          2HB       ARG  59  -4.122  -5.370 -17.153
  468   2HB   ARG  59          1HB       ARG  59  -4.170  -3.759 -17.868
  469   1HG   ARG  59          2HG       ARG  59  -2.311  -3.898 -15.621
  470   2HG   ARG  59          1HG       ARG  59  -1.903  -5.050 -16.890
  471   1HD   ARG  59          2HD       ARG  59  -1.025  -3.363 -18.086
  472   2HD   ARG  59          1HD       ARG  59  -2.635  -2.658 -18.206
  473    HE   ARG  59           HE       ARG  59  -2.024  -1.089 -16.546
  474   1HH1  ARG  59          1HH2      ARG  59   0.657  -2.882 -17.491
  475   2HH1  ARG  59          2HH2      ARG  59   1.606  -2.526 -16.088
  476   1HH2  ARG  59          1HH1      ARG  59  -0.992  -0.979 -14.392
  477   2HH2  ARG  59          2HH1      ARG  59   0.674  -1.449 -14.335
  478    H    TYR  60           H        TYR  60  -3.764  -3.879 -13.429
  479    HA   TYR  60           HA       TYR  60  -5.109  -6.462 -12.779
  480   1HB   TYR  60          2HB       TYR  60  -2.975  -7.093 -11.526
  481   2HB   TYR  60          1HB       TYR  60  -2.914  -7.195 -13.283
  482    HD1  TYR  60           HD1      TYR  60  -1.854  -5.345 -14.590
  483    HD2  TYR  60           HD2      TYR  60  -1.569  -5.562 -10.313
  484    HE1  TYR  60           HE1      TYR  60   0.067  -3.788 -14.647
  485    HE2  TYR  60           HE2      TYR  60   0.353  -4.002 -10.370
  486    HH   TYR  60           HH       TYR  60   2.112  -3.303 -12.014
  487    H    PHE  61           H        PHE  61  -6.082  -4.015 -11.929
  488    HA   PHE  61           HA       PHE  61  -5.661  -4.289  -9.012
  489   1HB   PHE  61          2HB       PHE  61  -5.171  -1.790 -10.613
  490   2HB   PHE  61          1HB       PHE  61  -5.730  -1.678  -8.942
  491    HD1  PHE  61           HD1      PHE  61  -4.437  -3.325  -7.249
  492    HD2  PHE  61           HD2      PHE  61  -2.872  -1.881 -10.971
  493    HE1  PHE  61           HE1      PHE  61  -2.141  -3.771  -6.470
  494    HE2  PHE  61           HE2      PHE  61  -0.594  -2.325 -10.196
  495    HZ   PHE  61           HZ       PHE  61  -0.210  -3.272  -7.935
  496    H    ILE  62           H        ILE  62  -7.702  -5.013  -8.654
  497    HA   ILE  62           HA       ILE  62  -9.957  -3.295  -9.622
  498    HB   ILE  62           HB       ILE  62 -11.348  -5.234  -9.684
  499   1HG1  ILE  62          2HG1      ILE  62  -9.081  -6.734  -8.329
  500   2HG1  ILE  62          1HG1      ILE  62 -10.548  -6.184  -7.521
  501   1HG2  ILE  62          1HG2      ILE  62  -9.548  -5.007 -11.481
  502   2HG2  ILE  62          2HG2      ILE  62 -10.235  -6.620 -11.285
  503   3HG2  ILE  62          3HG2      ILE  62  -8.651  -6.248 -10.607
  504   1HD1  ILE  62          1HD1      ILE  62 -11.652  -8.011  -8.223
  505   2HD1  ILE  62          2HD1      ILE  62 -10.165  -8.602  -8.965
  506   3HD1  ILE  62          3HD1      ILE  62 -11.285  -7.610  -9.901
  507    H    LYS  63           H        LYS  63 -11.601  -2.764  -8.109
  508    HA   LYS  63           HA       LYS  63 -10.792  -3.158  -5.260
  509   1HB   LYS  63          2HB       LYS  63 -12.153  -1.181  -4.766
  510   2HB   LYS  63          1HB       LYS  63 -10.990  -0.801  -6.038
  511   1HG   LYS  63          2HG       LYS  63 -13.354  -1.850  -7.267
  512   2HG   LYS  63          1HG       LYS  63 -13.830  -0.578  -6.140
  513   1HD   LYS  63          2HD       LYS  63 -11.760   0.685  -7.235
  514   2HD   LYS  63          1HD       LYS  63 -12.111  -0.401  -8.581
  515   1HE   LYS  63          2HE       LYS  63 -14.590   0.377  -8.205
  516   2HE   LYS  63          1HE       LYS  63 -13.841   1.743  -7.380
  517   1HZ   LYS  63          1HZ       LYS  63 -14.246   1.583 -10.036
  518   2HZ   LYS  63          2HZ       LYS  63 -12.626   1.085  -9.908
  519   3HZ   LYS  63          3HZ       LYS  63 -13.105   2.593  -9.291
  520    H    VAL  64           H        VAL  64 -13.282  -2.590  -4.084
  521    HA   VAL  64           HA       VAL  64 -15.174  -4.569  -5.228
  522    HB   VAL  64           HB       VAL  64 -13.906  -5.985  -3.781
  523   1HG1  VAL  64          1HG1      VAL  64 -13.558  -5.296  -1.358
  524   2HG1  VAL  64          2HG1      VAL  64 -14.092  -3.681  -1.825
  525   3HG1  VAL  64          3HG1      VAL  64 -12.634  -4.370  -2.540
  526   1HG2  VAL  64          1HG2      VAL  64 -15.817  -5.527  -1.668
  527   2HG2  VAL  64          2HG2      VAL  64 -15.776  -6.833  -2.852
  528   3HG2  VAL  64          3HG2      VAL  64 -16.605  -5.324  -3.232
  529    HA   PRO  65           HA       PRO  65 -17.336  -0.930  -3.516
  530   1HB   PRO  65          2HB       PRO  65 -19.064  -0.723  -5.645
  531   2HB   PRO  65          1HB       PRO  65 -17.462   0.035  -5.608
  532   1HG   PRO  65          2HG       PRO  65 -18.361  -2.382  -7.107
  533   2HG   PRO  65          1HG       PRO  65 -17.057  -1.246  -7.488
  534   1HD   PRO  65          2HD       PRO  65 -16.732  -3.813  -6.345
  535   2HD   PRO  65          1HD       PRO  65 -15.495  -2.540  -6.419
  536    H    ARG  66           H        ARG  66 -19.727  -0.734  -3.013
  537    HA   ARG  66           HA       ARG  66 -21.330  -3.191  -3.279
  538   1HB   ARG  66          2HB       ARG  66 -19.835  -3.406  -1.193
  539   2HB   ARG  66          1HB       ARG  66 -20.806  -2.104  -0.507
  540   1HG   ARG  66          2HG       ARG  66 -22.023  -3.928   0.231
  541   2HG   ARG  66          1HG       ARG  66 -22.816  -3.646  -1.318
  542   1HD   ARG  66          2HD       ARG  66 -20.669  -5.242  -2.019
  543   2HD   ARG  66          1HD       ARG  66 -21.158  -5.908  -0.461
  544    HE   ARG  66           HE       ARG  66 -23.474  -5.486  -2.107
  545   1HH1  ARG  66          1HH2      ARG  66 -20.815  -7.561  -1.412
  546   2HH1  ARG  66          2HH2      ARG  66 -21.479  -8.917  -2.259
  547   1HH2  ARG  66          1HH1      ARG  66 -24.292  -7.205  -3.341
  548   2HH2  ARG  66          2HH1      ARG  66 -23.446  -8.716  -3.350
  549    H    SER  67           H        SER  67 -23.255  -2.361  -3.933
  550    HA   SER  67           HA       SER  67 -24.431  -0.125  -2.384
  551   1HB   SER  67          2HB       SER  67 -23.644  -0.030  -5.265
  552   2HB   SER  67          1HB       SER  67 -25.147   0.757  -4.794
  553    HG   SER  67           HG       SER  67 -22.715   1.153  -3.404
  554    H    GLN  68           H        GLN  68 -24.855  -3.122  -3.105
  555    HA   GLN  68           HA       GLN  68 -27.583  -2.917  -4.270
  556   1HB   GLN  68          2HB       GLN  68 -25.810  -4.642  -5.033
  557   2HB   GLN  68          1HB       GLN  68 -26.172  -5.477  -3.522
  558   1HG   GLN  68          2HG       GLN  68 -27.541  -6.321  -5.429
  559   2HG   GLN  68          1HG       GLN  68 -28.530  -5.643  -4.134
  560   1HE2  GLN  68          1HE2      GLN  68 -29.604  -3.582  -4.531
  561   2HE2  GLN  68          2HE2      GLN  68 -29.723  -2.932  -6.095
  562    H    GLU  69           H        GLU  69 -26.153  -2.871  -1.248
  563    HA   GLU  69           HA       GLU  69 -28.695  -3.817  -0.004
  564   1HB   GLU  69          2HB       GLU  69 -26.201  -5.130   0.193
  565   2HB   GLU  69          1HB       GLU  69 -26.441  -4.309   1.735
  566   1HG   GLU  69          2HG       GLU  69 -27.818  -5.994   2.315
  567   2HG   GLU  69          1HG       GLU  69 -28.949  -5.390   1.105
  568    H    GLU  70           H        GLU  70 -25.592  -2.462   1.159
  569    HA   GLU  70           HA       GLU  70 -27.125  -0.502   2.761
  570   1HB   GLU  70          2HB       GLU  70 -24.304  -1.509   2.738
  571   2HB   GLU  70          1HB       GLU  70 -24.621   0.087   3.419
  572   1HG   GLU  70          2HG       GLU  70 -26.400  -2.173   4.243
  573   2HG   GLU  70          1HG       GLU  70 -24.776  -2.101   4.928
  574    HA   PRO  71           HA       PRO  71 -26.389   2.785  -0.056
  575   1HB   PRO  71          2HB       PRO  71 -26.615   4.882   1.709
  576   2HB   PRO  71          1HB       PRO  71 -28.000   3.956   1.107
  577   1HG   PRO  71          2HG       PRO  71 -26.695   3.854   3.790
  578   2HG   PRO  71          1HG       PRO  71 -28.370   3.488   3.343
  579   1HD   PRO  71          2HD       PRO  71 -26.347   1.582   3.850
  580   2HD   PRO  71          1HD       PRO  71 -27.906   1.261   3.061
  581    H    GLY  72           H        GLY  72 -24.227   1.945   2.395
  582   1HA   GLY  72          2HA       GLY  72 -22.382   4.203   2.005
  583   2HA   GLY  72          1HA       GLY  72 -22.093   2.792   3.027
  584    H    LYS  73           H        LYS  73 -21.524   4.205  -0.052
  585    HA   LYS  73           HA       LYS  73 -20.952   1.881  -1.607
  586   1HB   LYS  73          2HB       LYS  73 -20.617   4.731  -1.851
  587   2HB   LYS  73          1HB       LYS  73 -19.128   3.926  -2.350
  588   1HG   LYS  73          2HG       LYS  73 -20.691   2.342  -3.693
  589   2HG   LYS  73          1HG       LYS  73 -21.907   3.601  -3.473
  590   1HD   LYS  73          2HD       LYS  73 -19.212   4.463  -4.414
  591   2HD   LYS  73          1HD       LYS  73 -20.234   3.606  -5.568
  592   1HE   LYS  73          2HE       LYS  73 -21.632   5.369  -5.796
  593   2HE   LYS  73          1HE       LYS  73 -21.700   5.638  -4.054
  594   1HZ   LYS  73          1HZ       LYS  73 -19.219   6.426  -4.569
  595   2HZ   LYS  73          2HZ       LYS  73 -20.553   7.478  -4.601
  596   3HZ   LYS  73          3HZ       LYS  73 -19.948   6.822  -6.048
  597    H    GLY  74           H        GLY  74 -19.368   0.388  -1.306
  598   1HA   GLY  74          2HA       GLY  74 -17.350   0.709   0.741
  599   2HA   GLY  74          1HA       GLY  74 -17.448  -0.630  -0.403
  600    H    SER  75           H        SER  75 -14.937   0.176   0.033
  601    HA   SER  75           HA       SER  75 -14.126   1.235  -2.553
  602   1HB   SER  75          2HB       SER  75 -12.890   2.923  -0.513
  603   2HB   SER  75          1HB       SER  75 -13.649   3.388  -2.034
  604    HG   SER  75           HG       SER  75 -14.871   4.201  -0.350
  605    H    PHE  76           H        PHE  76 -13.574  -1.199  -1.266
  606    HA   PHE  76           HA       PHE  76 -10.880  -0.950  -0.083
  607   1HB   PHE  76          2HB       PHE  76 -12.922  -2.741   0.331
  608   2HB   PHE  76          1HB       PHE  76 -11.856  -3.650  -0.742
  609    HD1  PHE  76           HD1      PHE  76  -9.246  -3.354  -0.156
  610    HD2  PHE  76           HD2      PHE  76 -12.488  -2.873   2.619
  611    HE1  PHE  76           HE1      PHE  76  -7.694  -3.764   1.735
  612    HE2  PHE  76           HE2      PHE  76 -10.931  -3.288   4.505
  613    HZ   PHE  76           HZ       PHE  76  -8.536  -3.735   4.061
  614    H    TRP  77           H        TRP  77  -9.126  -0.907  -1.367
  615    HA   TRP  77           HA       TRP  77  -9.324  -1.592  -4.205
  616   1HB   TRP  77          2HB       TRP  77  -7.406  -0.232  -2.421
  617   2HB   TRP  77          1HB       TRP  77  -6.669  -1.135  -3.745
  618    HD1  TRP  77           HD1      TRP  77  -7.890   2.169  -3.049
  619    HE1  TRP  77           HE1      TRP  77  -8.556   3.422  -5.201
  620    HE3  TRP  77           HE3      TRP  77  -8.103  -1.746  -6.316
  621    HZ2  TRP  77           HZ2      TRP  77  -9.099   2.839  -7.946
  622    HZ3  TRP  77           HZ3      TRP  77  -8.694  -1.370  -8.692
  623    HH2  TRP  77           HH2      TRP  77  -9.186   0.915  -9.507
  624    H    ARG  78           H        ARG  78  -8.278  -3.318  -5.230
  625    HA   ARG  78           HA       ARG  78  -6.621  -5.184  -3.662
  626   1HB   ARG  78          2HB       ARG  78  -9.003  -6.339  -5.104
  627   2HB   ARG  78          1HB       ARG  78  -8.004  -7.080  -3.857
  628   1HG   ARG  78          2HG       ARG  78  -8.894  -5.247  -2.290
  629   2HG   ARG  78          1HG       ARG  78 -10.108  -4.940  -3.531
  630   1HD   ARG  78          2HD       ARG  78  -9.745  -7.787  -2.826
  631   2HD   ARG  78          1HD       ARG  78 -10.394  -6.781  -1.531
  632    HE   ARG  78           HE       ARG  78 -12.360  -6.436  -2.832
  633   1HH1  ARG  78          1HH1      ARG  78 -10.972  -5.973  -5.476
  634   2HH1  ARG  78          2HH1      ARG  78 -11.503  -7.344  -6.391
  635   1HH2  ARG  78          1HH2      ARG  78 -12.585  -9.114  -3.615
  636   2HH2  ARG  78          2HH2      ARG  78 -12.415  -9.122  -5.339
  637    H    ILE  79           H        ILE  79  -5.769  -6.955  -5.180
  638    HA   ILE  79           HA       ILE  79  -5.546  -5.834  -7.949
  639    HB   ILE  79           HB       ILE  79  -3.352  -6.680  -8.100
  640   1HG1  ILE  79          2HG1      ILE  79  -4.190  -8.464  -5.803
  641   2HG1  ILE  79          1HG1      ILE  79  -3.567  -8.937  -7.382
  642   1HG2  ILE  79          1HG2      ILE  79  -3.440  -6.082  -5.159
  643   2HG2  ILE  79          2HG2      ILE  79  -3.797  -4.831  -6.348
  644   3HG2  ILE  79          3HG2      ILE  79  -2.224  -5.624  -6.352
  645   1HD1  ILE  79          1HD1      ILE  79  -2.105  -8.208  -4.940
  646   2HD1  ILE  79          2HD1      ILE  79  -1.523  -7.369  -6.377
  647   3HD1  ILE  79          3HD1      ILE  79  -1.560  -9.132  -6.341
  648    H    ASP  80           H        ASP  80  -5.303  -7.549  -9.675
  649    HA   ASP  80           HA       ASP  80  -7.437  -9.429  -9.548
  650   1HB   ASP  80          2HB       ASP  80  -5.026  -9.196 -11.352
  651   2HB   ASP  80          1HB       ASP  80  -6.214 -10.481 -11.556
  652    HA   PRO  81           HA       PRO  81  -5.623 -12.729  -7.304
  653   1HB   PRO  81          2HB       PRO  81  -7.203 -14.775  -8.236
  654   2HB   PRO  81          1HB       PRO  81  -7.756 -13.556  -7.075
  655   1HG   PRO  81          2HG       PRO  81  -8.404 -13.816  -9.974
  656   2HG   PRO  81          1HG       PRO  81  -9.350 -13.069  -8.676
  657   1HD   PRO  81          2HD       PRO  81  -7.793 -11.693 -10.601
  658   2HD   PRO  81          1HD       PRO  81  -8.475 -10.995  -9.115
  659    H    ALA  82           H        ALA  82  -6.249 -13.569 -10.742
  660    HA   ALA  82           HA       ALA  82  -3.957 -15.432 -10.692
  661   1HB   ALA  82          1HB       ALA  82  -5.152 -14.934 -13.308
  662   2HB   ALA  82          2HB       ALA  82  -6.362 -15.363 -12.097
  663   3HB   ALA  82          3HB       ALA  82  -5.007 -16.448 -12.413
  664    H    SER  83           H        SER  83  -3.899 -12.288 -10.684
  665    HA   SER  83           HA       SER  83  -1.888 -12.100 -12.890
  666   1HB   SER  83          2HB       SER  83  -3.312  -9.729 -11.694
  667   2HB   SER  83          1HB       SER  83  -2.466  -9.831 -13.233
  668    HG   SER  83           HG       SER  83  -4.234 -11.627 -13.491
  669    H    GLU  84           H        GLU  84  -2.392 -12.132  -9.557
  670    HA   GLU  84           HA       GLU  84  -0.561 -10.189  -8.610
  671   1HB   GLU  84          2HB       GLU  84  -1.910 -11.199  -6.962
  672   2HB   GLU  84          1HB       GLU  84  -1.538 -12.828  -7.525
  673   1HG   GLU  84          2HG       GLU  84   0.723 -12.676  -6.673
  674   2HG   GLU  84          1HG       GLU  84   0.509 -10.971  -6.280
  675    H    ALA  85           H        ALA  85   0.033 -13.267 -10.164
  676    HA   ALA  85           HA       ALA  85   2.803 -13.396  -9.204
  677   1HB   ALA  85          1HB       ALA  85   0.988 -15.100 -10.718
  678   2HB   ALA  85          2HB       ALA  85   2.415 -15.545  -9.783
  679   3HB   ALA  85          3HB       ALA  85   2.584 -15.038 -11.464
  680    H    LYS  86           H        LYS  86   1.126 -11.924 -11.881
  681    HA   LYS  86           HA       LYS  86   3.651 -11.547 -13.378
  682   1HB   LYS  86          2HB       LYS  86   2.109 -10.322 -14.992
  683   2HB   LYS  86          1HB       LYS  86   1.773 -12.037 -14.775
  684   1HG   LYS  86          2HG       LYS  86  -0.058 -11.571 -13.286
  685   2HG   LYS  86          1HG       LYS  86   0.368  -9.861 -13.206
  686   1HD   LYS  86          2HD       LYS  86   0.011 -10.751 -15.958
  687   2HD   LYS  86          1HD       LYS  86  -1.440 -11.023 -14.992
  688   1HE   LYS  86          2HE       LYS  86  -1.774  -8.774 -14.606
  689   2HE   LYS  86          1HE       LYS  86  -0.052  -8.400 -14.674
  690   1HZ   LYS  86          1HZ       LYS  86  -0.142  -8.043 -16.861
  691   2HZ   LYS  86          2HZ       LYS  86  -1.823  -7.922 -16.650
  692   3HZ   LYS  86          3HZ       LYS  86  -1.131  -9.391 -17.152
  693    H    LEU  87           H        LEU  87   1.367  -9.688 -11.431
  694    HA   LEU  87           HA       LEU  87   2.600  -7.141 -12.057
  695   1HB   LEU  87          2HB       LEU  87   1.346  -6.452  -9.859
  696   2HB   LEU  87          1HB       LEU  87   0.440  -6.806 -11.304
  697    HG   LEU  87           HG       LEU  87   0.770  -9.266  -9.898
  698   1HD1  LEU  87          1HD1      LEU  87   0.985  -8.416  -7.777
  699   2HD1  LEU  87          2HD1      LEU  87  -0.763  -8.287  -7.934
  700   3HD1  LEU  87          3HD1      LEU  87   0.252  -6.873  -8.209
  701   1HD2  LEU  87          1HD2      LEU  87  -1.685  -9.163  -9.834
  702   2HD2  LEU  87          2HD2      LEU  87  -1.105  -8.615 -11.407
  703   3HD2  LEU  87          3HD2      LEU  87  -1.633  -7.440 -10.201
  704    H    VAL  88           H        VAL  88   2.721  -9.345  -9.320
  705    HA   VAL  88           HA       VAL  88   4.425  -7.951  -7.614
  706    HB   VAL  88           HB       VAL  88   5.243 -10.209  -6.983
  707   1HG1  VAL  88          1HG1      VAL  88   2.814 -11.089  -6.533
  708   2HG1  VAL  88          2HG1      VAL  88   2.339  -9.541  -7.232
  709   3HG1  VAL  88          3HG1      VAL  88   3.340  -9.582  -5.781
  710   1HG2  VAL  88          1HG2      VAL  88   3.764 -12.039  -8.200
  711   2HG2  VAL  88          2HG2      VAL  88   5.298 -11.516  -8.894
  712   3HG2  VAL  88          3HG2      VAL  88   3.783 -10.851  -9.501
  713    H    GLU  89           H        GLU  89   5.195  -9.577 -10.629
  714    HA   GLU  89           HA       GLU  89   7.985  -9.869 -10.366
  715   1HB   GLU  89          2HB       GLU  89   6.390  -9.069 -12.821
  716   2HB   GLU  89          1HB       GLU  89   8.064  -9.625 -12.849
  717   1HG   GLU  89          2HG       GLU  89   6.945 -11.619 -11.399
  718   2HG   GLU  89          1HG       GLU  89   5.566 -11.167 -12.404
  719    H    GLN  90           H        GLN  90   6.114  -7.017 -11.391
  720    HA   GLN  90           HA       GLN  90   8.541  -5.376 -11.565
  721   1HB   GLN  90          2HB       GLN  90   5.593  -4.666 -11.710
  722   2HB   GLN  90          1HB       GLN  90   6.909  -3.520 -11.970
  723   1HG   GLN  90          2HG       GLN  90   7.246  -4.254 -14.076
  724   2HG   GLN  90          1HG       GLN  90   7.265  -5.939 -13.554
  725   1HE2  GLN  90          1HE2      GLN  90   4.612  -3.509 -13.335
  726   2HE2  GLN  90          2HE2      GLN  90   3.502  -4.424 -14.236
  727    H    ALA  91           H        ALA  91   6.385  -6.400  -9.127
  728    HA   ALA  91           HA       ALA  91   6.382  -4.134  -7.407
  729   1HB   ALA  91          1HB       ALA  91   4.847  -5.872  -6.912
  730   2HB   ALA  91          2HB       ALA  91   6.005  -5.860  -5.582
  731   3HB   ALA  91          3HB       ALA  91   6.130  -7.080  -6.849
  732    H    PHE  92           H        PHE  92   8.617  -6.920  -7.561
  733    HA   PHE  92           HA       PHE  92  10.326  -5.694  -5.495
  734   1HB   PHE  92          2HB       PHE  92  10.920  -8.135  -7.187
  735   2HB   PHE  92          1HB       PHE  92  11.652  -7.696  -5.645
  736    HD1  PHE  92           HD1      PHE  92   9.429  -6.911  -3.973
  737    HD2  PHE  92           HD2      PHE  92   9.652 -10.073  -6.871
  738    HE1  PHE  92           HE1      PHE  92   7.643  -8.140  -2.770
  739    HE2  PHE  92           HE2      PHE  92   7.865 -11.302  -5.669
  740    HZ   PHE  92           HZ       PHE  92   6.860 -10.335  -3.619
  741    H    ARG  93           H        ARG  93   9.866  -4.585  -8.364
  742    HA   ARG  93           HA       ARG  93  12.744  -4.487  -9.169
  743   1HB   ARG  93          2HB       ARG  93  10.386  -4.908 -10.676
  744   2HB   ARG  93          1HB       ARG  93  10.962  -3.296 -11.101
  745   1HG   ARG  93          2HG       ARG  93  12.670  -4.153 -12.289
  746   2HG   ARG  93          1HG       ARG  93  13.186  -5.137 -10.919
  747   1HD   ARG  93          2HD       ARG  93  11.472  -6.828 -11.499
  748   2HD   ARG  93          1HD       ARG  93  10.998  -5.855 -12.892
  749    HE   ARG  93           HE       ARG  93  13.200  -6.323 -13.882
  750   1HH1  ARG  93          1HH2      ARG  93  14.740  -6.920 -11.403
  751   2HH1  ARG  93          2HH2      ARG  93  14.869  -8.646 -11.450
  752   1HH2  ARG  93          1HH1      ARG  93  12.332  -9.035 -13.783
  753   2HH2  ARG  93          2HH1      ARG  93  13.505  -9.844 -12.798
  754    H    LYS  94           H        LYS  94  12.873  -2.186 -10.574
  755    HA   LYS  94           HA       LYS  94  12.031  -0.084  -8.615
  756   1HB   LYS  94          2HB       LYS  94  14.648  -0.726  -9.782
  757   2HB   LYS  94          1HB       LYS  94  14.202   0.969  -9.975
  758   1HG   LYS  94          2HG       LYS  94  14.464   1.393  -7.771
  759   2HG   LYS  94          1HG       LYS  94  13.574  -0.058  -7.308
  760   1HD   LYS  94          2HD       LYS  94  15.468  -1.323  -7.122
  761   2HD   LYS  94          1HD       LYS  94  16.258  -0.519  -8.481
  762   1HE   LYS  94          2HE       LYS  94  17.495   0.157  -6.563
  763   2HE   LYS  94          1HE       LYS  94  16.457   1.530  -6.946
  764   1HZ   LYS  94          1HZ       LYS  94  15.768   1.374  -4.852
  765   2HZ   LYS  94          2HZ       LYS  94  16.466  -0.161  -4.634
  766   3HZ   LYS  94          3HZ       LYS  94  14.919  -0.017  -5.324
  767    H    ARG  95           H        ARG  95  12.624   2.164 -10.076
  768    HA   ARG  95           HA       ARG  95  10.515   2.098 -12.106
  769   1HB   ARG  95          2HB       ARG  95  11.293   4.038 -10.422
  770   2HB   ARG  95          1HB       ARG  95  12.292   4.476 -11.808
  771   1HG   ARG  95          2HG       ARG  95  10.190   4.333 -13.228
  772   2HG   ARG  95          1HG       ARG  95   9.280   4.207 -11.722
  773   1HD   ARG  95          2HD       ARG  95   9.228   6.492 -11.922
  774   2HD   ARG  95          1HD       ARG  95  10.798   6.356 -11.129
  775    HE   ARG  95           HE       ARG  95  11.780   6.409 -13.484
  776   1HH1  ARG  95          1HH1      ARG  95  10.700   9.094 -12.577
  777   2HH1  ARG  95          2HH1      ARG  95   9.781   9.579 -13.962
  778   1HH2  ARG  95          1HH2      ARG  95   9.711   6.409 -15.362
  779   2HH2  ARG  95          2HH2      ARG  95   9.222   8.061 -15.537
  780    H    ARG  96           H        ARG  96  11.384   0.749 -13.755
  781    HA   ARG  96           HA       ARG  96  13.661   1.979 -15.259
  782   1HB   ARG  96          2HB       ARG  96  13.479  -0.634 -14.132
  783   2HB   ARG  96          1HB       ARG  96  13.403  -0.805 -15.886
  784   1HG   ARG  96          2HG       ARG  96  15.540  -0.051 -16.188
  785   2HG   ARG  96          1HG       ARG  96  15.423   1.113 -14.867
  786   1HD   ARG  96          2HD       ARG  96  16.677  -0.322 -13.658
  787   2HD   ARG  96          1HD       ARG  96  15.248  -1.354 -13.588
  788    HE   ARG  96           HE       ARG  96  17.611  -2.070 -14.920
  789   1HH1  ARG  96          1HH1      ARG  96  15.081  -3.755 -14.657
  790   2HH1  ARG  96          2HH1      ARG  96  14.696  -4.041 -16.321
  791   1HH2  ARG  96          1HH2      ARG  96  16.774  -1.531 -17.507
  792   2HH2  ARG  96          2HH2      ARG  96  15.655  -2.781 -17.934
  793    H    GLN  97           H        GLN  97  13.500   0.459 -17.561
  794    HA   GLN  97           HA       GLN  97  10.841   1.296 -18.616
  795   1HB   GLN  97          2HB       GLN  97  13.583   1.072 -19.775
  796   2HB   GLN  97          1HB       GLN  97  12.219   0.760 -20.849
  797   1HG   GLN  97          2HG       GLN  97  11.322   2.924 -20.534
  798   2HG   GLN  97          1HG       GLN  97  12.288   3.206 -19.083
  799   1HE2  GLN  97          1HE2      GLN  97  12.360   3.230 -22.612
  800   2HE2  GLN  97          2HE2      GLN  97  13.899   3.930 -22.758
  801    H    ARG  98           H        ARG  98  10.172  -0.203 -20.575
  802    HA   ARG  98           HA       ARG  98   9.960  -2.915 -19.462
  803   1HB   ARG  98          2HB       ARG  98   8.714  -1.457 -21.780
  804   2HB   ARG  98          1HB       ARG  98   8.644  -3.217 -21.719
  805   1HG   ARG  98          2HG       ARG  98   7.759  -2.957 -19.331
  806   2HG   ARG  98          1HG       ARG  98   7.542  -1.247 -19.709
  807   1HD   ARG  98          2HD       ARG  98   6.132  -3.633 -20.862
  808   2HD   ARG  98          1HD       ARG  98   5.457  -2.104 -20.295
  809    HE   ARG  98           HE       ARG  98   6.847  -2.485 -22.908
  810   1HH1  ARG  98          1HH2      ARG  98   7.113   0.300 -22.003
  811   2HH1  ARG  98          2HH2      ARG  98   5.669   1.047 -22.598
  812   1HH2  ARG  98          1HH1      ARG  98   4.014  -1.955 -23.126
  813   2HH2  ARG  98          2HH1      ARG  98   3.915  -0.229 -23.234
  814    H    GLY  99           H        GLY  99  11.072  -4.691 -20.190
  815   1HA   GLY  99          2HA       GLY  99  12.563  -4.492 -22.751
  816   2HA   GLY  99          1HA       GLY  99  13.480  -4.850 -21.288
  817    H    VAL 100           H        VAL 100  10.362  -5.976 -22.653
  818    HA   VAL 100           HA       VAL 100  11.413  -8.734 -22.720
  819    HB   VAL 100           HB       VAL 100   9.494  -9.591 -21.378
  820   1HG1  VAL 100          1HG1      VAL 100  11.018  -7.520 -19.788
  821   2HG1  VAL 100          2HG1      VAL 100  11.791  -8.981 -20.406
  822   3HG1  VAL 100          3HG1      VAL 100  10.460  -9.106 -19.256
  823   1HG2  VAL 100          1HG2      VAL 100   7.779  -8.232 -20.839
  824   2HG2  VAL 100          2HG2      VAL 100   8.566  -6.939 -21.742
  825   3HG2  VAL 100          3HG2      VAL 100   8.876  -7.122 -20.016
  826    H    SER 101           HN       SER 101  10.658  -9.664 -24.561
  827    HA   SER 101           HA       SER 101   7.995  -8.795 -25.588
  828   1HB   SER 101          2HB       SER 101  10.528  -8.232 -26.782
  829   2HB   SER 101          1HB       SER 101   9.705  -9.413 -27.796
  830    HG   SER 101           HG       SER 101   9.275  -6.885 -27.793
  Start of MODEL    9
    1   1H    GLU   1          1HT       GLU   1  17.779   8.538  -1.300
    2   2H    GLU   1          2HT       GLU   1  16.593   9.026  -0.188
    3   3H    GLU   1          3HT       GLU   1  18.235   9.303   0.143
    4    HA   GLU   1           HA       GLU   1  16.891  11.281  -0.647
    5   1HB   GLU   1          2HB       GLU   1  18.775  12.100  -1.999
    6   2HB   GLU   1          1HB       GLU   1  19.371  11.199  -0.605
    7   1HG   GLU   1          2HG       GLU   1  19.294   9.151  -2.251
    8   2HG   GLU   1          1HG       GLU   1  19.332  10.397  -3.499
    9    H    SER   2           H        SER   2  16.711  12.395  -2.942
   10    HA   SER   2           HA       SER   2  15.361  12.418  -4.877
   11   1HB   SER   2          2HB       SER   2  17.552  10.531  -5.201
   12   2HB   SER   2          1HB       SER   2  16.160  10.065  -6.176
   13    HG   SER   2           HG       SER   2  17.844  11.757  -6.922
   14    H    LYS   3           H        LYS   3  14.250  10.363  -6.398
   15    HA   LYS   3           HA       LYS   3  12.388   9.153  -4.408
   16   1HB   LYS   3          2HB       LYS   3  11.939   9.576  -7.375
   17   2HB   LYS   3          1HB       LYS   3  10.739   9.077  -6.184
   18   1HG   LYS   3          2HG       LYS   3  10.372  11.407  -6.468
   19   2HG   LYS   3          1HG       LYS   3  11.280  11.273  -4.963
   20   1HD   LYS   3          2HD       LYS   3  13.165  12.224  -5.852
   21   2HD   LYS   3          1HD       LYS   3  12.894  11.513  -7.444
   22   1HE   LYS   3          2HE       LYS   3  11.246  13.160  -8.000
   23   2HE   LYS   3          1HE       LYS   3  11.175  13.745  -6.338
   24   1HZ   LYS   3          1HZ       LYS   3  12.527  15.120  -7.922
   25   2HZ   LYS   3          2HZ       LYS   3  13.645  13.842  -7.972
   26   3HZ   LYS   3          3HZ       LYS   3  13.331  14.642  -6.507
   27    HA   PRO   4           HA       PRO   4  14.393   5.397  -5.911
   28   1HB   PRO   4          2HB       PRO   4  14.076   4.043  -3.556
   29   2HB   PRO   4          1HB       PRO   4  15.389   5.191  -3.863
   30   1HG   PRO   4          2HG       PRO   4  13.010   5.507  -2.121
   31   2HG   PRO   4          1HG       PRO   4  14.546   6.386  -2.086
   32   1HD   PRO   4          2HD       PRO   4  12.050   7.275  -3.213
   33   2HD   PRO   4          1HD       PRO   4  13.608   8.127  -3.226
   34    HA   PRO   5           HA       PRO   5  10.166   3.192  -5.173
   35   1HB   PRO   5          2HB       PRO   5   8.105   4.612  -6.308
   36   2HB   PRO   5          1HB       PRO   5   8.538   4.703  -4.594
   37   1HG   PRO   5          2HG       PRO   5   8.998   6.689  -6.754
   38   2HG   PRO   5          1HG       PRO   5   8.883   6.942  -5.008
   39   1HD   PRO   5          2HD       PRO   5  11.257   6.841  -6.554
   40   2HD   PRO   5          1HD       PRO   5  11.150   6.880  -4.781
   41    H    TYR   6           H        TYR   6   8.432   2.552  -7.071
   42    HA   TYR   6           HA       TYR   6  10.063   2.434  -9.561
   43   1HB   TYR   6          2HB       TYR   6   7.839   0.512  -9.023
   44   2HB   TYR   6          1HB       TYR   6   9.359   0.253  -9.879
   45    HD1  TYR   6           HD1      TYR   6   7.964  -1.273  -7.406
   46    HD2  TYR   6           HD2      TYR   6  11.216   1.502  -7.822
   47    HE1  TYR   6           HE1      TYR   6   8.986  -2.154  -5.328
   48    HE2  TYR   6           HE2      TYR   6  12.235   0.620  -5.743
   49    HH   TYR   6           HH       TYR   6  11.680  -0.590  -3.796
   50    H    SER   7           H        SER   7   8.337   1.800 -11.481
   51    HA   SER   7           HA       SER   7   6.995   4.157 -12.153
   52   1HB   SER   7          2HB       SER   7   6.209   1.314 -12.874
   53   2HB   SER   7          1HB       SER   7   5.613   2.758 -13.688
   54    HG   SER   7           HG       SER   7   7.454   2.925 -14.700
   55    H    TYR   8           H        TYR   8   4.902   4.966 -11.718
   56    HA   TYR   8           HA       TYR   8   3.733   4.253  -9.230
   57   1HB   TYR   8          2HB       TYR   8   2.938   6.014 -11.493
   58   2HB   TYR   8          1HB       TYR   8   1.671   5.530 -10.361
   59    HD1  TYR   8           HD1      TYR   8   1.459   7.803  -9.403
   60    HD2  TYR   8           HD2      TYR   8   5.181   5.666  -9.323
   61    HE1  TYR   8           HE1      TYR   8   2.329   9.375  -7.691
   62    HE2  TYR   8           HE2      TYR   8   6.054   7.236  -7.625
   63    HH   TYR   8           HH       TYR   8   4.299  10.130  -6.721
   64    H    ALA   9           H        ALA   9   3.464   2.019  -9.277
   65    HA   ALA   9           HA       ALA   9   0.904   1.013  -9.833
   66   1HB   ALA   9          1HB       ALA   9   0.939   0.270 -11.972
   67   2HB   ALA   9          2HB       ALA   9   2.543  -0.431 -11.771
   68   3HB   ALA   9          3HB       ALA   9   2.373   1.270 -12.198
   69    H    GLN  10           H        GLN  10   4.332   0.495  -9.466
   70    HA   GLN  10           HA       GLN  10   4.085  -2.258  -8.504
   71   1HB   GLN  10          2HB       GLN  10   6.499  -0.482  -8.188
   72   2HB   GLN  10          1HB       GLN  10   6.444  -2.231  -8.404
   73   1HG   GLN  10          2HG       GLN  10   5.151  -0.979 -10.645
   74   2HG   GLN  10          1HG       GLN  10   6.734  -0.239 -10.413
   75   1HE2  GLN  10          1HE2      GLN  10   8.046  -2.596  -9.299
   76   2HE2  GLN  10          2HE2      GLN  10   8.192  -3.723 -10.559
   77    H    LEU  11           H        LEU  11   4.233   0.986  -7.157
   78    HA   LEU  11           HA       LEU  11   4.894   0.192  -4.462
   79   1HB   LEU  11          2HB       LEU  11   2.941   2.413  -4.672
   80   2HB   LEU  11          1HB       LEU  11   4.465   2.355  -3.806
   81    HG   LEU  11           HG       LEU  11   4.878   3.948  -5.441
   82   1HD1  LEU  11          1HD1      LEU  11   6.123   1.439  -5.711
   83   2HD1  LEU  11          2HD1      LEU  11   6.725   2.993  -6.280
   84   3HD1  LEU  11          3HD1      LEU  11   5.768   1.974  -7.353
   85   1HD2  LEU  11          1HD2      LEU  11   4.160   3.057  -7.915
   86   2HD2  LEU  11          2HD2      LEU  11   3.154   4.090  -6.900
   87   3HD2  LEU  11          3HD2      LEU  11   2.898   2.344  -6.913
   88    H    ILE  12           H        ILE  12   2.093   0.072  -6.486
   89    HA   ILE  12           HA       ILE  12   0.284  -0.430  -4.266
   90    HB   ILE  12           HB       ILE  12  -0.335  -1.258  -7.065
   91   1HG1  ILE  12          2HG1      ILE  12   0.667   0.988  -7.294
   92   2HG1  ILE  12          1HG1      ILE  12  -1.081   1.065  -7.539
   93   1HG2  ILE  12          1HG2      ILE  12  -2.049  -1.750  -5.541
   94   2HG2  ILE  12          2HG2      ILE  12  -2.551  -0.202  -6.217
   95   3HG2  ILE  12          3HG2      ILE  12  -1.786  -0.264  -4.630
   96   1HD1  ILE  12          1HD1      ILE  12   0.560   2.219  -5.385
   97   2HD1  ILE  12          2HD1      ILE  12  -0.901   1.397  -4.836
   98   3HD1  ILE  12          3HD1      ILE  12  -1.017   2.720  -5.995
   99    H    VAL  13           H        VAL  13   1.581  -2.427  -6.923
  100    HA   VAL  13           HA       VAL  13   0.573  -4.904  -6.148
  101    HB   VAL  13           HB       VAL  13   3.367  -4.326  -7.159
  102   1HG1  VAL  13          1HG1      VAL  13   1.722  -6.790  -6.791
  103   2HG1  VAL  13          2HG1      VAL  13   3.455  -6.569  -6.609
  104   3HG1  VAL  13          3HG1      VAL  13   2.752  -6.696  -8.219
  105   1HG2  VAL  13          1HG2      VAL  13   2.334  -4.669  -9.387
  106   2HG2  VAL  13          2HG2      VAL  13   1.604  -3.305  -8.547
  107   3HG2  VAL  13          3HG2      VAL  13   0.757  -4.850  -8.619
  108    H    GLN  14           H        GLN  14   3.758  -3.590  -5.115
  109    HA   GLN  14           HA       GLN  14   4.147  -5.649  -3.150
  110   1HB   GLN  14          2HB       GLN  14   5.964  -4.173  -4.114
  111   2HB   GLN  14          1HB       GLN  14   5.339  -2.863  -3.111
  112   1HG   GLN  14          2HG       GLN  14   5.638  -4.352  -1.104
  113   2HG   GLN  14          1HG       GLN  14   6.439  -5.520  -2.155
  114   1HE2  GLN  14          1HE2      GLN  14   8.392  -4.608  -3.412
  115   2HE2  GLN  14          2HE2      GLN  14   9.351  -3.452  -2.625
  116    H    ALA  15           H        ALA  15   2.310  -2.726  -3.230
  117    HA   ALA  15           HA       ALA  15   2.153  -2.268  -0.396
  118   1HB   ALA  15          1HB       ALA  15  -0.044  -1.042  -1.197
  119   2HB   ALA  15          2HB       ALA  15   0.601  -1.367  -2.800
  120   3HB   ALA  15          3HB       ALA  15   1.532  -0.401  -1.661
  121    H    ILE  16           H        ILE  16  -0.327  -3.621  -2.605
  122    HA   ILE  16           HA       ILE  16  -1.745  -4.805  -0.323
  123    HB   ILE  16           HB       ILE  16  -2.894  -5.761  -2.728
  124   1HG1  ILE  16          2HG1      ILE  16  -1.960  -2.889  -2.910
  125   2HG1  ILE  16          1HG1      ILE  16  -1.815  -4.155  -4.132
  126   1HG2  ILE  16          1HG2      ILE  16  -3.854  -4.920  -0.475
  127   2HG2  ILE  16          2HG2      ILE  16  -4.786  -4.610  -1.940
  128   3HG2  ILE  16          3HG2      ILE  16  -3.813  -3.329  -1.226
  129   1HD1  ILE  16          1HD1      ILE  16  -4.544  -4.038  -3.675
  130   2HD1  ILE  16          2HD1      ILE  16  -3.696  -3.292  -5.025
  131   3HD1  ILE  16          3HD1      ILE  16  -4.051  -2.348  -3.581
  132    H    SER  17           H        SER  17  -0.151  -5.983  -3.278
  133    HA   SER  17           HA       SER  17  -0.557  -8.743  -2.878
  134   1HB   SER  17          2HB       SER  17   2.030  -7.722  -4.006
  135   2HB   SER  17          1HB       SER  17   1.051  -9.089  -4.534
  136    HG   SER  17           HG       SER  17   0.256  -7.716  -5.907
  137    H    SER  18           H        SER  18   2.187  -6.736  -1.732
  138    HA   SER  18           HA       SER  18   3.413  -9.017  -0.394
  139   1HB   SER  18          2HB       SER  18   4.015  -6.110   0.148
  140   2HB   SER  18          1HB       SER  18   5.084  -7.490   0.343
  141    HG   SER  18           HG       SER  18   4.142  -7.383  -2.179
  142    H    ALA  19           H        ALA  19   0.705  -7.237   0.349
  143    HA   ALA  19           HA       ALA  19   1.198  -7.340   3.280
  144   1HB   ALA  19          1HB       ALA  19  -0.168  -5.517   1.646
  145   2HB   ALA  19          2HB       ALA  19  -0.197  -5.568   3.409
  146   3HB   ALA  19          3HB       ALA  19  -1.439  -6.408   2.481
  147    H    GLN  20           H        GLN  20   0.137  -8.867   4.560
  148    HA   GLN  20           HA       GLN  20  -0.812 -11.275   3.582
  149   1HB   GLN  20          2HB       GLN  20  -0.460 -10.684   6.017
  150   2HB   GLN  20          1HB       GLN  20  -2.026  -9.876   5.983
  151   1HG   GLN  20          2HG       GLN  20  -3.004 -11.860   6.396
  152   2HG   GLN  20          1HG       GLN  20  -2.435 -12.421   4.823
  153   1HE2  GLN  20          1HE2      GLN  20  -2.191 -13.005   8.166
  154   2HE2  GLN  20          2HE2      GLN  20  -0.794 -13.969   8.142
  155    H    ASP  21           H        ASP  21  -2.579  -8.247   3.940
  156    HA   ASP  21           HA       ASP  21  -5.048  -9.478   2.880
  157   1HB   ASP  21          2HB       ASP  21  -4.328  -6.892   4.177
  158   2HB   ASP  21          1HB       ASP  21  -5.671  -6.870   3.033
  159    H    ARG  22           H        ARG  22  -4.793  -9.851   0.675
  160    HA   ARG  22           HA       ARG  22  -3.236  -8.292  -1.115
  161   1HB   ARG  22          2HB       ARG  22  -4.814  -9.320  -2.876
  162   2HB   ARG  22          1HB       ARG  22  -3.899 -10.443  -1.870
  163   1HG   ARG  22          2HG       ARG  22  -6.415  -9.683  -0.612
  164   2HG   ARG  22          1HG       ARG  22  -6.674 -10.409  -2.200
  165   1HD   ARG  22          2HD       ARG  22  -4.684 -11.985  -1.008
  166   2HD   ARG  22          1HD       ARG  22  -5.847 -11.679   0.280
  167    HE   ARG  22           HE       ARG  22  -6.577 -12.901  -2.352
  168   1HH1  ARG  22          1HH2      ARG  22  -8.933 -11.901  -0.952
  169   2HH1  ARG  22          2HH2      ARG  22  -9.393 -13.224   0.067
  170   1HH2  ARG  22          1HH1      ARG  22  -6.334 -14.833  -0.184
  171   2HH2  ARG  22          2HH1      ARG  22  -7.924 -14.883   0.501
  172    H    GLN  23           H        GLN  23  -6.142  -7.492   0.454
  173    HA   GLN  23           HA       GLN  23  -6.791  -5.448  -1.619
  174   1HB   GLN  23          2HB       GLN  23  -9.020  -5.361  -0.639
  175   2HB   GLN  23          1HB       GLN  23  -8.618  -7.047  -0.970
  176   1HG   GLN  23          2HG       GLN  23  -7.634  -6.484   1.625
  177   2HG   GLN  23          1HG       GLN  23  -9.268  -5.825   1.551
  178   1HE2  GLN  23          1HE2      GLN  23 -11.012  -7.312   1.543
  179   2HE2  GLN  23          2HE2      GLN  23 -10.809  -8.997   1.530
  180    H    LEU  24           H        LEU  24  -6.635  -3.301  -1.067
  181    HA   LEU  24           HA       LEU  24  -6.010  -2.643   1.780
  182   1HB   LEU  24          2HB       LEU  24  -4.667  -1.791  -0.777
  183   2HB   LEU  24          1HB       LEU  24  -4.677  -0.705   0.605
  184    HG   LEU  24           HG       LEU  24  -3.742  -3.573   0.791
  185   1HD1  LEU  24          1HD1      LEU  24  -2.399  -1.162  -0.252
  186   2HD1  LEU  24          2HD1      LEU  24  -1.997  -2.862  -0.483
  187   3HD1  LEU  24          3HD1      LEU  24  -1.487  -2.029   0.984
  188   1HD2  LEU  24          1HD2      LEU  24  -3.001  -2.999   2.936
  189   2HD2  LEU  24          2HD2      LEU  24  -4.491  -2.061   2.816
  190   3HD2  LEU  24          3HD2      LEU  24  -2.931  -1.278   2.557
  191    H    THR  25           H        THR  25  -6.771  -0.521   2.433
  192    HA   THR  25           HA       THR  25  -9.171   0.334   0.979
  193    HB   THR  25           HB       THR  25  -9.117   0.414   3.459
  194    HG1  THR  25           HG1      THR  25  -9.245   3.032   3.251
  195   1HG2  THR  25          1HG2      THR  25  -6.770   0.839   3.833
  196   2HG2  THR  25          2HG2      THR  25  -7.675   2.186   4.522
  197   3HG2  THR  25          3HG2      THR  25  -6.862   2.374   2.969
  198    H    LEU  26           H        LEU  26  -9.217   2.947   0.653
  199    HA   LEU  26           HA       LEU  26  -7.265   3.486  -1.354
  200   1HB   LEU  26          2HB       LEU  26  -9.561   4.778  -0.546
  201   2HB   LEU  26          1HB       LEU  26  -8.303   5.894  -0.010
  202    HG   LEU  26           HG       LEU  26  -8.356   4.704  -2.796
  203   1HD1  LEU  26          1HD1      LEU  26 -10.401   6.148  -2.145
  204   2HD1  LEU  26          2HD1      LEU  26  -9.497   6.631  -3.581
  205   3HD1  LEU  26          3HD1      LEU  26  -9.263   7.492  -2.060
  206   1HD2  LEU  26          1HD2      LEU  26  -7.139   7.265  -2.640
  207   2HD2  LEU  26          2HD2      LEU  26  -6.346   5.715  -2.919
  208   3HD2  LEU  26          3HD2      LEU  26  -6.523   6.332  -1.276
  209    H    SER  27           H        SER  27  -7.359   4.252   2.100
  210    HA   SER  27           HA       SER  27  -4.653   5.458   1.894
  211   1HB   SER  27          2HB       SER  27  -6.939   5.834   3.636
  212   2HB   SER  27          1HB       SER  27  -5.473   5.528   4.564
  213    HG   SER  27           HG       SER  27  -4.473   7.175   3.261
  214    H    GLY  28           H        GLY  28  -5.061   2.558   1.593
  215   1HA   GLY  28          2HA       GLY  28  -3.860   1.522   4.125
  216   2HA   GLY  28          1HA       GLY  28  -4.592   0.519   2.870
  217    H    ILE  29           H        ILE  29  -3.465   1.425   0.627
  218    HA   ILE  29           HA       ILE  29  -0.998   0.149   0.392
  219    HB   ILE  29           HB       ILE  29  -2.496   0.801  -1.435
  220   1HG1  ILE  29          2HG1      ILE  29   0.392   1.146  -1.359
  221   2HG1  ILE  29          1HG1      ILE  29  -0.598   0.392  -2.605
  222   1HG2  ILE  29          1HG2      ILE  29  -1.429   3.580  -1.299
  223   2HG2  ILE  29          2HG2      ILE  29  -2.784   3.130  -0.275
  224   3HG2  ILE  29          3HG2      ILE  29  -2.920   2.993  -2.024
  225   1HD1  ILE  29          1HD1      ILE  29  -0.084   3.360  -2.284
  226   2HD1  ILE  29          2HD1      ILE  29  -1.144   2.645  -3.498
  227   3HD1  ILE  29          3HD1      ILE  29   0.590   2.317  -3.536
  228    H    TYR  30           H        TYR  30  -1.737   3.465   1.218
  229    HA   TYR  30           HA       TYR  30   0.935   4.476   0.936
  230   1HB   TYR  30          2HB       TYR  30  -1.168   5.531   2.837
  231   2HB   TYR  30          1HB       TYR  30   0.138   6.433   2.062
  232    HD1  TYR  30           HD1      TYR  30  -3.134   6.511   1.934
  233    HD2  TYR  30           HD2      TYR  30   0.048   5.303  -0.667
  234    HE1  TYR  30           HE1      TYR  30  -4.593   6.885  -0.033
  235    HE2  TYR  30           HE2      TYR  30  -1.398   5.681  -2.628
  236    HH   TYR  30           HH       TYR  30  -4.693   6.982  -2.257
  237    H    ALA  31           H        ALA  31  -0.875   3.400   3.819
  238    HA   ALA  31           HA       ALA  31   1.391   3.693   5.583
  239   1HB   ALA  31          1HB       ALA  31  -0.040   2.990   7.233
  240   2HB   ALA  31          2HB       ALA  31  -0.712   1.695   6.241
  241   3HB   ALA  31          3HB       ALA  31  -1.255   3.357   6.007
  242    H    HIS  32           H        HIS  32   0.466   1.270   3.286
  243    HA   HIS  32           HA       HIS  32   1.913  -0.923   4.553
  244   1HB   HIS  32          2HB       HIS  32   0.068  -1.374   2.991
  245   2HB   HIS  32          1HB       HIS  32   0.942  -0.545   1.705
  246    HD1  HIS  32           HD1      HIS  32   0.432  -3.857   2.984
  247    HD2  HIS  32           HD2      HIS  32   3.684  -1.814   1.360
  248    HE1  HIS  32           HE1      HIS  32   2.100  -5.625   2.267
  249    H    ILE  33           H        ILE  33   2.472   1.056   1.675
  250    HA   ILE  33           HA       ILE  33   5.044   0.118   0.993
  251    HB   ILE  33           HB       ILE  33   3.403   1.681  -0.252
  252   1HG1  ILE  33          2HG1      ILE  33   6.404   2.061  -0.226
  253   2HG1  ILE  33          1HG1      ILE  33   5.456   1.045  -1.313
  254   1HG2  ILE  33          1HG2      ILE  33   5.014   3.698   1.325
  255   2HG2  ILE  33          2HG2      ILE  33   3.278   3.420   1.457
  256   3HG2  ILE  33          3HG2      ILE  33   3.954   4.083  -0.029
  257   1HD1  ILE  33          1HD1      ILE  33   5.773   4.026  -1.302
  258   2HD1  ILE  33          2HD1      ILE  33   4.266   3.335  -1.901
  259   3HD1  ILE  33          3HD1      ILE  33   5.796   2.908  -2.664
  260    H    THR  34           H        THR  34   4.069   2.543   3.341
  261    HA   THR  34           HA       THR  34   6.544   3.843   3.743
  262    HB   THR  34           HB       THR  34   5.692   4.244   6.094
  263    HG1  THR  34           HG1      THR  34   3.257   3.448   5.879
  264   1HG2  THR  34          1HG2      THR  34   5.094   5.824   4.400
  265   2HG2  THR  34          2HG2      THR  34   3.607   5.448   5.270
  266   3HG2  THR  34          3HG2      THR  34   3.915   4.718   3.694
  267    H    LYS  35           H        LYS  35   5.660   0.600   4.489
  268    HA   LYS  35           HA       LYS  35   7.765   0.273   6.520
  269   1HB   LYS  35          2HB       LYS  35   5.478  -0.990   6.379
  270   2HB   LYS  35          1HB       LYS  35   6.311  -2.003   5.197
  271   1HG   LYS  35          2HG       LYS  35   8.075  -1.649   7.404
  272   2HG   LYS  35          1HG       LYS  35   6.497  -2.095   8.055
  273   1HD   LYS  35          2HD       LYS  35   6.989  -3.702   5.741
  274   2HD   LYS  35          1HD       LYS  35   8.413  -3.784   6.780
  275   1HE   LYS  35          2HE       LYS  35   6.080  -3.918   8.436
  276   2HE   LYS  35          1HE       LYS  35   5.911  -5.100   7.138
  277   1HZ   LYS  35          1HZ       LYS  35   7.932  -4.934   9.253
  278   2HZ   LYS  35          2HZ       LYS  35   8.399  -5.572   7.749
  279   3HZ   LYS  35          3HZ       LYS  35   7.134  -6.293   8.625
  280    H    HIS  36           H        HIS  36   7.284  -0.310   3.085
  281    HA   HIS  36           HA       HIS  36   9.825  -1.808   2.897
  282   1HB   HIS  36          2HB       HIS  36   7.949  -0.945   0.677
  283   2HB   HIS  36          1HB       HIS  36   9.241  -2.142   0.565
  284    HD1  HIS  36           HD1      HIS  36   8.709  -4.504   1.314
  285    HD2  HIS  36           HD2      HIS  36   5.733  -1.790   2.386
  286    HE1  HIS  36           HE1      HIS  36   6.777  -5.877   2.208
  287    H    TYR  37           H        TYR  37   8.643   0.764   0.715
  288    HA   TYR  37           HA       TYR  37  11.363   1.810   0.497
  289   1HB   TYR  37          2HB       TYR  37   8.988   3.292  -0.568
  290   2HB   TYR  37          1HB       TYR  37  10.575   3.074  -1.292
  291    HD1  TYR  37           HD1      TYR  37   7.501   2.484  -2.179
  292    HD2  TYR  37           HD2      TYR  37  10.899   0.136  -1.037
  293    HE1  TYR  37           HE1      TYR  37   6.600   0.564  -3.468
  294    HE2  TYR  37           HE2      TYR  37  10.011  -1.784  -2.326
  295    HH   TYR  37           HH       TYR  37   6.949  -1.514  -4.146
  296    HA   PRO  38           HA       PRO  38  10.609   4.490   4.000
  297   1HB   PRO  38          2HB       PRO  38  13.180   5.462   4.110
  298   2HB   PRO  38          1HB       PRO  38  12.689   3.897   4.782
  299   1HG   PRO  38          2HG       PRO  38  14.226   4.474   2.290
  300   2HG   PRO  38          1HG       PRO  38  14.260   3.035   3.322
  301   1HD   PRO  38          2HD       PRO  38  12.906   3.258   0.854
  302   2HD   PRO  38          1HD       PRO  38  12.660   1.979   2.063
  303    H    TYR  39           H        TYR  39  10.958   5.299   0.812
  304    HA   TYR  39           HA       TYR  39  11.427   8.185   1.240
  305   1HB   TYR  39          2HB       TYR  39  12.360   6.972  -0.761
  306   2HB   TYR  39          1HB       TYR  39  10.704   6.746  -1.330
  307    HD1  TYR  39           HD1      TYR  39   9.566   8.472  -2.476
  308    HD2  TYR  39           HD2      TYR  39  13.181   9.359  -0.333
  309    HE1  TYR  39           HE1      TYR  39   9.582  10.755  -3.448
  310    HE2  TYR  39           HE2      TYR  39  13.198  11.640  -1.306
  311    HH   TYR  39           HH       TYR  39  12.305  12.936  -2.965
  312    H    TYR  40           H        TYR  40   8.787   5.961   0.495
  313    HA   TYR  40           HA       TYR  40   6.901   8.211   0.175
  314   1HB   TYR  40          2HB       TYR  40   6.723   5.226  -0.160
  315   2HB   TYR  40          1HB       TYR  40   5.252   6.189  -0.020
  316    HD1  TYR  40           HD1      TYR  40   8.029   7.998  -1.392
  317    HD2  TYR  40           HD2      TYR  40   4.837   5.316  -2.429
  318    HE1  TYR  40           HE1      TYR  40   8.232   8.678  -3.760
  319    HE2  TYR  40           HE2      TYR  40   5.045   5.996  -4.803
  320    HH   TYR  40           HH       TYR  40   7.438   8.449  -5.807
  321    H    ARG  41           H        ARG  41   7.006   9.069   2.330
  322    HA   ARG  41           HA       ARG  41   5.194   7.693   4.189
  323   1HB   ARG  41          2HB       ARG  41   6.953   8.112   6.071
  324   2HB   ARG  41          1HB       ARG  41   7.135   6.683   5.053
  325   1HG   ARG  41          2HG       ARG  41   8.775   7.818   3.661
  326   2HG   ARG  41          1HG       ARG  41   8.520   9.329   4.535
  327   1HD   ARG  41          2HD       ARG  41   9.116   7.733   6.620
  328   2HD   ARG  41          1HD       ARG  41  10.018   6.892   5.359
  329    HE   ARG  41           HE       ARG  41  10.532   9.728   5.252
  330   1HH1  ARG  41          1HH2      ARG  41  12.421   7.250   5.148
  331   2HH1  ARG  41          2HH2      ARG  41  13.429   7.588   6.515
  332   1HH2  ARG  41          1HH1      ARG  41  11.309   9.998   7.823
  333   2HH2  ARG  41          2HH1      ARG  41  12.800   9.143   8.028
  334    H    THR  42           H        THR  42   7.344  10.447   3.550
  335    HA   THR  42           HA       THR  42   5.263  12.352   4.154
  336    HB   THR  42           HB       THR  42   5.713  11.847   6.466
  337    HG1  THR  42           HG1      THR  42   5.854  13.883   6.901
  338   1HG2  THR  42          1HG2      THR  42   7.691  10.879   6.938
  339   2HG2  THR  42          2HG2      THR  42   8.400  12.493   6.891
  340   3HG2  THR  42          3HG2      THR  42   8.410  11.483   5.446
  341    H    ALA  43           H        ALA  43   6.703  12.186   1.894
  342    HA   ALA  43           HA       ALA  43   8.837  14.265   2.154
  343   1HB   ALA  43          1HB       ALA  43   8.652  11.790   0.642
  344   2HB   ALA  43          2HB       ALA  43  10.056  12.820   0.923
  345   3HB   ALA  43          3HB       ALA  43   8.967  13.161  -0.422
  346    H    ASP  44           H        ASP  44   6.615  13.174  -0.434
  347    HA   ASP  44           HA       ASP  44   5.797  16.028  -0.765
  348   1HB   ASP  44          2HB       ASP  44   6.481  14.048  -2.960
  349   2HB   ASP  44          1HB       ASP  44   5.799  15.653  -3.228
  350    H    LYS  45           H        LYS  45   3.598  16.320  -1.251
  351    HA   LYS  45           HA       LYS  45   1.894  13.939  -0.864
  352   1HB   LYS  45          2HB       LYS  45   1.297  15.951   0.379
  353   2HB   LYS  45          1HB       LYS  45   1.239  16.892  -1.113
  354   1HG   LYS  45          2HG       LYS  45  -0.791  16.040  -1.731
  355   2HG   LYS  45          1HG       LYS  45  -0.444  14.448  -1.056
  356   1HD   LYS  45          2HD       LYS  45  -1.865  15.052   0.606
  357   2HD   LYS  45          1HD       LYS  45  -0.517  16.023   1.200
  358   1HE   LYS  45          2HE       LYS  45  -2.320  17.163  -0.911
  359   2HE   LYS  45          1HE       LYS  45  -2.860  17.155   0.767
  360   1HZ   LYS  45          1HZ       LYS  45  -0.203  18.189  -0.022
  361   2HZ   LYS  45          2HZ       LYS  45  -1.049  18.454   1.427
  362   3HZ   LYS  45          3HZ       LYS  45  -1.583  19.175  -0.016
  363    H    GLY  46           H        GLY  46   2.099  12.832  -2.863
  364   1HA   GLY  46          2HA       GLY  46   0.554  14.036  -5.072
  365   2HA   GLY  46          1HA       GLY  46   2.231  13.623  -5.440
  366    H    TRP  47           H        TRP  47   2.681  11.228  -4.340
  367    HA   TRP  47           HA       TRP  47   1.343   9.394  -6.012
  368   1HB   TRP  47          2HB       TRP  47   2.420   7.645  -4.740
  369   2HB   TRP  47          1HB       TRP  47   3.540   8.996  -4.885
  370    HD1  TRP  47           HD1      TRP  47   3.059  10.864  -2.653
  371    HE1  TRP  47           HE1      TRP  47   3.131  10.201  -0.174
  372    HE3  TRP  47           HE3      TRP  47   2.214   5.827  -3.051
  373    HZ2  TRP  47           HZ2      TRP  47   2.882   7.865   1.434
  374    HZ3  TRP  47           HZ3      TRP  47   2.154   4.418  -1.019
  375    HH2  TRP  47           HH2      TRP  47   2.483   5.430   1.221
  376    H    GLN  48           H        GLN  48   0.191  10.860  -3.151
  377    HA   GLN  48           HA       GLN  48  -1.414   8.794  -2.047
  378   1HB   GLN  48          2HB       GLN  48  -2.150  11.729  -2.250
  379   2HB   GLN  48          1HB       GLN  48  -2.751  10.568  -1.068
  380   1HG   GLN  48          2HG       GLN  48   0.148  11.405  -1.365
  381   2HG   GLN  48          1HG       GLN  48  -0.955  11.986  -0.116
  382   1HE2  GLN  48          1HE2      GLN  48   0.413   8.913  -1.411
  383   2HE2  GLN  48          2HE2      GLN  48   0.385   8.100   0.080
  384    H    ASN  49           H        ASN  49  -2.636  11.420  -4.163
  385    HA   ASN  49           HA       ASN  49  -4.980   9.880  -4.906
  386   1HB   ASN  49          2HB       ASN  49  -4.719  12.446  -4.874
  387   2HB   ASN  49          1HB       ASN  49  -3.902  12.256  -6.425
  388   1HD2  ASN  49          1HD2      ASN  49  -5.193  11.733  -8.276
  389   2HD2  ASN  49          2HD2      ASN  49  -6.885  11.618  -8.215
  390    H    SER  50           H        SER  50  -1.818  10.459  -6.389
  391    HA   SER  50           HA       SER  50  -2.387   9.435  -8.974
  392   1HB   SER  50          2HB       SER  50  -0.104   9.391  -9.310
  393   2HB   SER  50          1HB       SER  50  -0.139  10.413  -7.877
  394    HG   SER  50           HG       SER  50   0.275   7.604  -8.005
  395    H    ILE  51           H        ILE  51  -1.937   7.830  -5.906
  396    HA   ILE  51           HA       ILE  51  -1.571   5.172  -6.989
  397    HB   ILE  51           HB       ILE  51  -2.049   6.392  -4.309
  398   1HG1  ILE  51          2HG1      ILE  51  -0.010   5.464  -3.807
  399   2HG1  ILE  51          1HG1      ILE  51  -0.347   3.988  -4.700
  400   1HG2  ILE  51          1HG2      ILE  51  -3.794   4.629  -4.415
  401   2HG2  ILE  51          2HG2      ILE  51  -2.523   4.245  -3.256
  402   3HG2  ILE  51          3HG2      ILE  51  -2.550   3.448  -4.828
  403   1HD1  ILE  51          1HD1      ILE  51   0.007   6.510  -6.254
  404   2HD1  ILE  51          2HD1      ILE  51   0.423   4.853  -6.691
  405   3HD1  ILE  51          3HD1      ILE  51   1.443   5.750  -5.567
  406    H    ARG  52           H        ARG  52  -4.418   6.669  -5.358
  407    HA   ARG  52           HA       ARG  52  -6.270   4.639  -5.925
  408   1HB   ARG  52          2HB       ARG  52  -6.994   6.483  -4.574
  409   2HB   ARG  52          1HB       ARG  52  -6.627   7.644  -5.849
  410   1HG   ARG  52          2HG       ARG  52  -8.446   5.607  -6.822
  411   2HG   ARG  52          1HG       ARG  52  -9.100   6.386  -5.381
  412   1HD   ARG  52          2HD       ARG  52  -7.894   8.349  -7.137
  413   2HD   ARG  52          1HD       ARG  52  -9.112   7.410  -8.002
  414    HE   ARG  52           HE       ARG  52  -9.976   8.380  -5.371
  415   1HH1  ARG  52          1HH1      ARG  52  -9.162   9.831  -8.292
  416   2HH1  ARG  52          2HH1      ARG  52 -10.708  10.565  -8.558
  417   1HH2  ARG  52          1HH2      ARG  52 -12.233   8.942  -5.900
  418   2HH2  ARG  52          2HH2      ARG  52 -12.447  10.061  -7.204
  419    H    HIS  53           H        HIS  53  -4.869   7.041  -8.016
  420    HA   HIS  53           HA       HIS  53  -6.685   6.616 -10.241
  421   1HB   HIS  53          2HB       HIS  53  -4.863   8.539  -9.590
  422   2HB   HIS  53          1HB       HIS  53  -3.945   7.610 -10.774
  423    HD1  HIS  53           HD1      HIS  53  -4.565   7.909 -13.206
  424    HD2  HIS  53           HD2      HIS  53  -7.419   9.538 -10.641
  425    HE1  HIS  53           HE1      HIS  53  -6.201   9.176 -14.666
  426    H    ASN  54           H        ASN  54  -3.507   5.375  -9.287
  427    HA   ASN  54           HA       ASN  54  -3.042   3.860 -11.692
  428   1HB   ASN  54          2HB       ASN  54  -1.891   3.489  -8.918
  429   2HB   ASN  54          1HB       ASN  54  -1.250   2.785 -10.402
  430   1HD2  ASN  54          1HD2      ASN  54  -0.263   5.014  -8.413
  431   2HD2  ASN  54          2HD2      ASN  54   0.219   6.263  -9.455
  432    H    LEU  55           H        LEU  55  -4.934   3.235  -8.819
  433    HA   LEU  55           HA       LEU  55  -4.896   0.342  -9.091
  434   1HB   LEU  55          2HB       LEU  55  -7.203   1.720  -7.781
  435   2HB   LEU  55          1HB       LEU  55  -6.326   0.283  -7.275
  436    HG   LEU  55           HG       LEU  55  -5.372   3.145  -7.086
  437   1HD1  LEU  55          1HD1      LEU  55  -5.198   1.646  -4.671
  438   2HD1  LEU  55          2HD1      LEU  55  -6.824   1.464  -5.329
  439   3HD1  LEU  55          3HD1      LEU  55  -6.179   3.070  -5.006
  440   1HD2  LEU  55          1HD2      LEU  55  -3.260   2.357  -7.104
  441   2HD2  LEU  55          2HD2      LEU  55  -3.873   0.731  -7.409
  442   3HD2  LEU  55          3HD2      LEU  55  -3.658   1.296  -5.753
  443    H    SER  56           H        SER  56  -7.126   2.913 -10.155
  444    HA   SER  56           HA       SER  56  -8.829   0.901 -11.492
  445   1HB   SER  56          2HB       SER  56  -9.138   3.892 -11.709
  446   2HB   SER  56          1HB       SER  56 -10.375   2.649 -11.858
  447    HG   SER  56           HG       SER  56 -10.676   3.179  -9.824
  448    H    LEU  57           H        LEU  57  -6.057   2.696 -12.242
  449    HA   LEU  57           HA       LEU  57  -6.699   2.980 -15.114
  450   1HB   LEU  57          2HB       LEU  57  -4.587   3.923 -13.276
  451   2HB   LEU  57          1HB       LEU  57  -4.048   3.566 -14.914
  452    HG   LEU  57           HG       LEU  57  -4.744   5.897 -14.759
  453   1HD1  LEU  57          1HD1      LEU  57  -5.813   3.954 -16.550
  454   2HD1  LEU  57          2HD1      LEU  57  -5.506   5.663 -16.861
  455   3HD1  LEU  57          3HD1      LEU  57  -7.075   5.147 -16.242
  456   1HD2  LEU  57          1HD2      LEU  57  -7.539   5.723 -14.458
  457   2HD2  LEU  57          2HD2      LEU  57  -6.391   6.407 -13.307
  458   3HD2  LEU  57          3HD2      LEU  57  -6.864   4.713 -13.179
  459    H    ASN  58           H        ASN  58  -4.494   1.134 -13.039
  460    HA   ASN  58           HA       ASN  58  -3.265  -0.291 -15.233
  461   1HB   ASN  58          2HB       ASN  58  -3.358  -0.769 -12.249
  462   2HB   ASN  58          1HB       ASN  58  -2.485  -1.835 -13.353
  463   1HD2  ASN  58          1HD2      ASN  58  -2.810   1.758 -12.982
  464   2HD2  ASN  58          2HD2      ASN  58  -1.151   2.064 -13.110
  465    H    ARG  59           H        ARG  59  -3.692  -2.384 -15.983
  466    HA   ARG  59           HA       ARG  59  -6.473  -3.234 -15.753
  467   1HB   ARG  59          2HB       ARG  59  -5.899  -4.890 -17.426
  468   2HB   ARG  59          1HB       ARG  59  -5.138  -3.364 -17.879
  469   1HG   ARG  59          2HG       ARG  59  -3.186  -4.431 -16.321
  470   2HG   ARG  59          1HG       ARG  59  -3.895  -5.902 -16.988
  471   1HD   ARG  59          2HD       ARG  59  -2.061  -5.010 -18.416
  472   2HD   ARG  59          1HD       ARG  59  -3.607  -5.051 -19.263
  473    HE   ARG  59           HE       ARG  59  -3.284  -2.488 -18.029
  474   1HH1  ARG  59          1HH1      ARG  59  -3.473  -3.943 -20.976
  475   2HH1  ARG  59          2HH1      ARG  59  -2.403  -2.866 -21.809
  476   1HH2  ARG  59          1HH2      ARG  59  -1.288  -1.312 -18.917
  477   2HH2  ARG  59          2HH2      ARG  59  -1.167  -1.376 -20.643
  478    H    TYR  60           H        TYR  60  -3.539  -4.016 -14.101
  479    HA   TYR  60           HA       TYR  60  -4.661  -6.623 -13.226
  480   1HB   TYR  60          2HB       TYR  60  -2.442  -6.898 -12.098
  481   2HB   TYR  60          1HB       TYR  60  -2.340  -6.743 -13.843
  482    HD1  TYR  60           HD1      TYR  60  -1.567  -5.180 -10.615
  483    HD2  TYR  60           HD2      TYR  60  -1.565  -4.640 -14.876
  484    HE1  TYR  60           HE1      TYR  60  -0.029  -3.257 -10.377
  485    HE2  TYR  60           HE2      TYR  60  -0.032  -2.715 -14.634
  486    HH   TYR  60           HH       TYR  60   1.679  -2.079 -11.830
  487    H    PHE  61           H        PHE  61  -5.739  -3.990 -12.383
  488    HA   PHE  61           HA       PHE  61  -5.652  -4.503  -9.459
  489   1HB   PHE  61          2HB       PHE  61  -5.071  -1.888 -10.856
  490   2HB   PHE  61          1HB       PHE  61  -5.738  -1.902  -9.230
  491    HD1  PHE  61           HD1      PHE  61  -4.059  -4.731  -8.747
  492    HD2  PHE  61           HD2      PHE  61  -3.104  -0.688  -9.856
  493    HE1  PHE  61           HE1      PHE  61  -1.768  -5.020  -7.877
  494    HE2  PHE  61           HE2      PHE  61  -0.823  -0.988  -8.971
  495    HZ   PHE  61           HZ       PHE  61  -0.158  -3.149  -7.977
  496    H    ILE  62           H        ILE  62  -7.707  -4.145  -8.500
  497    HA   ILE  62           HA       ILE  62  -9.810  -2.794 -10.055
  498    HB   ILE  62           HB       ILE  62 -11.206  -4.664 -10.437
  499   1HG1  ILE  62          2HG1      ILE  62  -9.345  -6.264  -8.647
  500   2HG1  ILE  62          1HG1      ILE  62 -10.945  -5.679  -8.194
  501   1HG2  ILE  62          1HG2      ILE  62  -9.788  -6.278 -11.656
  502   2HG2  ILE  62          2HG2      ILE  62  -8.360  -5.629 -10.851
  503   3HG2  ILE  62          3HG2      ILE  62  -9.275  -4.621 -11.970
  504   1HD1  ILE  62          1HD1      ILE  62 -10.293  -8.097  -9.548
  505   2HD1  ILE  62          2HD1      ILE  62 -11.160  -7.072 -10.692
  506   3HD1  ILE  62          3HD1      ILE  62 -11.895  -7.482  -9.142
  507    H    LYS  63           H        LYS  63 -11.998  -3.060  -8.784
  508    HA   LYS  63           HA       LYS  63 -11.382  -2.462  -5.962
  509   1HB   LYS  63          2HB       LYS  63 -14.095  -2.450  -7.303
  510   2HB   LYS  63          1HB       LYS  63 -13.615  -1.602  -5.832
  511   1HG   LYS  63          2HG       LYS  63 -11.773  -0.742  -7.749
  512   2HG   LYS  63          1HG       LYS  63 -13.312  -0.779  -8.610
  513   1HD   LYS  63          2HD       LYS  63 -13.796   1.193  -7.633
  514   2HD   LYS  63          1HD       LYS  63 -13.931   0.315  -6.108
  515   1HE   LYS  63          2HE       LYS  63 -12.118   1.392  -5.329
  516   2HE   LYS  63          1HE       LYS  63 -11.155   0.712  -6.641
  517   1HZ   LYS  63          1HZ       LYS  63 -11.037   2.720  -7.527
  518   2HZ   LYS  63          2HZ       LYS  63 -12.016   3.364  -6.296
  519   3HZ   LYS  63          3HZ       LYS  63 -12.723   2.748  -7.713
  520    H    VAL  64           H        VAL  64 -13.084  -3.377  -4.320
  521    HA   VAL  64           HA       VAL  64 -12.826  -6.236  -4.354
  522    HB   VAL  64           HB       VAL  64 -13.888  -4.202  -2.497
  523   1HG1  VAL  64          1HG1      VAL  64 -15.081  -6.946  -2.732
  524   2HG1  VAL  64          2HG1      VAL  64 -15.860  -5.427  -2.292
  525   3HG1  VAL  64          3HG1      VAL  64 -14.833  -6.261  -1.126
  526   1HG2  VAL  64          1HG2      VAL  64 -11.630  -5.263  -2.367
  527   2HG2  VAL  64          2HG2      VAL  64 -12.416  -6.813  -2.066
  528   3HG2  VAL  64          3HG2      VAL  64 -12.589  -5.498  -0.904
  529    HA   PRO  65           HA       PRO  65 -17.522  -6.242  -5.198
  530   1HB   PRO  65          2HB       PRO  65 -18.690  -3.811  -5.740
  531   2HB   PRO  65          1HB       PRO  65 -18.559  -4.495  -4.110
  532   1HG   PRO  65          2HG       PRO  65 -16.997  -2.272  -5.342
  533   2HG   PRO  65          1HG       PRO  65 -17.364  -2.575  -3.635
  534   1HD   PRO  65          2HD       PRO  65 -14.902  -3.134  -4.921
  535   2HD   PRO  65          1HD       PRO  65 -15.402  -3.726  -3.329
  536    H    ARG  66           H        ARG  66 -19.025  -5.236  -7.235
  537    HA   ARG  66           HA       ARG  66 -17.185  -4.815  -9.539
  538   1HB   ARG  66          2HB       ARG  66 -18.449  -6.504 -10.842
  539   2HB   ARG  66          1HB       ARG  66 -17.663  -7.227  -9.438
  540   1HG   ARG  66          2HG       ARG  66 -19.949  -6.666  -8.246
  541   2HG   ARG  66          1HG       ARG  66 -20.575  -6.663  -9.894
  542   1HD   ARG  66          2HD       ARG  66 -20.050  -8.923 -10.235
  543   2HD   ARG  66          1HD       ARG  66 -18.857  -8.942  -8.935
  544    HE   ARG  66           HE       ARG  66 -21.573  -8.422  -7.997
  545   1HH1  ARG  66          1HH2      ARG  66 -19.103 -10.041  -6.881
  546   2HH1  ARG  66          2HH2      ARG  66 -19.830 -11.609  -6.768
  547   1HH2  ARG  66          1HH1      ARG  66 -22.580 -10.769  -8.704
  548   2HH2  ARG  66          2HH1      ARG  66 -21.798 -12.021  -7.799
  549    H    SER  67           H        SER  67 -18.839  -2.896  -8.223
  550    HA   SER  67           HA       SER  67 -20.914  -2.441 -10.333
  551   1HB   SER  67          2HB       SER  67 -21.380  -2.756  -7.626
  552   2HB   SER  67          1HB       SER  67 -21.304  -1.005  -7.799
  553    HG   SER  67           HG       SER  67 -22.865  -2.759  -9.402
  554    H    GLN  68           H        GLN  68 -21.024  -0.320 -11.183
  555    HA   GLN  68           HA       GLN  68 -18.651   1.369 -10.560
  556   1HB   GLN  68          2HB       GLN  68 -20.294   0.876 -12.962
  557   2HB   GLN  68          1HB       GLN  68 -19.884   2.571 -12.700
  558   1HG   GLN  68          2HG       GLN  68 -17.835   2.158 -13.528
  559   2HG   GLN  68          1HG       GLN  68 -17.532   1.096 -12.152
  560   1HE2  GLN  68          1HE2      GLN  68 -16.282   0.264 -14.413
  561   2HE2  GLN  68          2HE2      GLN  68 -17.098  -1.033 -15.145
  562    H    GLU  69           H        GLU  69 -20.538   1.472  -8.575
  563    HA   GLU  69           HA       GLU  69 -21.252   4.281  -8.568
  564   1HB   GLU  69          2HB       GLU  69 -23.755   3.734  -8.198
  565   2HB   GLU  69          1HB       GLU  69 -23.154   3.705  -9.856
  566   1HG   GLU  69          2HG       GLU  69 -22.928   1.287  -9.791
  567   2HG   GLU  69          1HG       GLU  69 -23.360   1.257  -8.081
  568    H    GLU  70           H        GLU  70 -20.120   4.273  -6.575
  569    HA   GLU  70           HA       GLU  70 -21.666   3.149  -4.312
  570   1HB   GLU  70          2HB       GLU  70 -19.311   1.912  -5.296
  571   2HB   GLU  70          1HB       GLU  70 -18.865   2.724  -3.794
  572   1HG   GLU  70          2HG       GLU  70 -20.960   1.665  -2.770
  573   2HG   GLU  70          1HG       GLU  70 -21.026   0.652  -4.213
  574    HA   PRO  71           HA       PRO  71 -19.743   7.343  -3.648
  575   1HB   PRO  71          2HB       PRO  71 -22.098   8.762  -3.622
  576   2HB   PRO  71          1HB       PRO  71 -21.137   8.488  -5.086
  577   1HG   PRO  71          2HG       PRO  71 -23.705   7.217  -4.266
  578   2HG   PRO  71          1HG       PRO  71 -23.043   7.461  -5.891
  579   1HD   PRO  71          2HD       PRO  71 -23.016   5.031  -4.428
  580   2HD   PRO  71          1HD       PRO  71 -22.096   5.376  -5.909
  581    H    GLY  72           H        GLY  72 -19.639   5.828  -1.578
  582   1HA   GLY  72          2HA       GLY  72 -21.351   7.111   0.499
  583   2HA   GLY  72          1HA       GLY  72 -21.212   5.349   0.465
  584    H    LYS  73           H        LYS  73 -19.971   4.897   2.255
  585    HA   LYS  73           HA       LYS  73 -17.358   6.343   2.483
  586   1HB   LYS  73          2HB       LYS  73 -18.904   5.065   4.754
  587   2HB   LYS  73          1HB       LYS  73 -17.477   6.094   4.880
  588   1HG   LYS  73          2HG       LYS  73 -18.695   7.993   4.692
  589   2HG   LYS  73          1HG       LYS  73 -19.667   7.337   3.373
  590   1HD   LYS  73          2HD       LYS  73 -21.349   7.271   4.893
  591   2HD   LYS  73          1HD       LYS  73 -20.526   5.845   5.525
  592   1HE   LYS  73          2HE       LYS  73 -20.023   6.920   7.437
  593   2HE   LYS  73          1HE       LYS  73 -19.265   8.237   6.540
  594   1HZ   LYS  73          1HZ       LYS  73 -21.793   8.172   7.816
  595   2HZ   LYS  73          2HZ       LYS  73 -21.981   8.524   6.164
  596   3HZ   LYS  73          3HZ       LYS  73 -20.975   9.490   7.133
  597    H    GLY  74           H        GLY  74 -17.747   3.993   0.886
  598   1HA   GLY  74          2HA       GLY  74 -16.153   2.028   2.484
  599   2HA   GLY  74          1HA       GLY  74 -17.379   1.508   1.328
  600    H    SER  75           H        SER  75 -14.120   2.629   1.710
  601    HA   SER  75           HA       SER  75 -13.763   2.495  -1.259
  602   1HB   SER  75          2HB       SER  75 -11.520   3.778  -0.199
  603   2HB   SER  75          1HB       SER  75 -12.862   4.558  -1.032
  604    HG   SER  75           HG       SER  75 -13.858   4.880   0.943
  605    H    PHE  76           H        PHE  76 -13.507   0.122  -0.910
  606    HA   PHE  76           HA       PHE  76 -10.736  -0.500   0.026
  607   1HB   PHE  76          2HB       PHE  76 -13.076  -1.401   1.229
  608   2HB   PHE  76          1HB       PHE  76 -12.592  -2.748   0.199
  609    HD1  PHE  76           HD1      PHE  76 -12.245  -1.468   3.395
  610    HD2  PHE  76           HD2      PHE  76  -9.870  -3.063   0.193
  611    HE1  PHE  76           HE1      PHE  76 -10.467  -2.073   5.017
  612    HE2  PHE  76           HE2      PHE  76  -8.092  -3.669   1.812
  613    HZ   PHE  76           HZ       PHE  76  -8.391  -3.175   4.225
  614    H    TRP  77           H        TRP  77  -9.574  -1.115  -1.727
  615    HA   TRP  77           HA       TRP  77 -10.965  -2.753  -3.807
  616   1HB   TRP  77          2HB       TRP  77  -9.798  -1.601  -5.523
  617   2HB   TRP  77          1HB       TRP  77 -10.312  -0.327  -4.419
  618    HD1  TRP  77           HD1      TRP  77  -8.405   0.487  -2.593
  619    HE1  TRP  77           HE1      TRP  77  -5.858   0.704  -2.919
  620    HE3  TRP  77           HE3      TRP  77  -7.789  -2.479  -6.690
  621    HZ2  TRP  77           HZ2      TRP  77  -3.842  -0.248  -4.690
  622    HZ3  TRP  77           HZ3      TRP  77  -5.551  -2.813  -7.675
  623    HH2  TRP  77           HH2      TRP  77  -3.580  -1.695  -6.695
  624    H    ARG  78           H        ARG  78  -9.359  -4.128  -5.078
  625    HA   ARG  78           HA       ARG  78  -6.939  -4.855  -3.498
  626   1HB   ARG  78          2HB       ARG  78  -7.586  -7.305  -3.986
  627   2HB   ARG  78          1HB       ARG  78  -8.475  -6.483  -2.708
  628   1HG   ARG  78          2HG       ARG  78 -10.375  -6.148  -4.077
  629   2HG   ARG  78          1HG       ARG  78  -9.470  -6.486  -5.552
  630   1HD   ARG  78          2HD       ARG  78  -9.215  -8.835  -4.880
  631   2HD   ARG  78          1HD       ARG  78 -10.075  -8.510  -3.375
  632    HE   ARG  78           HE       ARG  78 -11.928  -7.718  -5.172
  633   1HH1  ARG  78          1HH2      ARG  78  -9.960  -9.620  -6.845
  634   2HH1  ARG  78          2HH2      ARG  78 -10.987 -11.011  -6.950
  635   1HH2  ARG  78          1HH1      ARG  78 -13.220  -9.874  -4.555
  636   2HH2  ARG  78          2HH1      ARG  78 -12.833 -11.155  -5.654
  637    H    ILE  79           H        ILE  79  -5.494  -6.352  -4.824
  638    HA   ILE  79           HA       ILE  79  -5.415  -5.353  -7.598
  639    HB   ILE  79           HB       ILE  79  -3.309  -6.529  -7.798
  640   1HG1  ILE  79          2HG1      ILE  79  -4.170  -7.843  -5.212
  641   2HG1  ILE  79          1HG1      ILE  79  -3.765  -8.624  -6.741
  642   1HG2  ILE  79          1HG2      ILE  79  -3.460  -5.383  -5.010
  643   2HG2  ILE  79          2HG2      ILE  79  -3.434  -4.397  -6.470
  644   3HG2  ILE  79          3HG2      ILE  79  -2.057  -5.428  -6.076
  645   1HD1  ILE  79          1HD1      ILE  79  -1.502  -7.103  -6.126
  646   2HD1  ILE  79          2HD1      ILE  79  -1.664  -8.850  -5.945
  647   3HD1  ILE  79          3HD1      ILE  79  -2.000  -7.786  -4.579
  648    H    ASP  80           H        ASP  80  -5.356  -6.846  -9.461
  649    HA   ASP  80           HA       ASP  80  -7.495  -8.731  -9.417
  650   1HB   ASP  80          2HB       ASP  80  -5.878  -7.612 -11.377
  651   2HB   ASP  80          1HB       ASP  80  -5.443  -9.321 -11.422
  652    HA   PRO  81           HA       PRO  81  -5.555 -12.166  -7.513
  653   1HB   PRO  81          2HB       PRO  81  -7.307 -14.109  -8.363
  654   2HB   PRO  81          1HB       PRO  81  -7.669 -12.945  -7.077
  655   1HG   PRO  81          2HG       PRO  81  -8.673 -13.012  -9.883
  656   2HG   PRO  81          1HG       PRO  81  -9.422 -12.309  -8.440
  657   1HD   PRO  81          2HD       PRO  81  -8.055 -10.877 -10.467
  658   2HD   PRO  81          1HD       PRO  81  -8.523 -10.245  -8.874
  659    H    ALA  82           H        ALA  82  -6.579 -12.809 -10.902
  660    HA   ALA  82           HA       ALA  82  -4.485 -14.835 -11.199
  661   1HB   ALA  82          1HB       ALA  82  -6.337 -13.573 -13.245
  662   2HB   ALA  82          2HB       ALA  82  -6.612 -15.095 -12.396
  663   3HB   ALA  82          3HB       ALA  82  -5.283 -14.954 -13.547
  664    H    SER  83           H        SER  83  -4.163 -11.632 -10.948
  665    HA   SER  83           HA       SER  83  -2.008 -11.570 -13.019
  666   1HB   SER  83          2HB       SER  83  -3.661  -9.253 -11.982
  667   2HB   SER  83          1HB       SER  83  -2.322  -9.111 -13.114
  668    HG   SER  83           HG       SER  83  -4.882  -9.702 -13.601
  669    H    GLU  84           H        GLU  84  -2.800 -11.517  -9.730
  670    HA   GLU  84           HA       GLU  84  -0.874  -9.731  -8.684
  671   1HB   GLU  84          2HB       GLU  84  -1.142 -10.896  -6.595
  672   2HB   GLU  84          1HB       GLU  84  -2.715 -10.898  -7.395
  673   1HG   GLU  84          2HG       GLU  84  -2.097 -13.173  -8.350
  674   2HG   GLU  84          1HG       GLU  84  -0.718 -13.168  -7.250
  675    H    ALA  85           H        ALA  85  -0.565 -13.222  -9.416
  676    HA   ALA  85           HA       ALA  85   2.149 -13.427  -8.544
  677   1HB   ALA  85          1HB       ALA  85   0.820 -15.423  -9.021
  678   2HB   ALA  85          2HB       ALA  85   2.246 -15.419 -10.059
  679   3HB   ALA  85          3HB       ALA  85   0.676 -14.956 -10.716
  680    H    LYS  86           H        LYS  86   0.786 -11.851 -11.284
  681    HA   LYS  86           HA       LYS  86   3.329 -11.912 -12.793
  682   1HB   LYS  86          2HB       LYS  86   1.113 -12.052 -13.967
  683   2HB   LYS  86          1HB       LYS  86   0.769 -10.409 -13.418
  684   1HG   LYS  86          2HG       LYS  86   3.404 -10.596 -14.646
  685   2HG   LYS  86          1HG       LYS  86   2.134 -11.118 -15.754
  686   1HD   LYS  86          2HD       LYS  86   1.368  -9.008 -16.010
  687   2HD   LYS  86          1HD       LYS  86   1.361  -8.730 -14.267
  688   1HE   LYS  86          2HE       LYS  86   3.362  -7.668 -14.317
  689   2HE   LYS  86          1HE       LYS  86   4.063  -8.859 -15.414
  690   1HZ   LYS  86          1HZ       LYS  86   3.606  -7.602 -17.179
  691   2HZ   LYS  86          2HZ       LYS  86   3.382  -6.328 -16.078
  692   3HZ   LYS  86          3HZ       LYS  86   2.046  -7.217 -16.636
  693    H    LEU  87           H        LEU  87   1.153  -9.361 -11.539
  694    HA   LEU  87           HA       LEU  87   2.854  -7.186 -11.884
  695   1HB   LEU  87          2HB       LEU  87   1.674  -6.374  -9.657
  696   2HB   LEU  87          1HB       LEU  87   0.779  -6.502 -11.147
  697    HG   LEU  87           HG       LEU  87   0.699  -9.058  -9.858
  698   1HD1  LEU  87          1HD1      LEU  87   0.319  -6.675  -8.090
  699   2HD1  LEU  87          2HD1      LEU  87   1.000  -8.256  -7.704
  700   3HD1  LEU  87          3HD1      LEU  87  -0.744  -8.066  -7.886
  701   1HD2  LEU  87          1HD2      LEU  87  -1.686  -8.699  -9.975
  702   2HD2  LEU  87          2HD2      LEU  87  -0.979  -7.971 -11.417
  703   3HD2  LEU  87          3HD2      LEU  87  -1.466  -6.954 -10.062
  704    H    VAL  88           H        VAL  88   2.510  -9.106  -8.946
  705    HA   VAL  88           HA       VAL  88   4.440  -7.977  -7.330
  706    HB   VAL  88           HB       VAL  88   4.747 -10.262  -6.439
  707   1HG1  VAL  88          1HG1      VAL  88   2.721  -8.704  -6.002
  708   2HG1  VAL  88          2HG1      VAL  88   2.563 -10.400  -5.548
  709   3HG1  VAL  88          3HG1      VAL  88   1.835  -9.816  -7.043
  710   1HG2  VAL  88          1HG2      VAL  88   4.662 -11.789  -8.153
  711   2HG2  VAL  88          2HG2      VAL  88   3.454 -10.859  -9.040
  712   3HG2  VAL  88          3HG2      VAL  88   2.968 -11.854  -7.667
  713    H    GLU  89           H        GLU  89   5.017 -10.082 -10.120
  714    HA   GLU  89           HA       GLU  89   7.669 -10.857  -9.608
  715   1HB   GLU  89          2HB       GLU  89   6.113 -10.331 -12.104
  716   2HB   GLU  89          1HB       GLU  89   7.862 -10.489 -12.249
  717   1HG   GLU  89          2HG       GLU  89   6.309 -12.513 -10.659
  718   2HG   GLU  89          1HG       GLU  89   6.371 -12.637 -12.418
  719    H    GLN  90           H        GLN  90   6.509  -7.823 -11.090
  720    HA   GLN  90           HA       GLN  90   9.242  -6.752 -11.176
  721   1HB   GLN  90          2HB       GLN  90   6.638  -5.240 -11.537
  722   2HB   GLN  90          1HB       GLN  90   8.240  -4.766 -12.104
  723   1HG   GLN  90          2HG       GLN  90   7.634  -7.396 -13.096
  724   2HG   GLN  90          1HG       GLN  90   6.306  -6.306 -13.494
  725   1HE2  GLN  90          1HE2      GLN  90   6.685  -5.642 -15.626
  726   2HE2  GLN  90          2HE2      GLN  90   8.169  -5.052 -16.201
  727    H    ALA  91           H        ALA  91   6.621  -6.931  -8.959
  728    HA   ALA  91           HA       ALA  91   7.072  -4.594  -7.407
  729   1HB   ALA  91          1HB       ALA  91   6.190  -7.226  -6.253
  730   2HB   ALA  91          2HB       ALA  91   5.131  -6.249  -7.268
  731   3HB   ALA  91          3HB       ALA  91   5.733  -5.600  -5.744
  732    H    PHE  92           H        PHE  92   8.524  -7.831  -7.220
  733    HA   PHE  92           HA       PHE  92  10.100  -7.195  -4.868
  734   1HB   PHE  92          2HB       PHE  92  10.674  -9.369  -6.893
  735   2HB   PHE  92          1HB       PHE  92  11.128  -9.333  -5.189
  736    HD1  PHE  92           HD1      PHE  92   8.444  -8.122  -4.230
  737    HD2  PHE  92           HD2      PHE  92   9.407 -11.444  -6.775
  738    HE1  PHE  92           HE1      PHE  92   6.294  -9.202  -3.631
  739    HE2  PHE  92           HE2      PHE  92   7.257 -12.526  -6.177
  740    HZ   PHE  92           HZ       PHE  92   5.701 -11.405  -4.604
  741    H    ARG  93           H        ARG  93  10.709  -7.148  -8.370
  742    HA   ARG  93           HA       ARG  93  13.258  -5.702  -7.769
  743   1HB   ARG  93          2HB       ARG  93  13.182  -8.201  -8.849
  744   2HB   ARG  93          1HB       ARG  93  13.124  -7.214 -10.310
  745   1HG   ARG  93          2HG       ARG  93  15.448  -7.615  -9.800
  746   2HG   ARG  93          1HG       ARG  93  15.104  -5.928  -9.414
  747   1HD   ARG  93          2HD       ARG  93  14.558  -7.690  -7.155
  748   2HD   ARG  93          1HD       ARG  93  16.235  -7.807  -7.690
  749    HE   ARG  93           HE       ARG  93  15.324  -5.050  -7.453
  750   1HH1  ARG  93          1HH2      ARG  93  18.071  -6.306  -6.837
  751   2HH1  ARG  93          2HH2      ARG  93  18.152  -6.064  -5.124
  752   1HH2  ARG  93          1HH1      ARG  93  14.766  -5.381  -4.795
  753   2HH2  ARG  93          2HH1      ARG  93  16.280  -5.540  -3.968
  754    H    LYS  94           H        LYS  94  13.487  -3.779  -8.852
  755    HA   LYS  94           HA       LYS  94  12.127  -3.290 -11.388
  756   1HB   LYS  94          2HB       LYS  94  10.568  -2.827  -9.206
  757   2HB   LYS  94          1HB       LYS  94  11.352  -1.256  -9.385
  758   1HG   LYS  94          2HG       LYS  94   9.933  -2.740 -11.617
  759   2HG   LYS  94          1HG       LYS  94   9.237  -1.409 -10.694
  760   1HD   LYS  94          2HD       LYS  94  11.238  -0.015 -11.407
  761   2HD   LYS  94          1HD       LYS  94  11.646  -1.319 -12.522
  762   1HE   LYS  94          2HE       LYS  94   9.092  -1.049 -13.218
  763   2HE   LYS  94          1HE       LYS  94   9.335   0.578 -12.586
  764   1HZ   LYS  94          1HZ       LYS  94  10.500   1.128 -14.371
  765   2HZ   LYS  94          2HZ       LYS  94  10.059  -0.357 -15.070
  766   3HZ   LYS  94          3HZ       LYS  94  11.519  -0.218 -14.212
  767    H    ARG  95           H        ARG  95  13.297  -1.278  -8.661
  768    HA   ARG  95           HA       ARG  95  14.604   0.630 -10.318
  769   1HB   ARG  95          2HB       ARG  95  14.898  -0.170  -7.430
  770   2HB   ARG  95          1HB       ARG  95  15.985   1.023  -8.142
  771   1HG   ARG  95          2HG       ARG  95  13.034   1.328  -8.568
  772   2HG   ARG  95          1HG       ARG  95  13.720   1.791  -7.010
  773   1HD   ARG  95          2HD       ARG  95  14.711   2.793  -9.696
  774   2HD   ARG  95          1HD       ARG  95  13.646   3.695  -8.618
  775    HE   ARG  95           HE       ARG  95  16.223   2.798  -7.478
  776   1HH1  ARG  95          1HH1      ARG  95  14.730   5.207  -9.388
  777   2HH1  ARG  95          2HH1      ARG  95  15.482   6.533  -8.568
  778   1HH2  ARG  95          1HH2      ARG  95  17.007   4.539  -6.177
  779   2HH2  ARG  95          2HH2      ARG  95  16.770   6.156  -6.751
  780    H    ARG  96           H        ARG  96  16.682   0.726 -11.154
  781    HA   ARG  96           HA       ARG  96  18.357  -1.724 -10.770
  782   1HB   ARG  96          2HB       ARG  96  18.629   0.065 -13.167
  783   2HB   ARG  96          1HB       ARG  96  18.975  -1.658 -13.018
  784   1HG   ARG  96          2HG       ARG  96  16.560  -2.133 -12.837
  785   2HG   ARG  96          1HG       ARG  96  16.210  -0.411 -12.982
  786   1HD   ARG  96          2HD       ARG  96  17.815  -0.819 -15.164
  787   2HD   ARG  96          1HD       ARG  96  16.961  -2.359 -15.067
  788    HE   ARG  96           HE       ARG  96  14.828  -0.983 -15.096
  789   1HH1  ARG  96          1HH1      ARG  96  17.569  -0.395 -16.983
  790   2HH1  ARG  96          2HH1      ARG  96  16.960   1.053 -17.710
  791   1HH2  ARG  96          1HH2      ARG  96  14.131   1.186 -15.713
  792   2HH2  ARG  96          2HH2      ARG  96  15.016   1.948 -16.993
  793    H    GLN  97           H        GLN  97  20.677  -0.696 -12.017
  794    HA   GLN  97           HA       GLN  97  21.571   1.197  -9.911
  795   1HB   GLN  97          2HB       GLN  97  23.870   0.639 -11.007
  796   2HB   GLN  97          1HB       GLN  97  23.080  -0.603 -10.036
  797   1HG   GLN  97          2HG       GLN  97  22.435  -1.845 -11.905
  798   2HG   GLN  97          1HG       GLN  97  22.519  -0.451 -12.983
  799   1HE2  GLN  97          1HE2      GLN  97  24.277  -3.173 -11.813
  800   2HE2  GLN  97          2HE2      GLN  97  25.779  -2.779 -12.500
  801    H    ARG  98           H        ARG  98  23.640   2.507 -11.124
  802    HA   ARG  98           HA       ARG  98  22.413   3.850 -13.494
  803   1HB   ARG  98          2HB       ARG  98  22.751   4.962 -10.892
  804   2HB   ARG  98          1HB       ARG  98  23.920   5.744 -11.957
  805   1HG   ARG  98          2HG       ARG  98  22.299   6.729 -13.243
  806   2HG   ARG  98          1HG       ARG  98  21.179   5.379 -13.049
  807   1HD   ARG  98          2HD       ARG  98  21.129   6.196 -10.534
  808   2HD   ARG  98          1HD       ARG  98  21.649   7.724 -11.244
  809    HE   ARG  98           HE       ARG  98  19.004   6.527 -11.512
  810   1HH1  ARG  98          1HH2      ARG  98  20.650   9.364 -11.783
  811   2HH1  ARG  98          2HH2      ARG  98  19.860   9.927 -13.218
  812   1HH2  ARG  98          1HH1      ARG  98  18.297   6.899 -13.864
  813   2HH2  ARG  98          2HH1      ARG  98  18.528   8.530 -14.397
  814    H    GLY  99           H        GLY  99  24.355   1.901 -13.766
  815   1HA   GLY  99          2HA       GLY  99  26.637   3.528 -14.741
  816   2HA   GLY  99          1HA       GLY  99  26.994   2.175 -13.668
  817    H    VAL 100           H        VAL 100  28.226   1.512 -15.712
  818    HA   VAL 100           HA       VAL 100  26.463  -0.285 -17.285
  819    HB   VAL 100           HB       VAL 100  27.802   0.387 -19.360
  820   1HG1  VAL 100          1HG1      VAL 100  26.142   1.885 -19.940
  821   2HG1  VAL 100          2HG1      VAL 100  26.254   2.761 -18.415
  822   3HG1  VAL 100          3HG1      VAL 100  25.416   1.212 -18.482
  823   1HG2  VAL 100          1HG2      VAL 100  28.766   2.361 -17.341
  824   2HG2  VAL 100          2HG2      VAL 100  28.448   2.970 -18.964
  825   3HG2  VAL 100          3HG2      VAL 100  29.610   1.666 -18.725
  826    H    SER 101           HN       SER 101  27.480  -2.222 -17.826
  827    HA   SER 101           HA       SER 101  30.402  -2.449 -17.328
  828   1HB   SER 101          2HB       SER 101  30.007  -4.541 -16.016
  829   2HB   SER 101          1HB       SER 101  29.382  -3.103 -15.213
  830    HG   SER 101           HG       SER 101  27.706  -4.469 -15.141
  Start of MODEL   10
    1   1H    GLU   1          1HT       GLU   1   9.927  16.093  -4.702
    2   2H    GLU   1          2HT       GLU   1   9.509  14.487  -5.066
    3   3H    GLU   1          3HT       GLU   1   9.649  14.984  -3.448
    4    HA   GLU   1           HA       GLU   1   7.723  16.314  -3.567
    5   1HB   GLU   1          2HB       GLU   1   8.153  15.929  -6.509
    6   2HB   GLU   1          1HB       GLU   1   6.511  16.195  -5.922
    7   1HG   GLU   1          2HG       GLU   1   7.062  18.309  -5.001
    8   2HG   GLU   1          1HG       GLU   1   8.794  17.989  -5.097
    9    H    SER   2           H        SER   2   8.036  13.842  -2.593
   10    HA   SER   2           HA       SER   2   6.884  11.850  -2.138
   11   1HB   SER   2          2HB       SER   2   4.962  13.791  -2.660
   12   2HB   SER   2          1HB       SER   2   4.501  12.463  -3.720
   13    HG   SER   2           HG       SER   2   5.213  12.021  -1.026
   14    H    LYS   3           H        LYS   3   8.474  12.172  -4.664
   15    HA   LYS   3           HA       LYS   3   7.042  10.616  -6.673
   16   1HB   LYS   3          2HB       LYS   3   9.198  10.648  -7.881
   17   2HB   LYS   3          1HB       LYS   3   8.737  12.259  -7.342
   18   1HG   LYS   3          2HG       LYS   3  10.191  11.937  -5.322
   19   2HG   LYS   3          1HG       LYS   3  10.739  10.412  -6.015
   20   1HD   LYS   3          2HD       LYS   3  11.203  11.959  -8.135
   21   2HD   LYS   3          1HD       LYS   3  11.309  13.210  -6.897
   22   1HE   LYS   3          2HE       LYS   3  12.758  11.070  -5.836
   23   2HE   LYS   3          1HE       LYS   3  13.203  11.093  -7.542
   24   1HZ   LYS   3          1HZ       LYS   3  14.655  12.622  -6.728
   25   2HZ   LYS   3          2HZ       LYS   3  13.620  13.129  -5.480
   26   3HZ   LYS   3          3HZ       LYS   3  13.356  13.654  -7.074
   27    HA   PRO   4           HA       PRO   4   8.162   6.740  -4.849
   28   1HB   PRO   4          2HB       PRO   4   7.157   5.170  -6.867
   29   2HB   PRO   4          1HB       PRO   4   6.143   5.961  -5.648
   30   1HG   PRO   4          2HG       PRO   4   6.524   6.672  -8.515
   31   2HG   PRO   4          1HG       PRO   4   5.150   7.008  -7.449
   32   1HD   PRO   4          2HD       PRO   4   7.187   8.845  -8.196
   33   2HD   PRO   4          1HD       PRO   4   5.964   9.085  -6.932
   34    HA   PRO   5           HA       PRO   5  11.924   5.686  -6.938
   35   1HB   PRO   5          2HB       PRO   5  12.400   3.312  -5.627
   36   2HB   PRO   5          1HB       PRO   5  12.681   4.904  -4.902
   37   1HG   PRO   5          2HG       PRO   5  10.478   2.968  -4.378
   38   2HG   PRO   5          1HG       PRO   5  11.159   4.203  -3.310
   39   1HD   PRO   5          2HD       PRO   5   8.727   4.411  -4.737
   40   2HD   PRO   5          1HD       PRO   5   9.592   5.749  -3.951
   41    H    TYR   6           H        TYR   6   9.207   3.467  -6.746
   42    HA   TYR   6           HA       TYR   6  10.213   1.984  -9.127
   43   1HB   TYR   6          2HB       TYR   6   7.755   1.234  -7.564
   44   2HB   TYR   6          1HB       TYR   6   8.820   0.196  -8.511
   45    HD1  TYR   6           HD1      TYR   6  11.199  -0.204  -7.669
   46    HD2  TYR   6           HD2      TYR   6   8.126   1.569  -5.248
   47    HE1  TYR   6           HE1      TYR   6  12.498  -0.740  -5.625
   48    HE2  TYR   6           HE2      TYR   6   9.430   1.037  -3.205
   49    HH   TYR   6           HH       TYR   6  11.940   0.634  -2.679
   50    H    SER   7           H        SER   7   8.305   1.388 -10.692
   51    HA   SER   7           HA       SER   7   7.250   3.749 -11.824
   52   1HB   SER   7          2HB       SER   7   6.502   0.843 -12.005
   53   2HB   SER   7          1HB       SER   7   5.427   2.044 -12.718
   54    HG   SER   7           HG       SER   7   6.970   1.378 -14.228
   55    H    TYR   8           H        TYR   8   4.533   3.765 -11.996
   56    HA   TYR   8           HA       TYR   8   3.803   4.260  -9.175
   57   1HB   TYR   8          2HB       TYR   8   3.085   5.488 -11.650
   58   2HB   TYR   8          1HB       TYR   8   1.613   4.872 -10.882
   59    HD1  TYR   8           HD1      TYR   8   1.988   5.009  -8.107
   60    HD2  TYR   8           HD2      TYR   8   3.442   7.739 -11.080
   61    HE1  TYR   8           HE1      TYR   8   2.153   6.772  -6.391
   62    HE2  TYR   8           HE2      TYR   8   3.602   9.513  -9.366
   63    HH   TYR   8           HH       TYR   8   3.699   9.846  -7.072
   64    H    ALA   9           H        ALA   9   4.071   1.568 -10.294
   65    HA   ALA   9           HA       ALA   9   1.391   0.574  -9.483
   66   1HB   ALA   9          1HB       ALA   9   2.429   0.423 -12.103
   67   2HB   ALA   9          2HB       ALA   9   1.005  -0.401 -11.467
   68   3HB   ALA   9          3HB       ALA   9   2.577  -1.197 -11.423
   69    H    GLN  10           H        GLN  10   4.770   0.454  -9.127
   70    HA   GLN  10           HA       GLN  10   4.855  -2.320  -8.131
   71   1HB   GLN  10          2HB       GLN  10   6.783  -0.314  -8.957
   72   2HB   GLN  10          1HB       GLN  10   7.195  -0.944  -7.362
   73   1HG   GLN  10          2HG       GLN  10   7.543  -3.087  -8.143
   74   2HG   GLN  10          1HG       GLN  10   6.377  -2.910  -9.455
   75   1HE2  GLN  10          1HE2      GLN  10   9.738  -2.417  -8.542
   76   2HE2  GLN  10          2HE2      GLN  10  10.280  -1.934 -10.077
   77    H    LEU  11           H        LEU  11   4.413   0.916  -6.985
   78    HA   LEU  11           HA       LEU  11   4.992   0.321  -4.184
   79   1HB   LEU  11          2HB       LEU  11   3.045   2.482  -4.562
   80   2HB   LEU  11          1HB       LEU  11   4.605   2.541  -3.765
   81    HG   LEU  11           HG       LEU  11   4.834   4.040  -5.538
   82   1HD1  LEU  11          1HD1      LEU  11   6.760   3.142  -6.244
   83   2HD1  LEU  11          2HD1      LEU  11   5.877   2.054  -7.315
   84   3HD1  LEU  11          3HD1      LEU  11   6.225   1.568  -5.658
   85   1HD2  LEU  11          1HD2      LEU  11   3.065   3.906  -6.951
   86   2HD2  LEU  11          2HD2      LEU  11   2.991   2.147  -6.849
   87   3HD2  LEU  11          3HD2      LEU  11   4.161   2.920  -7.916
   88    H    ILE  12           H        ILE  12   2.388  -0.034  -6.425
   89    HA   ILE  12           HA       ILE  12   0.466  -0.477  -4.288
   90    HB   ILE  12           HB       ILE  12  -0.106  -1.275  -7.098
   91   1HG1  ILE  12          2HG1      ILE  12   0.648   0.862  -7.723
   92   2HG1  ILE  12          1HG1      ILE  12  -1.008   1.210  -7.276
   93   1HG2  ILE  12          1HG2      ILE  12  -2.251   0.049  -6.094
   94   2HG2  ILE  12          2HG2      ILE  12  -1.505  -0.541  -4.610
   95   3HG2  ILE  12          3HG2      ILE  12  -1.959  -1.673  -5.875
   96   1HD1  ILE  12          1HD1      ILE  12   0.800   1.363  -4.979
   97   2HD1  ILE  12          2HD1      ILE  12  -0.367   2.513  -5.578
   98   3HD1  ILE  12          3HD1      ILE  12   1.246   2.473  -6.271
   99    H    VAL  13           H        VAL  13   1.712  -2.507  -6.991
  100    HA   VAL  13           HA       VAL  13   0.616  -4.930  -6.121
  101    HB   VAL  13           HB       VAL  13   3.378  -4.589  -7.317
  102   1HG1  VAL  13          1HG1      VAL  13   2.737  -6.896  -8.240
  103   2HG1  VAL  13          2HG1      VAL  13   1.435  -6.890  -7.052
  104   3HG1  VAL  13          3HG1      VAL  13   3.112  -6.823  -6.519
  105   1HG2  VAL  13          1HG2      VAL  13   1.534  -3.463  -8.599
  106   2HG2  VAL  13          2HG2      VAL  13   0.700  -5.015  -8.683
  107   3HG2  VAL  13          3HG2      VAL  13   2.263  -4.809  -9.475
  108    H    GLN  14           H        GLN  14   3.713  -3.467  -5.084
  109    HA   GLN  14           HA       GLN  14   4.294  -5.655  -3.262
  110   1HB   GLN  14          2HB       GLN  14   5.631  -3.324  -4.194
  111   2HB   GLN  14          1HB       GLN  14   5.534  -3.191  -2.437
  112   1HG   GLN  14          2HG       GLN  14   6.444  -5.505  -2.248
  113   2HG   GLN  14          1HG       GLN  14   6.636  -5.542  -4.001
  114   1HE2  GLN  14          1HE2      GLN  14   7.446  -2.716  -4.238
  115   2HE2  GLN  14          2HE2      GLN  14   9.011  -2.605  -3.590
  116    H    ALA  15           H        ALA  15   2.443  -2.732  -3.172
  117    HA   ALA  15           HA       ALA  15   2.255  -2.447  -0.317
  118   1HB   ALA  15          1HB       ALA  15   0.059  -1.169  -1.159
  119   2HB   ALA  15          2HB       ALA  15   0.872  -1.331  -2.714
  120   3HB   ALA  15          3HB       ALA  15   1.670  -0.487  -1.387
  121    H    ILE  16           H        ILE  16  -0.084  -3.814  -2.685
  122    HA   ILE  16           HA       ILE  16  -1.723  -4.853  -0.485
  123    HB   ILE  16           HB       ILE  16  -2.638  -5.953  -2.933
  124   1HG1  ILE  16          2HG1      ILE  16  -1.735  -3.066  -3.173
  125   2HG1  ILE  16          1HG1      ILE  16  -1.370  -4.402  -4.265
  126   1HG2  ILE  16          1HG2      ILE  16  -3.629  -3.477  -1.498
  127   2HG2  ILE  16          2HG2      ILE  16  -3.905  -5.119  -0.915
  128   3HG2  ILE  16          3HG2      ILE  16  -4.578  -4.607  -2.463
  129   1HD1  ILE  16          1HD1      ILE  16  -3.792  -4.577  -4.814
  130   2HD1  ILE  16          2HD1      ILE  16  -3.116  -3.007  -5.248
  131   3HD1  ILE  16          3HD1      ILE  16  -4.100  -3.172  -3.795
  132    H    SER  17           H        SER  17   0.318  -6.202  -3.060
  133    HA   SER  17           HA       SER  17  -0.205  -8.937  -2.661
  134   1HB   SER  17          2HB       SER  17   1.337  -7.786  -4.395
  135   2HB   SER  17          1HB       SER  17   2.587  -7.915  -3.161
  136    HG   SER  17           HG       SER  17   2.234 -10.152  -3.129
  137    H    SER  18           H        SER  18   2.124  -6.852  -0.955
  138    HA   SER  18           HA       SER  18   3.011  -9.031   0.771
  139   1HB   SER  18          2HB       SER  18   3.457  -6.043   0.780
  140   2HB   SER  18          1HB       SER  18   4.080  -7.086   2.057
  141    HG   SER  18           HG       SER  18   5.656  -6.964   0.519
  142    H    ALA  19           H        ALA  19   0.347  -6.876   0.754
  143    HA   ALA  19           HA       ALA  19  -0.125  -6.532   3.539
  144   1HB   ALA  19          1HB       ALA  19  -2.386  -6.003   2.932
  145   2HB   ALA  19          2HB       ALA  19  -2.270  -6.937   1.440
  146   3HB   ALA  19          3HB       ALA  19  -1.371  -5.429   1.608
  147    H    GLN  20           H        GLN  20  -2.387  -7.663   4.373
  148    HA   GLN  20           HA       GLN  20  -1.748 -10.253   5.193
  149   1HB   GLN  20          2HB       GLN  20  -4.518  -9.128   4.660
  150   2HB   GLN  20          1HB       GLN  20  -4.177 -10.567   5.620
  151   1HG   GLN  20          2HG       GLN  20  -2.894  -7.915   6.255
  152   2HG   GLN  20          1HG       GLN  20  -4.483  -8.340   6.889
  153   1HE2  GLN  20          1HE2      GLN  20  -1.664  -8.109   8.201
  154   2HE2  GLN  20          2HE2      GLN  20  -1.517  -9.561   9.069
  155    H    ASP  21           H        ASP  21  -4.520  -9.955   3.013
  156    HA   ASP  21           HA       ASP  21  -3.655 -12.425   1.646
  157   1HB   ASP  21          2HB       ASP  21  -6.085 -11.723   2.448
  158   2HB   ASP  21          1HB       ASP  21  -6.120 -10.896   0.889
  159    H    ARG  22           H        ARG  22  -5.102  -9.410   0.398
  160    HA   ARG  22           HA       ARG  22  -2.913  -8.605  -1.216
  161   1HB   ARG  22          2HB       ARG  22  -3.759  -9.361  -3.451
  162   2HB   ARG  22          1HB       ARG  22  -3.216 -10.695  -2.433
  163   1HG   ARG  22          2HG       ARG  22  -5.812 -10.563  -1.672
  164   2HG   ARG  22          1HG       ARG  22  -5.956 -10.003  -3.339
  165   1HD   ARG  22          2HD       ARG  22  -4.787 -12.001  -4.141
  166   2HD   ARG  22          1HD       ARG  22  -4.554 -12.552  -2.482
  167    HE   ARG  22           HE       ARG  22  -7.358 -12.105  -3.115
  168   1HH1  ARG  22          1HH1      ARG  22  -5.629 -14.044  -4.998
  169   2HH1  ARG  22          2HH1      ARG  22  -6.182 -15.560  -4.370
  170   1HH2  ARG  22          1HH2      ARG  22  -7.679 -14.159  -1.575
  171   2HH2  ARG  22          2HH2      ARG  22  -7.344 -15.626  -2.434
  172    H    GLN  23           H        GLN  23  -5.089  -7.513   0.380
  173    HA   GLN  23           HA       GLN  23  -6.261  -5.723  -1.692
  174   1HB   GLN  23          2HB       GLN  23  -8.430  -5.790  -0.634
  175   2HB   GLN  23          1HB       GLN  23  -7.931  -7.458  -0.925
  176   1HG   GLN  23          2HG       GLN  23  -7.055  -7.541   1.428
  177   2HG   GLN  23          1HG       GLN  23  -7.750  -5.941   1.694
  178   1HE2  GLN  23          1HE2      GLN  23 -10.139  -6.482  -0.005
  179   2HE2  GLN  23          2HE2      GLN  23 -11.113  -7.549   0.886
  180    H    LEU  24           H        LEU  24  -6.464  -3.567  -1.050
  181    HA   LEU  24           HA       LEU  24  -5.680  -2.889   1.736
  182   1HB   LEU  24          2HB       LEU  24  -4.429  -1.912  -0.838
  183   2HB   LEU  24          1HB       LEU  24  -4.363  -0.968   0.642
  184    HG   LEU  24           HG       LEU  24  -3.420  -3.835   0.448
  185   1HD1  LEU  24          1HD1      LEU  24  -1.708  -2.905  -0.727
  186   2HD1  LEU  24          2HD1      LEU  24  -1.195  -2.273   0.836
  187   3HD1  LEU  24          3HD1      LEU  24  -2.152  -1.269  -0.253
  188   1HD2  LEU  24          1HD2      LEU  24  -3.514  -1.723   2.573
  189   2HD2  LEU  24          2HD2      LEU  24  -2.142  -2.833   2.560
  190   3HD2  LEU  24          3HD2      LEU  24  -3.784  -3.460   2.713
  191    H    THR  25           H        THR  25  -6.507  -0.824   2.409
  192    HA   THR  25           HA       THR  25  -8.922   0.007   0.964
  193    HB   THR  25           HB       THR  25  -9.357   1.408   2.842
  194    HG1  THR  25           HG1      THR  25  -7.126   1.239   4.275
  195   1HG2  THR  25          1HG2      THR  25  -9.527  -0.958   3.416
  196   2HG2  THR  25          2HG2      THR  25  -8.896  -0.066   4.801
  197   3HG2  THR  25          3HG2      THR  25  -7.805  -1.017   3.792
  198    H    LEU  26           H        LEU  26  -8.995   2.684   0.892
  199    HA   LEU  26           HA       LEU  26  -7.111   3.366  -1.159
  200   1HB   LEU  26          2HB       LEU  26  -9.427   4.530  -0.280
  201   2HB   LEU  26          1HB       LEU  26  -8.220   5.638   0.376
  202    HG   LEU  26           HG       LEU  26  -7.836   4.725  -2.437
  203   1HD1  LEU  26          1HD1      LEU  26 -10.334   5.358  -2.004
  204   2HD1  LEU  26          2HD1      LEU  26  -9.494   6.104  -3.364
  205   3HD1  LEU  26          3HD1      LEU  26  -9.719   7.005  -1.864
  206   1HD2  LEU  26          1HD2      LEU  26  -7.382   7.341  -2.468
  207   2HD2  LEU  26          2HD2      LEU  26  -6.193   6.238  -1.775
  208   3HD2  LEU  26          3HD2      LEU  26  -7.291   7.128  -0.720
  209    H    SER  27           H        SER  27  -7.158   3.904   2.332
  210    HA   SER  27           HA       SER  27  -4.494   5.212   2.162
  211   1HB   SER  27          2HB       SER  27  -6.606   5.926   3.655
  212   2HB   SER  27          1HB       SER  27  -5.859   4.791   4.775
  213    HG   SER  27           HG       SER  27  -4.436   6.859   3.456
  214    H    GLY  28           H        GLY  28  -4.973   2.273   1.728
  215   1HA   GLY  28          2HA       GLY  28  -3.578   1.145   4.119
  216   2HA   GLY  28          1HA       GLY  28  -4.380   0.192   2.868
  217    H    ILE  29           H        ILE  29  -3.410   1.287   0.604
  218    HA   ILE  29           HA       ILE  29  -0.940   0.052   0.136
  219    HB   ILE  29           HB       ILE  29  -2.683   0.903  -1.480
  220   1HG1  ILE  29          2HG1      ILE  29   0.232   1.535  -1.903
  221   2HG1  ILE  29          1HG1      ILE  29  -0.655   0.094  -2.421
  222   1HG2  ILE  29          1HG2      ILE  29  -2.404   3.272  -0.266
  223   2HG2  ILE  29          2HG2      ILE  29  -2.915   3.136  -1.945
  224   3HG2  ILE  29          3HG2      ILE  29  -1.230   3.484  -1.562
  225   1HD1  ILE  29          1HD1      ILE  29  -2.114   2.244  -3.447
  226   2HD1  ILE  29          2HD1      ILE  29  -1.082   1.148  -4.349
  227   3HD1  ILE  29          3HD1      ILE  29  -0.427   2.661  -3.737
  228    H    TYR  30           H        TYR  30  -1.704   3.193   1.389
  229    HA   TYR  30           HA       TYR  30   0.947   4.314   1.026
  230   1HB   TYR  30          2HB       TYR  30  -1.198   5.236   2.949
  231   2HB   TYR  30          1HB       TYR  30   0.111   6.200   2.256
  232    HD1  TYR  30           HD1      TYR  30  -3.092   6.424   2.043
  233    HD2  TYR  30           HD2      TYR  30   0.028   5.043  -0.525
  234    HE1  TYR  30           HE1      TYR  30  -4.497   6.912   0.053
  235    HE2  TYR  30           HE2      TYR  30  -1.348   5.531  -2.509
  236    HH   TYR  30           HH       TYR  30  -4.423   7.222  -2.219
  237    H    ALA  31           H        ALA  31  -0.786   3.594   4.072
  238    HA   ALA  31           HA       ALA  31   1.527   3.658   5.699
  239   1HB   ALA  31          1HB       ALA  31  -0.857   1.855   6.171
  240   2HB   ALA  31          2HB       ALA  31  -0.900   3.595   6.457
  241   3HB   ALA  31          3HB       ALA  31   0.205   2.576   7.381
  242    H    HIS  32           H        HIS  32   0.595   1.301   3.359
  243    HA   HIS  32           HA       HIS  32   1.954  -0.933   4.643
  244   1HB   HIS  32          2HB       HIS  32   0.101  -1.294   3.055
  245   2HB   HIS  32          1HB       HIS  32   1.076  -0.591   1.762
  246    HD1  HIS  32           HD1      HIS  32   0.319  -3.762   3.325
  247    HD2  HIS  32           HD2      HIS  32   3.663  -2.128   1.447
  248    HE1  HIS  32           HE1      HIS  32   1.831  -5.705   2.736
  249    H    ILE  33           H        ILE  33   2.709   0.197   1.363
  250    HA   ILE  33           HA       ILE  33   5.428  -0.594   1.483
  251    HB   ILE  33           HB       ILE  33   5.702   0.990  -0.470
  252   1HG1  ILE  33          2HG1      ILE  33   3.026   1.443  -1.115
  253   2HG1  ILE  33          1HG1      ILE  33   3.147   1.880   0.593
  254   1HG2  ILE  33          1HG2      ILE  33   3.575  -1.140  -0.340
  255   2HG2  ILE  33          2HG2      ILE  33   5.205  -1.257  -1.005
  256   3HG2  ILE  33          3HG2      ILE  33   3.970  -0.335  -1.856
  257   1HD1  ILE  33          1HD1      ILE  33   5.478   2.869  -0.742
  258   2HD1  ILE  33          2HD1      ILE  33   4.195   3.795   0.037
  259   3HD1  ILE  33          3HD1      ILE  33   4.062   3.365  -1.669
  260    H    THR  34           H        THR  34   3.937   2.387   2.550
  261    HA   THR  34           HA       THR  34   6.182   4.093   2.476
  262    HB   THR  34           HB       THR  34   5.134   5.201   4.512
  263    HG1  THR  34           HG1      THR  34   3.864   3.960   5.596
  264   1HG2  THR  34          1HG2      THR  34   4.274   6.242   2.682
  265   2HG2  THR  34          2HG2      THR  34   2.807   5.358   3.102
  266   3HG2  THR  34          3HG2      THR  34   3.898   4.721   1.872
  267    H    LYS  35           H        LYS  35   5.405   1.458   4.661
  268    HA   LYS  35           HA       LYS  35   7.645   2.122   6.453
  269   1HB   LYS  35          2HB       LYS  35   5.444   1.083   7.216
  270   2HB   LYS  35          1HB       LYS  35   5.987  -0.407   6.445
  271   1HG   LYS  35          2HG       LYS  35   7.952   0.900   8.239
  272   2HG   LYS  35          1HG       LYS  35   6.532   0.212   9.029
  273   1HD   LYS  35          2HD       LYS  35   6.949  -1.955   8.036
  274   2HD   LYS  35          1HD       LYS  35   8.256  -1.300   7.048
  275   1HE   LYS  35          2HE       LYS  35   9.745  -1.422   8.747
  276   2HE   LYS  35          1HE       LYS  35   8.599  -0.749   9.906
  277   1HZ   LYS  35          1HZ       LYS  35   9.413  -3.273   9.957
  278   2HZ   LYS  35          2HZ       LYS  35   8.041  -3.442   8.969
  279   3HZ   LYS  35          3HZ       LYS  35   7.893  -2.779  10.527
  280    H    HIS  36           H        HIS  36   7.028   0.115   3.671
  281    HA   HIS  36           HA       HIS  36   9.621  -1.300   4.105
  282   1HB   HIS  36          2HB       HIS  36   7.402  -1.933   2.140
  283   2HB   HIS  36          1HB       HIS  36   8.827  -2.920   2.460
  284    HD1  HIS  36           HD1      HIS  36   8.996  -3.992   4.895
  285    HD2  HIS  36           HD2      HIS  36   5.309  -2.279   3.971
  286    HE1  HIS  36           HE1      HIS  36   7.351  -4.862   6.612
  287    H    TYR  37           H        TYR  37   8.767   1.489   2.718
  288    HA   TYR  37           HA       TYR  37  10.405   1.003   0.263
  289   1HB   TYR  37          2HB       TYR  37   8.059   2.745   0.833
  290   2HB   TYR  37          1HB       TYR  37   9.287   3.403  -0.242
  291    HD1  TYR  37           HD1      TYR  37   9.045  -0.208  -0.168
  292    HD2  TYR  37           HD2      TYR  37   7.476   3.331  -2.029
  293    HE1  TYR  37           HE1      TYR  37   8.153  -1.584  -2.027
  294    HE2  TYR  37           HE2      TYR  37   6.584   1.954  -3.886
  295    HH   TYR  37           HH       TYR  37   6.131  -1.240  -3.761
  296    HA   PRO  38           HA       PRO  38  13.465   3.696   1.880
  297   1HB   PRO  38          2HB       PRO  38  14.557   4.576  -0.485
  298   2HB   PRO  38          1HB       PRO  38  14.830   2.953   0.175
  299   1HG   PRO  38          2HG       PRO  38  13.099   3.784  -2.109
  300   2HG   PRO  38          1HG       PRO  38  13.891   2.228  -1.809
  301   1HD   PRO  38          2HD       PRO  38  11.155   2.806  -1.369
  302   2HD   PRO  38          1HD       PRO  38  12.032   1.383  -0.766
  303    H    TYR  39           H        TYR  39  12.133   5.229  -1.080
  304    HA   TYR  39           HA       TYR  39  12.321   7.876   0.125
  305   1HB   TYR  39          2HB       TYR  39  12.557   7.382  -2.354
  306   2HB   TYR  39          1HB       TYR  39  10.815   7.104  -2.386
  307    HD1  TYR  39           HD1      TYR  39  13.344   9.638  -1.278
  308    HD2  TYR  39           HD2      TYR  39   9.362   8.911  -2.713
  309    HE1  TYR  39           HE1      TYR  39  12.956  12.082  -1.437
  310    HE2  TYR  39           HE2      TYR  39   8.972  11.355  -2.872
  311    HH   TYR  39           HH       TYR  39  11.271  13.668  -1.594
  312    H    TYR  40           H        TYR  40   9.606   5.745  -0.844
  313    HA   TYR  40           HA       TYR  40   7.609   7.507   0.278
  314   1HB   TYR  40          2HB       TYR  40   7.639   4.679  -0.742
  315   2HB   TYR  40          1HB       TYR  40   6.229   5.274   0.136
  316    HD1  TYR  40           HD1      TYR  40   8.101   7.819  -1.592
  317    HD2  TYR  40           HD2      TYR  40   5.008   4.884  -2.100
  318    HE1  TYR  40           HE1      TYR  40   7.322   8.998  -3.624
  319    HE2  TYR  40           HE2      TYR  40   4.230   6.064  -4.136
  320    HH   TYR  40           HH       TYR  40   4.742   7.655  -5.645
  321    H    ARG  41           H        ARG  41   7.939   7.942   2.460
  322    HA   ARG  41           HA       ARG  41   7.626   5.639   4.298
  323   1HB   ARG  41          2HB       ARG  41  10.059   7.228   3.963
  324   2HB   ARG  41          1HB       ARG  41   9.466   7.245   5.624
  325   1HG   ARG  41          2HG       ARG  41   9.215   4.684   5.353
  326   2HG   ARG  41          1HG       ARG  41  10.259   4.870   3.943
  327   1HD   ARG  41          2HD       ARG  41  11.627   6.335   5.797
  328   2HD   ARG  41          1HD       ARG  41  10.920   5.080   6.815
  329    HE   ARG  41           HE       ARG  41  11.958   3.643   4.713
  330   1HH1  ARG  41          1HH1      ARG  41  13.105   5.884   7.065
  331   2HH1  ARG  41          2HH1      ARG  41  14.761   5.405   6.907
  332   1HH2  ARG  41          1HH2      ARG  41  14.134   3.098   4.396
  333   2HH2  ARG  41          2HH2      ARG  41  15.344   3.829   5.399
  334    H    THR  42           H        THR  42   8.422   9.102   4.706
  335    HA   THR  42           HA       THR  42   6.084   9.310   6.526
  336    HB   THR  42           HB       THR  42   7.098  11.294   7.384
  337    HG1  THR  42           HG1      THR  42   8.078  12.543   6.040
  338   1HG2  THR  42          1HG2      THR  42   8.466   8.853   7.301
  339   2HG2  THR  42          2HG2      THR  42   8.749  10.177   8.431
  340   3HG2  THR  42          3HG2      THR  42   9.694  10.068   6.946
  341    H    ALA  43           H        ALA  43   7.230  10.369   3.402
  342    HA   ALA  43           HA       ALA  43   5.521  12.616   3.015
  343   1HB   ALA  43          1HB       ALA  43   7.425  11.789   1.501
  344   2HB   ALA  43          2HB       ALA  43   5.974  12.378   0.687
  345   3HB   ALA  43          3HB       ALA  43   6.256  10.644   0.843
  346    H    ASP  44           H        ASP  44   3.588  12.536   1.419
  347    HA   ASP  44           HA       ASP  44   2.076  10.095   1.178
  348   1HB   ASP  44          2HB       ASP  44   0.223  10.800   2.763
  349   2HB   ASP  44          1HB       ASP  44   1.712  10.272   3.548
  350    H    LYS  45           H        LYS  45   1.697  13.631   1.595
  351    HA   LYS  45           HA       LYS  45  -0.535  13.741  -0.259
  352   1HB   LYS  45          2HB       LYS  45  -0.133  15.411   1.583
  353   2HB   LYS  45          1HB       LYS  45   1.246  16.014   0.663
  354   1HG   LYS  45          2HG       LYS  45  -0.564  16.128  -1.289
  355   2HG   LYS  45          1HG       LYS  45  -1.674  16.257   0.077
  356   1HD   LYS  45          2HD       LYS  45  -0.694  18.251   0.848
  357   2HD   LYS  45          1HD       LYS  45   0.798  17.974  -0.052
  358   1HE   LYS  45          2HE       LYS  45  -1.680  18.171  -1.673
  359   2HE   LYS  45          1HE       LYS  45  -1.141  19.661  -0.901
  360   1HZ   LYS  45          1HZ       LYS  45  -0.220  18.919  -3.226
  361   2HZ   LYS  45          2HZ       LYS  45   0.855  18.015  -2.272
  362   3HZ   LYS  45          3HZ       LYS  45   0.775  19.705  -2.100
  363    H    GLY  46           H        GLY  46   0.469  12.611  -2.095
  364   1HA   GLY  46          2HA       GLY  46   1.407  14.367  -4.118
  365   2HA   GLY  46          1HA       GLY  46   2.816  13.563  -3.421
  366    H    TRP  47           H        TRP  47   1.749  11.026  -2.923
  367    HA   TRP  47           HA       TRP  47   1.270  10.076  -5.702
  368   1HB   TRP  47          2HB       TRP  47   2.267   7.974  -5.034
  369   2HB   TRP  47          1HB       TRP  47   3.356   9.285  -4.618
  370    HD1  TRP  47           HD1      TRP  47   2.766  10.194  -1.881
  371    HE1  TRP  47           HE1      TRP  47   2.746   8.662   0.173
  372    HE3  TRP  47           HE3      TRP  47   1.909   5.701  -4.148
  373    HZ2  TRP  47           HZ2      TRP  47   2.446   5.883   0.780
  374    HZ3  TRP  47           HZ3      TRP  47   1.785   3.628  -2.810
  375    HH2  TRP  47           HH2      TRP  47   2.030   3.718  -0.349
  376    H    GLN  48           H        GLN  48   0.027   9.966  -2.421
  377    HA   GLN  48           HA       GLN  48  -1.685   7.772  -2.636
  378   1HB   GLN  48          2HB       GLN  48  -2.426   8.481  -0.616
  379   2HB   GLN  48          1HB       GLN  48  -1.331   9.841  -0.791
  380   1HG   GLN  48          2HG       GLN  48  -4.235   9.784  -1.680
  381   2HG   GLN  48          1HG       GLN  48  -3.613  10.602  -0.246
  382   1HE2  GLN  48          1HE2      GLN  48  -1.082  11.284  -1.883
  383   2HE2  GLN  48          2HE2      GLN  48  -1.556  12.561  -2.876
  384    H    ASN  49           H        ASN  49  -1.922  10.889  -4.216
  385    HA   ASN  49           HA       ASN  49  -4.698  10.568  -5.036
  386   1HB   ASN  49          2HB       ASN  49  -4.358  12.548  -6.369
  387   2HB   ASN  49          1HB       ASN  49  -3.534  12.798  -4.831
  388   1HD2  ASN  49          1HD2      ASN  49  -3.048  12.342  -8.289
  389   2HD2  ASN  49          2HD2      ASN  49  -1.374  12.622  -8.280
  390    H    SER  50           H        SER  50  -1.560  10.272  -6.719
  391    HA   SER  50           HA       SER  50  -2.693   9.345  -9.180
  392   1HB   SER  50          2HB       SER  50  -0.048   8.255  -8.517
  393   2HB   SER  50          1HB       SER  50  -0.534   9.272  -9.868
  394    HG   SER  50           HG       SER  50   0.157  10.940  -8.802
  395    H    ILE  51           H        ILE  51  -2.333   7.902  -6.118
  396    HA   ILE  51           HA       ILE  51  -2.169   5.140  -7.019
  397    HB   ILE  51           HB       ILE  51  -2.541   6.585  -4.397
  398   1HG1  ILE  51          2HG1      ILE  51  -0.311   6.125  -4.468
  399   2HG1  ILE  51          1HG1      ILE  51  -0.788   4.510  -3.974
  400   1HG2  ILE  51          1HG2      ILE  51  -2.986   4.473  -3.222
  401   2HG2  ILE  51          2HG2      ILE  51  -3.015   3.596  -4.751
  402   3HG2  ILE  51          3HG2      ILE  51  -4.267   4.786  -4.391
  403   1HD1  ILE  51          1HD1      ILE  51  -0.968   3.948  -6.452
  404   2HD1  ILE  51          2HD1      ILE  51   0.662   4.226  -5.842
  405   3HD1  ILE  51          3HD1      ILE  51  -0.162   5.484  -6.764
  406    H    ARG  52           H        ARG  52  -4.802   6.923  -5.332
  407    HA   ARG  52           HA       ARG  52  -6.809   5.010  -5.729
  408   1HB   ARG  52          2HB       ARG  52  -7.352   6.936  -4.422
  409   2HB   ARG  52          1HB       ARG  52  -6.933   8.035  -5.735
  410   1HG   ARG  52          2HG       ARG  52  -8.821   7.150  -7.068
  411   2HG   ARG  52          1HG       ARG  52  -9.251   6.079  -5.734
  412   1HD   ARG  52          2HD       ARG  52 -10.590   7.793  -5.072
  413   2HD   ARG  52          1HD       ARG  52  -9.096   8.500  -4.458
  414    HE   ARG  52           HE       ARG  52  -9.320  10.148  -6.114
  415   1HH1  ARG  52          1HH2      ARG  52 -11.761   7.877  -6.560
  416   2HH1  ARG  52          2HH2      ARG  52 -12.027   8.236  -8.233
  417   1HH2  ARG  52          1HH1      ARG  52  -9.292  10.353  -8.487
  418   2HH2  ARG  52          2HH1      ARG  52 -10.629   9.638  -9.325
  419    H    HIS  53           H        HIS  53  -5.639   7.503  -7.955
  420    HA   HIS  53           HA       HIS  53  -7.496   6.802 -10.079
  421   1HB   HIS  53          2HB       HIS  53  -5.903   8.963  -9.540
  422   2HB   HIS  53          1HB       HIS  53  -4.977   8.156 -10.807
  423    HD1  HIS  53           HD1      HIS  53  -7.400  10.674 -10.563
  424    HD2  HIS  53           HD2      HIS  53  -7.114   7.275 -12.961
  425    HE1  HIS  53           HE1      HIS  53  -8.916  11.071 -12.552
  426    H    ASN  54           H        ASN  54  -4.293   5.744  -9.117
  427    HA   ASN  54           HA       ASN  54  -3.540   4.593 -11.639
  428   1HB   ASN  54          2HB       ASN  54  -2.494   4.647  -8.900
  429   2HB   ASN  54          1HB       ASN  54  -2.162   3.138  -9.750
  430   1HD2  ASN  54          1HD2      ASN  54  -0.632   5.921  -9.138
  431   2HD2  ASN  54          2HD2      ASN  54   0.190   6.169 -10.601
  432    H    LEU  55           H        LEU  55  -5.105   3.165  -8.741
  433    HA   LEU  55           HA       LEU  55  -4.995   0.484  -9.664
  434   1HB   LEU  55          2HB       LEU  55  -7.376   1.508  -8.131
  435   2HB   LEU  55          1HB       LEU  55  -6.607  -0.065  -8.034
  436    HG   LEU  55           HG       LEU  55  -5.687   0.799  -6.141
  437   1HD1  LEU  55          1HD1      LEU  55  -3.840   2.576  -7.605
  438   2HD1  LEU  55          2HD1      LEU  55  -3.881   0.895  -8.136
  439   3HD1  LEU  55          3HD1      LEU  55  -3.504   1.284  -6.460
  440   1HD2  LEU  55          1HD2      LEU  55  -6.336   3.448  -7.379
  441   2HD2  LEU  55          2HD2      LEU  55  -5.318   3.357  -5.941
  442   3HD2  LEU  55          3HD2      LEU  55  -6.965   2.730  -5.897
  443    H    SER  56           H        SER  56  -6.757   3.150 -10.855
  444    HA   SER  56           HA       SER  56  -8.813   1.474 -12.159
  445   1HB   SER  56          2HB       SER  56  -9.864   3.457 -11.696
  446   2HB   SER  56          1HB       SER  56  -8.359   4.371 -11.714
  447    HG   SER  56           HG       SER  56  -8.511   4.607 -13.844
  448    H    LEU  57           H        LEU  57  -5.827   3.170 -12.925
  449    HA   LEU  57           HA       LEU  57  -6.154   2.848 -15.812
  450   1HB   LEU  57          2HB       LEU  57  -3.608   3.467 -14.292
  451   2HB   LEU  57          1HB       LEU  57  -3.959   3.819 -15.985
  452    HG   LEU  57           HG       LEU  57  -5.656   4.947 -13.759
  453   1HD1  LEU  57          1HD1      LEU  57  -3.401   5.698 -13.278
  454   2HD1  LEU  57          2HD1      LEU  57  -4.274   7.035 -14.027
  455   3HD1  LEU  57          3HD1      LEU  57  -3.123   6.090 -14.974
  456   1HD2  LEU  57          1HD2      LEU  57  -6.779   5.857 -15.489
  457   2HD2  LEU  57          2HD2      LEU  57  -5.734   4.974 -16.603
  458   3HD2  LEU  57          3HD2      LEU  57  -5.295   6.601 -16.085
  459    H    ASN  58           H        ASN  58  -3.832   1.477 -13.455
  460    HA   ASN  58           HA       ASN  58  -2.524  -0.373 -15.030
  461   1HB   ASN  58          2HB       ASN  58  -3.537  -1.524 -12.482
  462   2HB   ASN  58          1HB       ASN  58  -1.893  -1.459 -13.110
  463   1HD2  ASN  58          1HD2      ASN  58  -1.197   1.118 -13.316
  464   2HD2  ASN  58          2HD2      ASN  58  -1.460   1.987 -11.884
  465    H    ARG  59           H        ARG  59  -2.958  -2.469 -15.841
  466    HA   ARG  59           HA       ARG  59  -5.833  -3.018 -16.222
  467   1HB   ARG  59          2HB       ARG  59  -5.188  -4.454 -18.001
  468   2HB   ARG  59          1HB       ARG  59  -4.096  -3.073 -18.101
  469   1HG   ARG  59          2HG       ARG  59  -2.891  -4.917 -16.323
  470   2HG   ARG  59          1HG       ARG  59  -3.448  -5.852 -17.710
  471   1HD   ARG  59          2HD       ARG  59  -2.356  -3.504 -18.798
  472   2HD   ARG  59          1HD       ARG  59  -1.228  -3.994 -17.535
  473    HE   ARG  59           HE       ARG  59  -0.676  -5.889 -18.837
  474   1HH1  ARG  59          1HH2      ARG  59  -3.842  -4.831 -19.607
  475   2HH1  ARG  59          2HH2      ARG  59  -3.874  -5.594 -21.162
  476   1HH2  ARG  59          1HH1      ARG  59  -0.590  -6.691 -20.986
  477   2HH2  ARG  59          2HH1      ARG  59  -2.033  -6.646 -21.944
  478    H    TYR  60           H        TYR  60  -3.903  -3.735 -13.740
  479    HA   TYR  60           HA       TYR  60  -5.083  -6.466 -13.488
  480   1HB   TYR  60          2HB       TYR  60  -3.095  -6.894 -11.882
  481   2HB   TYR  60          1HB       TYR  60  -2.797  -6.954 -13.610
  482    HD1  TYR  60           HD1      TYR  60  -2.255  -4.499 -14.640
  483    HD2  TYR  60           HD2      TYR  60  -1.511  -5.720 -10.594
  484    HE1  TYR  60           HE1      TYR  60  -0.473  -2.801 -14.460
  485    HE2  TYR  60           HE2      TYR  60   0.265  -4.020 -10.416
  486    HH   TYR  60           HH       TYR  60   0.787  -1.627 -12.914
  487    H    PHE  61           H        PHE  61  -4.590  -3.352 -12.065
  488    HA   PHE  61           HA       PHE  61  -5.476  -4.201  -9.402
  489   1HB   PHE  61          2HB       PHE  61  -4.789  -1.560 -10.663
  490   2HB   PHE  61          1HB       PHE  61  -5.520  -1.645  -9.065
  491    HD1  PHE  61           HD1      PHE  61  -2.478  -1.617 -10.793
  492    HD2  PHE  61           HD2      PHE  61  -4.368  -3.502  -7.434
  493    HE1  PHE  61           HE1      PHE  61  -0.261  -2.157  -9.870
  494    HE2  PHE  61           HE2      PHE  61  -2.134  -4.035  -6.508
  495    HZ   PHE  61           HZ       PHE  61  -0.092  -3.359  -7.708
  496    H    ILE  62           H        ILE  62  -7.511  -3.984  -8.560
  497    HA   ILE  62           HA       ILE  62  -9.601  -2.628 -10.157
  498    HB   ILE  62           HB       ILE  62 -10.855  -4.506 -10.646
  499   1HG1  ILE  62          2HG1      ILE  62  -9.543  -5.942  -8.309
  500   2HG1  ILE  62          1HG1      ILE  62 -11.137  -5.188  -8.276
  501   1HG2  ILE  62          1HG2      ILE  62  -8.169  -5.860 -10.290
  502   2HG2  ILE  62          2HG2      ILE  62  -8.541  -4.776 -11.630
  503   3HG2  ILE  62          3HG2      ILE  62  -9.435  -6.286 -11.441
  504   1HD1  ILE  62          1HD1      ILE  62 -11.613  -6.713 -10.353
  505   2HD1  ILE  62          2HD1      ILE  62 -11.665  -7.420  -8.738
  506   3HD1  ILE  62          3HD1      ILE  62 -10.243  -7.648  -9.755
  507    H    LYS  63           H        LYS  63 -11.814  -3.050  -8.826
  508    HA   LYS  63           HA       LYS  63 -11.138  -2.581  -5.947
  509   1HB   LYS  63          2HB       LYS  63 -13.540  -1.441  -6.094
  510   2HB   LYS  63          1HB       LYS  63 -12.088  -0.553  -6.554
  511   1HG   LYS  63          2HG       LYS  63 -12.535  -0.721  -8.824
  512   2HG   LYS  63          1HG       LYS  63 -13.472  -2.203  -8.635
  513   1HD   LYS  63          2HD       LYS  63 -14.846  -0.142  -9.178
  514   2HD   LYS  63          1HD       LYS  63 -15.343  -0.999  -7.718
  515   1HE   LYS  63          2HE       LYS  63 -13.912   0.591  -6.388
  516   2HE   LYS  63          1HE       LYS  63 -13.647   1.508  -7.871
  517   1HZ   LYS  63          1HZ       LYS  63 -16.227   1.437  -7.987
  518   2HZ   LYS  63          2HZ       LYS  63 -15.455   2.573  -6.986
  519   3HZ   LYS  63          3HZ       LYS  63 -16.117   1.158  -6.318
  520    H    VAL  64           H        VAL  64 -12.606  -3.523  -4.388
  521    HA   VAL  64           HA       VAL  64 -13.588  -6.113  -5.154
  522    HB   VAL  64           HB       VAL  64 -12.788  -5.360  -2.842
  523   1HG1  VAL  64          1HG1      VAL  64 -14.204  -3.330  -2.721
  524   2HG1  VAL  64          2HG1      VAL  64 -14.522  -4.417  -1.368
  525   3HG1  VAL  64          3HG1      VAL  64 -15.646  -4.345  -2.725
  526   1HG2  VAL  64          1HG2      VAL  64 -15.276  -6.963  -3.390
  527   2HG2  VAL  64          2HG2      VAL  64 -14.711  -6.751  -1.732
  528   3HG2  VAL  64          3HG2      VAL  64 -13.672  -7.530  -2.926
  529    HA   PRO  65           HA       PRO  65 -17.566  -4.722  -6.591
  530   1HB   PRO  65          2HB       PRO  65 -18.543  -7.229  -7.147
  531   2HB   PRO  65          1HB       PRO  65 -17.410  -6.366  -8.202
  532   1HG   PRO  65          2HG       PRO  65 -16.896  -8.670  -6.383
  533   2HG   PRO  65          1HG       PRO  65 -16.030  -8.183  -7.849
  534   1HD   PRO  65          2HD       PRO  65 -15.184  -7.719  -5.182
  535   2HD   PRO  65          1HD       PRO  65 -14.496  -6.982  -6.645
  536    H    ARG  66           H        ARG  66 -19.884  -6.316  -6.195
  537    HA   ARG  66           HA       ARG  66 -20.625  -5.618  -3.527
  538   1HB   ARG  66          2HB       ARG  66 -21.934  -6.591  -5.810
  539   2HB   ARG  66          1HB       ARG  66 -22.192  -7.829  -4.580
  540   1HG   ARG  66          2HG       ARG  66 -23.683  -6.525  -3.516
  541   2HG   ARG  66          1HG       ARG  66 -22.504  -5.219  -3.398
  542   1HD   ARG  66          2HD       ARG  66 -24.064  -4.164  -4.727
  543   2HD   ARG  66          1HD       ARG  66 -23.119  -4.953  -5.991
  544    HE   ARG  66           HE       ARG  66 -24.874  -6.627  -6.191
  545   1HH1  ARG  66          1HH2      ARG  66 -26.550  -4.257  -6.526
  546   2HH1  ARG  66          2HH2      ARG  66 -27.779  -4.457  -5.321
  547   1HH2  ARG  66          1HH1      ARG  66 -25.996  -6.820  -3.517
  548   2HH2  ARG  66          2HH1      ARG  66 -27.464  -5.908  -3.617
  549    H    SER  67           H        SER  67 -19.000  -6.536  -2.145
  550    HA   SER  67           HA       SER  67 -19.508  -9.387  -1.517
  551   1HB   SER  67          2HB       SER  67 -16.647  -8.559  -1.518
  552   2HB   SER  67          1HB       SER  67 -17.360 -10.132  -1.860
  553    HG   SER  67           HG       SER  67 -16.444  -8.649  -3.642
  554    H    GLN  68           H        GLN  68 -20.586  -8.095   0.257
  555    HA   GLN  68           HA       GLN  68 -18.654  -6.969   2.220
  556   1HB   GLN  68          2HB       GLN  68 -21.663  -6.946   2.467
  557   2HB   GLN  68          1HB       GLN  68 -20.495  -5.862   3.221
  558   1HG   GLN  68          2HG       GLN  68 -20.850  -4.449   1.499
  559   2HG   GLN  68          1HG       GLN  68 -20.002  -5.612   0.480
  560   1HE2  GLN  68          1HE2      GLN  68 -21.219  -6.110  -1.341
  561   2HE2  GLN  68          2HE2      GLN  68 -22.911  -6.244  -1.380
  562    H    GLU  69           H        GLU  69 -18.044  -9.418   2.419
  563    HA   GLU  69           HA       GLU  69 -19.943 -10.984   4.036
  564   1HB   GLU  69          2HB       GLU  69 -17.231 -11.501   2.842
  565   2HB   GLU  69          1HB       GLU  69 -17.848 -12.557   4.111
  566   1HG   GLU  69          2HG       GLU  69 -19.962 -12.123   2.244
  567   2HG   GLU  69          1HG       GLU  69 -18.519 -12.564   1.331
  568    H    GLU  70           H        GLU  70 -16.939  -9.171   4.472
  569    HA   GLU  70           HA       GLU  70 -16.817  -9.940   7.325
  570   1HB   GLU  70          2HB       GLU  70 -15.069  -7.861   6.018
  571   2HB   GLU  70          1HB       GLU  70 -14.686  -8.946   7.355
  572   1HG   GLU  70          2HG       GLU  70 -14.667 -10.865   5.859
  573   2HG   GLU  70          1HG       GLU  70 -15.197  -9.860   4.511
  574    HA   PRO  71           HA       PRO  71 -18.856  -6.337   8.776
  575   1HB   PRO  71          2HB       PRO  71 -17.491  -5.895  11.122
  576   2HB   PRO  71          1HB       PRO  71 -18.663  -7.206  10.901
  577   1HG   PRO  71          2HG       PRO  71 -15.684  -7.350  11.003
  578   2HG   PRO  71          1HG       PRO  71 -16.883  -8.587  11.417
  579   1HD   PRO  71          2HD       PRO  71 -15.385  -8.475   9.021
  580   2HD   PRO  71          1HD       PRO  71 -16.817  -9.486   9.308
  581    H    GLY  72           H        GLY  72 -18.328  -4.635   7.344
  582   1HA   GLY  72          2HA       GLY  72 -16.332  -2.718   8.330
  583   2HA   GLY  72          1HA       GLY  72 -15.982  -3.391   6.733
  584    H    LYS  73           H        LYS  73 -17.014  -0.652   7.872
  585    HA   LYS  73           HA       LYS  73 -19.254  -0.381   5.905
  586   1HB   LYS  73          2HB       LYS  73 -18.903   0.628   8.675
  587   2HB   LYS  73          1HB       LYS  73 -19.596   1.769   7.521
  588   1HG   LYS  73          2HG       LYS  73 -20.872  -0.699   7.025
  589   2HG   LYS  73          1HG       LYS  73 -20.845  -0.512   8.779
  590   1HD   LYS  73          2HD       LYS  73 -21.684   1.875   8.390
  591   2HD   LYS  73          1HD       LYS  73 -22.004   1.382   6.727
  592   1HE   LYS  73          2HE       LYS  73 -23.168  -0.676   8.047
  593   2HE   LYS  73          1HE       LYS  73 -23.399   0.610   9.233
  594   1HZ   LYS  73          1HZ       LYS  73 -23.963   1.386   6.514
  595   2HZ   LYS  73          2HZ       LYS  73 -24.863   1.653   7.931
  596   3HZ   LYS  73          3HZ       LYS  73 -24.989   0.172   7.106
  597    H    GLY  74           H        GLY  74 -17.553   0.072   4.287
  598   1HA   GLY  74          2HA       GLY  74 -17.133   2.868   3.887
  599   2HA   GLY  74          1HA       GLY  74 -15.645   2.159   4.512
  600    H    SER  75           H        SER  75 -14.310   1.951   2.761
  601    HA   SER  75           HA       SER  75 -15.389   0.460   0.407
  602   1HB   SER  75          2HB       SER  75 -13.315   2.616   0.081
  603   2HB   SER  75          1HB       SER  75 -14.401   1.937  -1.126
  604    HG   SER  75           HG       SER  75 -15.329   3.828  -0.603
  605    H    PHE  76           H        PHE  76 -13.714  -0.742  -0.768
  606    HA   PHE  76           HA       PHE  76 -11.065  -0.974   0.494
  607   1HB   PHE  76          2HB       PHE  76 -13.035  -2.615   1.479
  608   2HB   PHE  76          1HB       PHE  76 -12.352  -3.612   0.194
  609    HD1  PHE  76           HD1      PHE  76  -9.625  -3.367   0.082
  610    HD2  PHE  76           HD2      PHE  76 -12.078  -2.897   3.575
  611    HE1  PHE  76           HE1      PHE  76  -7.673  -3.882   1.522
  612    HE2  PHE  76           HE2      PHE  76 -10.126  -3.411   5.016
  613    HZ   PHE  76           HZ       PHE  76  -7.924  -3.905   3.989
  614    H    TRP  77           H        TRP  77  -9.795  -0.877  -1.294
  615    HA   TRP  77           HA       TRP  77 -10.751  -2.256  -3.758
  616   1HB   TRP  77          2HB       TRP  77  -9.667  -0.635  -5.001
  617   2HB   TRP  77          1HB       TRP  77 -10.004   0.303  -3.551
  618    HD1  TRP  77           HD1      TRP  77  -7.941   0.756  -1.874
  619    HE1  TRP  77           HE1      TRP  77  -5.393   0.731  -2.305
  620    HE3  TRP  77           HE3      TRP  77  -7.856  -1.752  -6.287
  621    HZ2  TRP  77           HZ2      TRP  77  -3.563  -0.244  -4.303
  622    HZ3  TRP  77           HZ3      TRP  77  -5.728  -2.224  -7.433
  623    HH2  TRP  77           HH2      TRP  77  -3.599  -1.465  -6.466
  624    H    ARG  78           H        ARG  78  -8.933  -3.372  -5.056
  625    HA   ARG  78           HA       ARG  78  -6.593  -4.222  -3.487
  626   1HB   ARG  78          2HB       ARG  78  -7.210  -6.624  -3.539
  627   2HB   ARG  78          1HB       ARG  78  -8.352  -5.681  -2.579
  628   1HG   ARG  78          2HG       ARG  78  -9.946  -5.640  -4.391
  629   2HG   ARG  78          1HG       ARG  78  -8.782  -6.370  -5.498
  630   1HD   ARG  78          2HD       ARG  78  -9.298  -8.447  -4.789
  631   2HD   ARG  78          1HD       ARG  78  -9.098  -7.981  -3.099
  632    HE   ARG  78           HE       ARG  78 -11.600  -7.039  -4.287
  633   1HH1  ARG  78          1HH2      ARG  78 -11.496  -7.615  -1.429
  634   2HH1  ARG  78          2HH2      ARG  78 -12.231  -9.178  -1.302
  635   1HH2  ARG  78          1HH1      ARG  78 -11.878  -9.913  -4.672
  636   2HH2  ARG  78          2HH1      ARG  78 -12.447 -10.479  -3.137
  637    H    ILE  79           H        ILE  79  -5.643  -6.305  -4.821
  638    HA   ILE  79           HA       ILE  79  -5.537  -5.385  -7.660
  639    HB   ILE  79           HB       ILE  79  -3.370  -5.319  -6.608
  640   1HG1  ILE  79          2HG1      ILE  79  -2.118  -7.010  -7.944
  641   2HG1  ILE  79          1HG1      ILE  79  -3.647  -7.792  -8.332
  642   1HG2  ILE  79          1HG2      ILE  79  -2.426  -7.593  -5.797
  643   2HG2  ILE  79          2HG2      ILE  79  -4.123  -8.048  -5.640
  644   3HG2  ILE  79          3HG2      ILE  79  -3.487  -6.679  -4.725
  645   1HD1  ILE  79          1HD1      ILE  79  -2.685  -5.053  -9.139
  646   2HD1  ILE  79          2HD1      ILE  79  -4.391  -5.486  -9.179
  647   3HD1  ILE  79          3HD1      ILE  79  -3.244  -6.367 -10.169
  648    H    ASP  80           H        ASP  80  -5.336  -7.144  -9.298
  649    HA   ASP  80           HA       ASP  80  -7.415  -9.056  -9.058
  650   1HB   ASP  80          2HB       ASP  80  -6.027  -8.117 -11.146
  651   2HB   ASP  80          1HB       ASP  80  -5.157  -9.633 -10.910
  652    HA   PRO  81           HA       PRO  81  -5.369 -12.231  -6.791
  653   1HB   PRO  81          2HB       PRO  81  -7.223 -14.208  -7.247
  654   2HB   PRO  81          1HB       PRO  81  -7.474 -12.871  -6.110
  655   1HG   PRO  81          2HG       PRO  81  -8.691 -13.300  -8.792
  656   2HG   PRO  81          1HG       PRO  81  -9.295 -12.348  -7.426
  657   1HD   PRO  81          2HD       PRO  81  -8.004 -11.338  -9.758
  658   2HD   PRO  81          1HD       PRO  81  -8.408 -10.420  -8.290
  659    H    ALA  82           H        ALA  82  -6.479 -12.933 -10.112
  660    HA   ALA  82           HA       ALA  82  -4.598 -15.205 -10.300
  661   1HB   ALA  82          1HB       ALA  82  -5.546 -15.404 -12.630
  662   2HB   ALA  82          2HB       ALA  82  -6.586 -14.027 -12.263
  663   3HB   ALA  82          3HB       ALA  82  -6.753 -15.526 -11.352
  664    H    SER  83           H        SER  83  -4.602 -11.830 -11.028
  665    HA   SER  83           HA       SER  83  -2.387 -12.188 -12.976
  666   1HB   SER  83          2HB       SER  83  -4.357 -10.105 -12.487
  667   2HB   SER  83          1HB       SER  83  -2.725  -9.444 -12.512
  668    HG   SER  83           HG       SER  83  -4.157 -10.820 -14.504
  669    H    GLU  84           H        GLU  84  -2.737 -12.145  -9.716
  670    HA   GLU  84           HA       GLU  84  -0.847 -10.268  -8.789
  671   1HB   GLU  84          2HB       GLU  84  -2.292 -11.523  -7.263
  672   2HB   GLU  84          1HB       GLU  84  -1.494 -13.028  -7.717
  673   1HG   GLU  84          2HG       GLU  84   0.500 -12.452  -6.629
  674   2HG   GLU  84          1HG       GLU  84   0.120 -10.729  -6.639
  675    H    ALA  85           H        ALA  85  -0.297 -13.733  -9.549
  676    HA   ALA  85           HA       ALA  85   2.472 -13.785  -9.137
  677   1HB   ALA  85          1HB       ALA  85   0.571 -15.284 -10.831
  678   2HB   ALA  85          2HB       ALA  85   1.843 -15.884  -9.766
  679   3HB   ALA  85          3HB       ALA  85   2.242 -15.326 -11.391
  680    H    LYS  86           H        LYS  86   0.716 -12.101 -11.623
  681    HA   LYS  86           HA       LYS  86   3.103 -11.747 -13.313
  682   1HB   LYS  86          2HB       LYS  86   0.761 -11.924 -14.249
  683   2HB   LYS  86          1HB       LYS  86   0.427 -10.346 -13.536
  684   1HG   LYS  86          2HG       LYS  86   2.679  -9.696 -14.805
  685   2HG   LYS  86          1HG       LYS  86   2.207 -11.049 -15.832
  686   1HD   LYS  86          2HD       LYS  86   1.192  -9.141 -16.826
  687   2HD   LYS  86          1HD       LYS  86  -0.109  -9.947 -15.947
  688   1HE   LYS  86          2HE       LYS  86   0.137  -8.405 -14.077
  689   2HE   LYS  86          1HE       LYS  86   1.534  -7.650 -14.842
  690   1HZ   LYS  86          1HZ       LYS  86  -0.414  -6.331 -15.240
  691   2HZ   LYS  86          2HZ       LYS  86  -1.251  -7.667 -15.873
  692   3HZ   LYS  86          3HZ       LYS  86   0.085  -7.026 -16.705
  693    H    LEU  87           H        LEU  87   0.885  -9.464 -11.660
  694    HA   LEU  87           HA       LEU  87   2.464  -7.176 -11.900
  695   1HB   LEU  87          2HB       LEU  87   1.406  -6.668  -9.498
  696   2HB   LEU  87          1HB       LEU  87   0.437  -6.636 -10.955
  697    HG   LEU  87           HG       LEU  87   0.601  -9.331  -9.882
  698   1HD1  LEU  87          1HD1      LEU  87  -0.158  -7.080  -8.056
  699   2HD1  LEU  87          2HD1      LEU  87   0.710  -8.570  -7.688
  700   3HD1  LEU  87          3HD1      LEU  87  -1.033  -8.607  -7.954
  701   1HD2  LEU  87          1HD2      LEU  87  -1.091  -8.431 -11.514
  702   2HD2  LEU  87          2HD2      LEU  87  -1.751  -7.450 -10.209
  703   3HD2  LEU  87          3HD2      LEU  87  -1.820  -9.200 -10.106
  704    H    VAL  88           H        VAL  88   2.353  -9.263  -9.043
  705    HA   VAL  88           HA       VAL  88   4.363  -8.242  -7.492
  706    HB   VAL  88           HB       VAL  88   4.859 -10.596  -6.877
  707   1HG1  VAL  88          1HG1      VAL  88   1.917  -9.966  -7.209
  708   2HG1  VAL  88          2HG1      VAL  88   2.934  -9.354  -5.905
  709   3HG1  VAL  88          3HG1      VAL  88   2.608 -11.083  -6.031
  710   1HG2  VAL  88          1HG2      VAL  88   4.667 -12.020  -8.640
  711   2HG2  VAL  88          2HG2      VAL  88   3.501 -10.979  -9.455
  712   3HG2  VAL  88          3HG2      VAL  88   2.965 -12.073  -8.181
  713    H    GLU  89           H        GLU  89   4.792  -9.947 -10.534
  714    HA   GLU  89           HA       GLU  89   7.498 -10.677 -10.369
  715   1HB   GLU  89          2HB       GLU  89   5.864 -11.084 -12.304
  716   2HB   GLU  89          1HB       GLU  89   6.281  -9.461 -12.858
  717   1HG   GLU  89          2HG       GLU  89   8.718 -10.800 -12.246
  718   2HG   GLU  89          1HG       GLU  89   7.748 -11.895 -13.231
  719    H    GLN  90           H        GLN  90   6.171  -7.558 -11.523
  720    HA   GLN  90           HA       GLN  90   8.862  -6.382 -11.530
  721   1HB   GLN  90          2HB       GLN  90   7.520  -4.260 -12.061
  722   2HB   GLN  90          1HB       GLN  90   7.417  -5.565 -13.244
  723   1HG   GLN  90          2HG       GLN  90   5.235  -6.066 -12.713
  724   2HG   GLN  90          1HG       GLN  90   5.419  -5.570 -11.031
  725   1HE2  GLN  90          1HE2      GLN  90   3.701  -4.036 -10.937
  726   2HE2  GLN  90          2HE2      GLN  90   3.664  -2.628 -11.882
  727    H    ALA  91           H        ALA  91   6.519  -7.018  -9.199
  728    HA   ALA  91           HA       ALA  91   6.486  -4.700  -7.596
  729   1HB   ALA  91          1HB       ALA  91   5.036  -6.555  -7.074
  730   2HB   ALA  91          2HB       ALA  91   6.079  -6.260  -5.684
  731   3HB   ALA  91          3HB       ALA  91   6.418  -7.606  -6.772
  732    H    PHE  92           H        PHE  92   8.583  -7.555  -7.024
  733    HA   PHE  92           HA       PHE  92  10.418  -5.837  -5.472
  734   1HB   PHE  92          2HB       PHE  92  11.200  -8.639  -6.041
  735   2HB   PHE  92          1HB       PHE  92  11.194  -7.763  -4.512
  736    HD1  PHE  92           HD1      PHE  92   9.454 -10.124  -6.592
  737    HD2  PHE  92           HD2      PHE  92   8.927  -7.314  -3.386
  738    HE1  PHE  92           HE1      PHE  92   7.319 -11.226  -5.979
  739    HE2  PHE  92           HE2      PHE  92   6.791  -8.416  -2.772
  740    HZ   PHE  92           HZ       PHE  92   5.989 -10.373  -4.069
  741    H    ARG  93           H        ARG  93  10.046  -5.812  -8.549
  742    HA   ARG  93           HA       ARG  93  12.952  -6.141  -9.191
  743   1HB   ARG  93          2HB       ARG  93  11.154  -7.666 -10.345
  744   2HB   ARG  93          1HB       ARG  93  10.806  -6.222 -11.296
  745   1HG   ARG  93          2HG       ARG  93  12.957  -6.167 -12.239
  746   2HG   ARG  93          1HG       ARG  93  13.643  -7.172 -10.961
  747   1HD   ARG  93          2HD       ARG  93  11.470  -8.486 -12.437
  748   2HD   ARG  93          1HD       ARG  93  12.863  -8.089 -13.444
  749    HE   ARG  93           HE       ARG  93  13.027  -9.760 -10.968
  750   1HH1  ARG  93          1HH2      ARG  93  15.624  -8.642 -11.873
  751   2HH1  ARG  93          2HH2      ARG  93  16.209  -9.867 -12.948
  752   1HH2  ARG  93          1HH1      ARG  93  13.121 -11.402 -13.306
  753   2HH2  ARG  93          2HH1      ARG  93  14.792 -11.429 -13.761
  754    H    LYS  94           H        LYS  94  13.859  -4.149  -9.358
  755    HA   LYS  94           HA       LYS  94  12.226  -1.791  -9.944
  756   1HB   LYS  94          2HB       LYS  94  15.227  -2.108  -9.612
  757   2HB   LYS  94          1HB       LYS  94  14.377  -0.568  -9.729
  758   1HG   LYS  94          2HG       LYS  94  12.965  -1.412  -7.736
  759   2HG   LYS  94          1HG       LYS  94  14.228  -2.625  -7.526
  760   1HD   LYS  94          2HD       LYS  94  14.750   0.359  -7.644
  761   2HD   LYS  94          1HD       LYS  94  14.594  -0.559  -6.147
  762   1HE   LYS  94          2HE       LYS  94  16.528  -1.877  -6.643
  763   2HE   LYS  94          1HE       LYS  94  16.580  -1.293  -8.307
  764   1HZ   LYS  94          1HZ       LYS  94  18.116  -0.264  -6.487
  765   2HZ   LYS  94          2HZ       LYS  94  16.736   0.655  -6.119
  766   3HZ   LYS  94          3HZ       LYS  94  17.413   0.721  -7.676
  767    H    ARG  95           H        ARG  95  13.443  -0.206 -11.638
  768    HA   ARG  95           HA       ARG  95  13.355  -1.682 -14.194
  769   1HB   ARG  95          2HB       ARG  95  13.870   1.274 -13.925
  770   2HB   ARG  95          1HB       ARG  95  13.064   0.408 -15.233
  771   1HG   ARG  95          2HG       ARG  95  11.189  -0.134 -13.704
  772   2HG   ARG  95          1HG       ARG  95  11.987   0.780 -12.423
  773   1HD   ARG  95          2HD       ARG  95  11.259   1.984 -15.104
  774   2HD   ARG  95          1HD       ARG  95  10.205   2.064 -13.691
  775    HE   ARG  95           HE       ARG  95  12.983   3.130 -13.507
  776   1HH1  ARG  95          1HH2      ARG  95   9.703   3.840 -14.105
  777   2HH1  ARG  95          2HH2      ARG  95   9.677   5.268 -13.126
  778   1HH2  ARG  95          1HH1      ARG  95  12.904   4.833 -11.935
  779   2HH2  ARG  95          2HH1      ARG  95  11.488   5.830 -11.899
  780    H    ARG  96           H        ARG  96  15.265  -2.638 -14.761
  781    HA   ARG  96           HA       ARG  96  17.797  -1.175 -14.169
  782   1HB   ARG  96          2HB       ARG  96  17.023  -4.012 -14.265
  783   2HB   ARG  96          1HB       ARG  96  18.538  -3.660 -15.100
  784   1HG   ARG  96          2HG       ARG  96  18.201  -2.343 -12.467
  785   2HG   ARG  96          1HG       ARG  96  18.375  -4.099 -12.423
  786   1HD   ARG  96          2HD       ARG  96  20.241  -2.665 -14.227
  787   2HD   ARG  96          1HD       ARG  96  20.489  -2.400 -12.502
  788    HE   ARG  96           HE       ARG  96  20.471  -5.121 -13.751
  789   1HH1  ARG  96          1HH2      ARG  96  20.457  -3.950 -10.712
  790   2HH1  ARG  96          2HH2      ARG  96  22.030  -4.504 -10.248
  791   1HH2  ARG  96          1HH1      ARG  96  22.978  -5.345 -13.477
  792   2HH2  ARG  96          2HH1      ARG  96  23.457  -5.295 -11.814
  793    H    GLN  97           H        GLN  97  15.718  -2.219 -16.729
  794    HA   GLN  97           HA       GLN  97  17.676  -2.227 -18.850
  795   1HB   GLN  97          2HB       GLN  97  15.611  -1.922 -20.313
  796   2HB   GLN  97          1HB       GLN  97  15.593  -3.337 -19.260
  797   1HG   GLN  97          2HG       GLN  97  14.516  -0.898 -18.007
  798   2HG   GLN  97          1HG       GLN  97  13.582  -1.468 -19.391
  799   1HE2  GLN  97          1HE2      GLN  97  12.426  -1.651 -16.833
  800   2HE2  GLN  97          2HE2      GLN  97  12.349  -3.280 -16.362
  801    H    ARG  98           H        ARG  98  18.645  -0.495 -19.788
  802    HA   ARG  98           HA       ARG  98  18.018   2.202 -18.922
  803   1HB   ARG  98          2HB       ARG  98  19.903   1.021 -20.958
  804   2HB   ARG  98          1HB       ARG  98  19.669   2.765 -20.851
  805   1HG   ARG  98          2HG       ARG  98  21.428   2.499 -19.365
  806   2HG   ARG  98          1HG       ARG  98  20.058   2.328 -18.266
  807   1HD   ARG  98          2HD       ARG  98  20.448  -0.241 -19.313
  808   2HD   ARG  98          1HD       ARG  98  22.075   0.366 -19.001
  809    HE   ARG  98           HE       ARG  98  20.376   0.920 -16.749
  810   1HH1  ARG  98          1HH1      ARG  98  20.469  -2.048 -18.134
  811   2HH1  ARG  98          2HH1      ARG  98  21.344  -2.848 -16.872
  812   1HH2  ARG  98          1HH2      ARG  98  22.179   0.089 -15.227
  813   2HH2  ARG  98          2HH2      ARG  98  22.315  -1.638 -15.226
  814    H    GLY  99           H        GLY  99  16.283   3.305 -19.677
  815   1HA   GLY  99          2HA       GLY  99  14.772   2.519 -21.979
  816   2HA   GLY  99          1HA       GLY  99  14.603   4.056 -21.133
  817    H    VAL 100           H        VAL 100  14.844   3.238 -24.101
  818    HA   VAL 100           HA       VAL 100  16.710   5.436 -24.796
  819    HB   VAL 100           HB       VAL 100  16.856   2.933 -26.437
  820   1HG1  VAL 100          1HG1      VAL 100  17.945   5.266 -26.888
  821   2HG1  VAL 100          2HG1      VAL 100  18.925   3.816 -27.109
  822   3HG1  VAL 100          3HG1      VAL 100  19.096   4.781 -25.644
  823   1HG2  VAL 100          1HG2      VAL 100  18.755   2.169 -24.990
  824   2HG2  VAL 100          2HG2      VAL 100  17.194   2.093 -24.172
  825   3HG2  VAL 100          3HG2      VAL 100  18.313   3.410 -23.818
  826    H    SER 101           HN       SER 101  16.325   6.228 -27.014
  827    HA   SER 101           HA       SER 101  13.482   6.065 -27.706
  828   1HB   SER 101          2HB       SER 101  14.503   7.562 -29.688
  829   2HB   SER 101          1HB       SER 101  14.179   8.224 -28.088
  830    HG   SER 101           HG       SER 101  16.559   7.736 -29.364
  Start of MODEL   11
    1   1H    GLU   1          1HT       GLU   1  15.874  13.098  -0.382
    2   2H    GLU   1          2HT       GLU   1  14.830  11.776  -0.596
    3   3H    GLU   1          3HT       GLU   1  14.791  13.078  -1.686
    4    HA   GLU   1           HA       GLU   1  17.212  12.521  -2.175
    5   1HB   GLU   1          2HB       GLU   1  16.316  10.293  -0.419
    6   2HB   GLU   1          1HB       GLU   1  17.269   9.843  -1.835
    7   1HG   GLU   1          2HG       GLU   1  18.276  12.169  -0.296
    8   2HG   GLU   1          1HG       GLU   1  18.380  10.609   0.520
    9    H    SER   2           H        SER   2  14.727   9.938  -2.227
   10    HA   SER   2           HA       SER   2  14.527  10.383  -5.177
   11   1HB   SER   2          2HB       SER   2  13.865   7.694  -4.656
   12   2HB   SER   2          1HB       SER   2  15.311   8.294  -5.467
   13    HG   SER   2           HG       SER   2  15.383   6.965  -3.349
   14    H    LYS   3           H        LYS   3  12.448  10.975  -5.700
   15    HA   LYS   3           HA       LYS   3  10.318  10.570  -3.756
   16   1HB   LYS   3          2HB       LYS   3  10.752  12.263  -6.048
   17   2HB   LYS   3          1HB       LYS   3   9.161  11.515  -6.122
   18   1HG   LYS   3          2HG       LYS   3   8.919  12.214  -3.652
   19   2HG   LYS   3          1HG       LYS   3  10.303  13.267  -3.947
   20   1HD   LYS   3          2HD       LYS   3   8.455  14.657  -4.411
   21   2HD   LYS   3          1HD       LYS   3   8.960  14.099  -6.007
   22   1HE   LYS   3          2HE       LYS   3   7.275  12.221  -5.774
   23   2HE   LYS   3          1HE       LYS   3   6.676  13.034  -4.329
   24   1HZ   LYS   3          1HZ       LYS   3   5.407  13.659  -6.288
   25   2HZ   LYS   3          2HZ       LYS   3   6.818  14.223  -7.047
   26   3HZ   LYS   3          3HZ       LYS   3   6.230  14.999  -5.655
   27    HA   PRO   4           HA       PRO   4   8.709   7.614  -7.139
   28   1HB   PRO   4          2HB       PRO   4  10.196   7.358  -9.410
   29   2HB   PRO   4          1HB       PRO   4   9.019   8.663  -9.172
   30   1HG   PRO   4          2HG       PRO   4  11.995   8.797  -9.140
   31   2HG   PRO   4          1HG       PRO   4  10.818  10.079  -9.471
   32   1HD   PRO   4          2HD       PRO   4  12.220   9.641  -6.996
   33   2HD   PRO   4          1HD       PRO   4  10.931  10.815  -7.321
   34    HA   PRO   5           HA       PRO   5  12.327   4.694  -6.110
   35   1HB   PRO   5          2HB       PRO   5  11.126   3.358  -4.030
   36   2HB   PRO   5          1HB       PRO   5  12.162   4.777  -3.801
   37   1HG   PRO   5          2HG       PRO   5   9.172   4.590  -3.707
   38   2HG   PRO   5          1HG       PRO   5  10.259   5.652  -2.794
   39   1HD   PRO   5          2HD       PRO   5   8.789   6.477  -5.009
   40   2HD   PRO   5          1HD       PRO   5  10.282   7.250  -4.431
   41    H    TYR   6           H        TYR   6   8.905   3.867  -5.492
   42    HA   TYR   6           HA       TYR   6   9.188   1.518  -7.309
   43   1HB   TYR   6          2HB       TYR   6   7.178   2.192  -5.146
   44   2HB   TYR   6          1HB       TYR   6   6.995   0.825  -6.246
   45    HD1  TYR   6           HD1      TYR   6   9.676  -0.211  -6.556
   46    HD2  TYR   6           HD2      TYR   6   7.763   1.341  -3.041
   47    HE1  TYR   6           HE1      TYR   6  11.184  -1.573  -5.139
   48    HE2  TYR   6           HE2      TYR   6   9.268  -0.022  -1.623
   49    HH   TYR   6           HH       TYR   6  12.063  -1.497  -2.797
   50    H    SER   7           H        SER   7   8.108   1.558  -9.257
   51    HA   SER   7           HA       SER   7   6.989   3.901 -10.325
   52   1HB   SER   7          2HB       SER   7   6.817   1.015 -11.006
   53   2HB   SER   7          1HB       SER   7   5.508   2.016 -11.627
   54    HG   SER   7           HG       SER   7   7.756   1.754 -12.752
   55    H    TYR   8           H        TYR   8   4.612   4.349 -10.756
   56    HA   TYR   8           HA       TYR   8   3.138   3.877  -8.250
   57   1HB   TYR   8          2HB       TYR   8   2.528   5.595 -10.669
   58   2HB   TYR   8          1HB       TYR   8   1.477   5.465  -9.258
   59    HD1  TYR   8           HD1      TYR   8   3.465   5.248  -7.068
   60    HD2  TYR   8           HD2      TYR   8   3.393   7.801 -10.522
   61    HE1  TYR   8           HE1      TYR   8   4.858   6.907  -5.869
   62    HE2  TYR   8           HE2      TYR   8   4.786   9.463  -9.320
   63    HH   TYR   8           HH       TYR   8   5.100   9.808  -6.369
   64    H    ALA   9           H        ALA   9   3.472   1.558  -9.469
   65    HA   ALA   9           HA       ALA   9   0.740   0.694 -10.056
   66   1HB   ALA   9          1HB       ALA   9   0.987   0.113 -12.252
   67   2HB   ALA   9          2HB       ALA   9   2.673  -0.356 -12.034
   68   3HB   ALA   9          3HB       ALA   9   2.250   1.344 -12.245
   69    H    GLN  10           H        GLN  10   4.188  -0.065  -9.833
   70    HA   GLN  10           HA       GLN  10   3.637  -2.806  -8.887
   71   1HB   GLN  10          2HB       GLN  10   6.066  -3.048  -8.815
   72   2HB   GLN  10          1HB       GLN  10   5.640  -2.288 -10.345
   73   1HG   GLN  10          2HG       GLN  10   6.412  -0.184  -9.659
   74   2HG   GLN  10          1HG       GLN  10   6.310  -0.596  -7.950
   75   1HE2  GLN  10          1HE2      GLN  10   8.114  -1.637  -6.972
   76   2HE2  GLN  10          2HE2      GLN  10   9.548  -1.989  -7.810
   77    H    LEU  11           H        LEU  11   4.425   0.389  -7.787
   78    HA   LEU  11           HA       LEU  11   5.257  -0.105  -5.122
   79   1HB   LEU  11          2HB       LEU  11   5.355   2.134  -6.020
   80   2HB   LEU  11          1HB       LEU  11   3.631   2.126  -6.383
   81    HG   LEU  11           HG       LEU  11   3.471   1.671  -3.750
   82   1HD1  LEU  11          1HD1      LEU  11   5.201   2.992  -2.591
   83   2HD1  LEU  11          2HD1      LEU  11   6.023   3.258  -4.129
   84   3HD1  LEU  11          3HD1      LEU  11   5.916   1.631  -3.457
   85   1HD2  LEU  11          1HD2      LEU  11   2.548   3.743  -3.767
   86   2HD2  LEU  11          2HD2      LEU  11   2.995   3.782  -5.473
   87   3HD2  LEU  11          3HD2      LEU  11   4.061   4.500  -4.266
   88    H    ILE  12           H        ILE  12   2.177  -0.183  -6.718
   89    HA   ILE  12           HA       ILE  12   0.543  -0.429  -4.295
   90    HB   ILE  12           HB       ILE  12  -0.287  -1.477  -6.949
   91   1HG1  ILE  12          2HG1      ILE  12   0.696   0.554  -7.704
   92   2HG1  ILE  12          1HG1      ILE  12  -1.015   0.925  -7.507
   93   1HG2  ILE  12          1HG2      ILE  12  -1.927  -1.692  -5.293
   94   2HG2  ILE  12          2HG2      ILE  12  -2.402  -0.232  -6.161
   95   3HG2  ILE  12          3HG2      ILE  12  -1.570  -0.107  -4.609
   96   1HD1  ILE  12          1HD1      ILE  12   0.967   1.407  -5.286
   97   2HD1  ILE  12          2HD1      ILE  12  -0.639   2.100  -5.492
   98   3HD1  ILE  12          3HD1      ILE  12   0.680   2.608  -6.542
   99    H    VAL  13           H        VAL  13   1.559  -2.648  -6.881
  100    HA   VAL  13           HA       VAL  13   0.461  -5.028  -5.978
  101    HB   VAL  13           HB       VAL  13   3.252  -4.685  -7.104
  102   1HG1  VAL  13          1HG1      VAL  13   1.364  -6.990  -6.769
  103   2HG1  VAL  13          2HG1      VAL  13   3.104  -6.923  -6.496
  104   3HG1  VAL  13          3HG1      VAL  13   2.470  -6.967  -8.141
  105   1HG2  VAL  13          1HG2      VAL  13   2.146  -4.950  -9.300
  106   2HG2  VAL  13          2HG2      VAL  13   1.556  -3.517  -8.465
  107   3HG2  VAL  13          3HG2      VAL  13   0.574  -4.979  -8.502
  108    H    GLN  14           H        GLN  14   3.818  -3.989  -5.170
  109    HA   GLN  14           HA       GLN  14   4.254  -6.015  -3.243
  110   1HB   GLN  14          2HB       GLN  14   6.102  -4.648  -4.003
  111   2HB   GLN  14          1HB       GLN  14   5.332  -3.186  -3.386
  112   1HG   GLN  14          2HG       GLN  14   5.435  -4.198  -1.081
  113   2HG   GLN  14          1HG       GLN  14   6.397  -5.510  -1.762
  114   1HE2  GLN  14          1HE2      GLN  14   7.336  -3.006  -3.650
  115   2HE2  GLN  14          2HE2      GLN  14   8.616  -2.390  -2.729
  116    H    ALA  15           H        ALA  15   2.394  -3.103  -3.120
  117    HA   ALA  15           HA       ALA  15   2.198  -2.836  -0.261
  118   1HB   ALA  15          1HB       ALA  15  -0.074  -1.974  -1.979
  119   2HB   ALA  15          2HB       ALA  15   1.499  -1.267  -2.346
  120   3HB   ALA  15          3HB       ALA  15   0.799  -1.076  -0.738
  121    H    ILE  16           H        ILE  16  -0.180  -4.046  -2.619
  122    HA   ILE  16           HA       ILE  16  -1.742  -5.285  -0.471
  123    HB   ILE  16           HB       ILE  16  -2.897  -6.091  -2.875
  124   1HG1  ILE  16          2HG1      ILE  16  -1.708  -3.311  -3.142
  125   2HG1  ILE  16          1HG1      ILE  16  -1.522  -4.657  -4.270
  126   1HG2  ILE  16          1HG2      ILE  16  -4.606  -4.497  -2.275
  127   2HG2  ILE  16          2HG2      ILE  16  -3.447  -3.534  -1.364
  128   3HG2  ILE  16          3HG2      ILE  16  -3.919  -5.127  -0.777
  129   1HD1  ILE  16          1HD1      ILE  16  -4.189  -4.518  -4.261
  130   2HD1  ILE  16          2HD1      ILE  16  -3.198  -3.533  -5.335
  131   3HD1  ILE  16          3HD1      ILE  16  -3.838  -2.840  -3.847
  132    H    SER  17           H        SER  17  -0.208  -6.451  -3.475
  133    HA   SER  17           HA       SER  17  -0.643  -9.209  -3.010
  134   1HB   SER  17          2HB       SER  17   0.350  -7.921  -5.091
  135   2HB   SER  17          1HB       SER  17   1.892  -8.289  -4.324
  136    HG   SER  17           HG       SER  17  -0.096 -10.024  -5.311
  137    H    SER  18           H        SER  18   2.134  -7.168  -2.040
  138    HA   SER  18           HA       SER  18   3.493  -9.420  -0.780
  139   1HB   SER  18          2HB       SER  18   5.251  -8.007  -0.732
  140   2HB   SER  18          1HB       SER  18   4.241  -6.858  -1.593
  141    HG   SER  18           HG       SER  18   5.207  -6.159   0.475
  142    H    ALA  19           H        ALA  19   0.777  -7.732   0.130
  143    HA   ALA  19           HA       ALA  19   1.456  -7.851   3.030
  144   1HB   ALA  19          1HB       ALA  19  -0.439  -6.282   1.382
  145   2HB   ALA  19          2HB       ALA  19   0.388  -5.840   2.876
  146   3HB   ALA  19          3HB       ALA  19  -1.071  -6.829   2.936
  147    H    GLN  20           H        GLN  20   0.083  -9.066   4.464
  148    HA   GLN  20           HA       GLN  20  -0.668 -11.624   3.728
  149   1HB   GLN  20          2HB       GLN  20  -0.704 -10.595   6.073
  150   2HB   GLN  20          1HB       GLN  20  -2.316  -9.998   5.679
  151   1HG   GLN  20          2HG       GLN  20  -3.233 -12.027   6.024
  152   2HG   GLN  20          1HG       GLN  20  -2.045 -12.802   4.976
  153   1HE2  GLN  20          1HE2      GLN  20   0.040 -13.457   5.990
  154   2HE2  GLN  20          2HE2      GLN  20   0.120 -13.720   7.665
  155    H    ASP  21           H        ASP  21  -2.834  -8.787   3.804
  156    HA   ASP  21           HA       ASP  21  -4.844 -10.282   2.235
  157   1HB   ASP  21          2HB       ASP  21  -4.948  -7.409   3.195
  158   2HB   ASP  21          1HB       ASP  21  -6.303  -8.407   2.662
  159    H    ARG  22           H        ARG  22  -4.843 -10.134   0.014
  160    HA   ARG  22           HA       ARG  22  -2.988  -8.410  -1.381
  161   1HB   ARG  22          2HB       ARG  22  -5.342  -9.781  -2.676
  162   2HB   ARG  22          1HB       ARG  22  -3.744  -9.462  -3.351
  163   1HG   ARG  22          2HG       ARG  22  -3.005 -11.458  -2.623
  164   2HG   ARG  22          1HG       ARG  22  -3.451 -11.043  -0.968
  165   1HD   ARG  22          2HD       ARG  22  -5.897 -11.591  -1.854
  166   2HD   ARG  22          1HD       ARG  22  -5.004 -12.559  -3.028
  167    HE   ARG  22           HE       ARG  22  -4.075 -13.063  -0.335
  168   1HH1  ARG  22          1HH1      ARG  22  -6.886 -13.448  -2.261
  169   2HH1  ARG  22          2HH1      ARG  22  -7.192 -15.072  -1.744
  170   1HH2  ARG  22          1HH2      ARG  22  -4.322 -15.275   0.194
  171   2HH2  ARG  22          2HH2      ARG  22  -5.739 -16.107  -0.353
  172    H    GLN  23           H        GLN  23  -5.803  -7.627   0.143
  173    HA   GLN  23           HA       GLN  23  -6.519  -5.559  -1.890
  174   1HB   GLN  23          2HB       GLN  23  -8.688  -5.418  -0.621
  175   2HB   GLN  23          1HB       GLN  23  -8.411  -6.991  -1.372
  176   1HG   GLN  23          2HG       GLN  23  -7.759  -7.978   0.700
  177   2HG   GLN  23          1HG       GLN  23  -7.629  -6.406   1.490
  178   1HE2  GLN  23          1HE2      GLN  23  -9.295  -6.484   3.044
  179   2HE2  GLN  23          2HE2      GLN  23 -10.919  -6.818   2.682
  180    H    LEU  24           H        LEU  24  -6.567  -3.392  -1.225
  181    HA   LEU  24           HA       LEU  24  -5.824  -2.816   1.600
  182   1HB   LEU  24          2HB       LEU  24  -4.372  -2.023  -0.911
  183   2HB   LEU  24          1HB       LEU  24  -4.376  -0.934   0.466
  184    HG   LEU  24           HG       LEU  24  -3.503  -3.834   0.570
  185   1HD1  LEU  24          1HD1      LEU  24  -1.712  -2.886  -0.523
  186   2HD1  LEU  24          2HD1      LEU  24  -1.280  -2.429   1.125
  187   3HD1  LEU  24          3HD1      LEU  24  -2.076  -1.264   0.066
  188   1HD2  LEU  24          1HD2      LEU  24  -2.469  -2.481   2.751
  189   2HD2  LEU  24          2HD2      LEU  24  -3.900  -3.511   2.783
  190   3HD2  LEU  24          3HD2      LEU  24  -4.074  -1.768   2.583
  191    H    THR  25           H        THR  25  -6.462  -0.661   2.261
  192    HA   THR  25           HA       THR  25  -8.802   0.330   0.800
  193    HB   THR  25           HB       THR  25  -8.935   1.995   2.626
  194    HG1  THR  25           HG1      THR  25  -6.493   0.800   3.435
  195   1HG2  THR  25          1HG2      THR  25  -9.829  -0.298   2.975
  196   2HG2  THR  25          2HG2      THR  25  -9.269   0.436   4.478
  197   3HG2  THR  25          3HG2      THR  25  -8.278  -0.776   3.664
  198    H    LEU  26           H        LEU  26  -8.787   2.850   0.374
  199    HA   LEU  26           HA       LEU  26  -6.747   3.361  -1.540
  200   1HB   LEU  26          2HB       LEU  26  -8.978   4.878  -0.416
  201   2HB   LEU  26          1HB       LEU  26  -7.577   5.898  -0.736
  202    HG   LEU  26           HG       LEU  26  -8.840   3.984  -2.721
  203   1HD1  LEU  26          1HD1      LEU  26 -10.015   6.226  -2.044
  204   2HD1  LEU  26          2HD1      LEU  26  -9.816   5.848  -3.755
  205   3HD1  LEU  26          3HD1      LEU  26  -8.717   6.982  -2.968
  206   1HD2  LEU  26          1HD2      LEU  26  -7.092   4.411  -4.125
  207   2HD2  LEU  26          2HD2      LEU  26  -6.228   4.777  -2.631
  208   3HD2  LEU  26          3HD2      LEU  26  -6.938   6.081  -3.581
  209    H    SER  27           H        SER  27  -6.986   4.295   1.879
  210    HA   SER  27           HA       SER  27  -4.278   5.508   1.700
  211   1HB   SER  27          2HB       SER  27  -6.466   5.589   3.767
  212   2HB   SER  27          1HB       SER  27  -4.827   6.103   4.152
  213    HG   SER  27           HG       SER  27  -5.617   7.923   3.367
  214    H    GLY  28           H        GLY  28  -4.738   2.567   1.582
  215   1HA   GLY  28          2HA       GLY  28  -3.514   1.715   4.170
  216   2HA   GLY  28          1HA       GLY  28  -4.280   0.627   3.010
  217    H    ILE  29           H        ILE  29  -3.162   1.473   0.686
  218    HA   ILE  29           HA       ILE  29  -0.744   0.086   0.479
  219    HB   ILE  29           HB       ILE  29  -2.215   0.703  -1.379
  220   1HG1  ILE  29          2HG1      ILE  29   0.700   1.161  -1.319
  221   2HG1  ILE  29          1HG1      ILE  29  -0.246   0.127  -2.387
  222   1HG2  ILE  29          1HG2      ILE  29  -1.063   3.446  -1.397
  223   2HG2  ILE  29          2HG2      ILE  29  -2.417   3.111  -0.323
  224   3HG2  ILE  29          3HG2      ILE  29  -2.589   2.877  -2.061
  225   1HD1  ILE  29          1HD1      ILE  29  -0.932   2.060  -3.703
  226   2HD1  ILE  29          2HD1      ILE  29   0.827   2.009  -3.599
  227   3HD1  ILE  29          3HD1      ILE  29  -0.081   3.141  -2.603
  228    H    TYR  30           H        TYR  30  -1.345   3.480   1.105
  229    HA   TYR  30           HA       TYR  30   1.360   4.373   0.795
  230   1HB   TYR  30          2HB       TYR  30  -0.676   5.597   2.664
  231   2HB   TYR  30          1HB       TYR  30   0.624   6.408   1.792
  232    HD1  TYR  30           HD1      TYR  30   0.421   5.168  -0.869
  233    HD2  TYR  30           HD2      TYR  30  -2.666   6.533   1.772
  234    HE1  TYR  30           HE1      TYR  30  -1.090   5.472  -2.804
  235    HE2  TYR  30           HE2      TYR  30  -4.183   6.839  -0.164
  236    HH   TYR  30           HH       TYR  30  -4.482   6.334  -2.364
  237    H    ALA  31           H        ALA  31  -0.494   3.449   3.692
  238    HA   ALA  31           HA       ALA  31   1.749   3.754   5.481
  239   1HB   ALA  31          1HB       ALA  31   0.359   2.814   7.139
  240   2HB   ALA  31          2HB       ALA  31  -0.542   1.853   5.964
  241   3HB   ALA  31          3HB       ALA  31  -0.783   3.599   6.048
  242    H    HIS  32           H        HIS  32   0.923   1.381   3.141
  243    HA   HIS  32           HA       HIS  32   2.263  -0.862   4.432
  244   1HB   HIS  32          2HB       HIS  32   0.490  -1.234   2.776
  245   2HB   HIS  32          1HB       HIS  32   1.447  -0.416   1.542
  246    HD1  HIS  32           HD1      HIS  32   0.645  -3.699   2.515
  247    HD2  HIS  32           HD2      HIS  32   4.249  -1.841   1.542
  248    HE1  HIS  32           HE1      HIS  32   2.266  -5.550   1.913
  249    H    ILE  33           H        ILE  33   3.077   0.920   1.431
  250    HA   ILE  33           HA       ILE  33   5.764  -0.009   1.257
  251    HB   ILE  33           HB       ILE  33   6.124   1.952  -0.208
  252   1HG1  ILE  33          2HG1      ILE  33   3.711   3.183  -0.490
  253   2HG1  ILE  33          1HG1      ILE  33   3.720   2.865   1.245
  254   1HG2  ILE  33          1HG2      ILE  33   5.109   0.071  -1.272
  255   2HG2  ILE  33          2HG2      ILE  33   4.151   1.467  -1.767
  256   3HG2  ILE  33          3HG2      ILE  33   3.553   0.389  -0.505
  257   1HD1  ILE  33          1HD1      ILE  33   5.853   4.325  -0.337
  258   2HD1  ILE  33          2HD1      ILE  33   6.013   3.880   1.360
  259   3HD1  ILE  33          3HD1      ILE  33   4.771   5.024   0.865
  260    H    THR  34           H        THR  34   4.368   2.713   2.994
  261    HA   THR  34           HA       THR  34   6.721   4.147   3.598
  262    HB   THR  34           HB       THR  34   5.350   4.615   5.832
  263    HG1  THR  34           HG1      THR  34   3.849   3.028   5.660
  264   1HG2  THR  34          1HG2      THR  34   3.886   6.169   4.436
  265   2HG2  THR  34          2HG2      THR  34   4.635   5.440   3.016
  266   3HG2  THR  34          3HG2      THR  34   5.625   6.315   4.183
  267    H    LYS  35           H        LYS  35   5.594   1.094   4.858
  268    HA   LYS  35           HA       LYS  35   7.012   1.020   7.317
  269   1HB   LYS  35          2HB       LYS  35   5.392  -0.725   6.602
  270   2HB   LYS  35          1HB       LYS  35   6.546  -1.274   5.385
  271   1HG   LYS  35          2HG       LYS  35   7.093  -2.714   7.111
  272   2HG   LYS  35          1HG       LYS  35   8.176  -1.374   7.488
  273   1HD   LYS  35          2HD       LYS  35   6.360  -0.441   8.978
  274   2HD   LYS  35          1HD       LYS  35   5.473  -1.946   8.730
  275   1HE   LYS  35          2HE       LYS  35   7.410  -3.217   9.617
  276   2HE   LYS  35          1HE       LYS  35   8.258  -1.699   9.908
  277   1HZ   LYS  35          1HZ       LYS  35   6.081  -2.913  11.379
  278   2HZ   LYS  35          2HZ       LYS  35   5.919  -1.243  11.119
  279   3HZ   LYS  35          3HZ       LYS  35   7.293  -1.853  11.912
  280    H    HIS  36           H        HIS  36   8.068   0.178   4.020
  281    HA   HIS  36           HA       HIS  36  10.855  -0.080   5.044
  282   1HB   HIS  36          2HB       HIS  36   9.935  -0.709   2.239
  283   2HB   HIS  36          1HB       HIS  36  11.351  -1.324   3.092
  284    HD1  HIS  36           HD1      HIS  36  11.060  -3.415   4.476
  285    HD2  HIS  36           HD2      HIS  36   7.410  -1.810   3.261
  286    HE1  HIS  36           HE1      HIS  36   9.285  -5.101   5.123
  287    H    TYR  37           H        TYR  37   8.841   2.220   3.709
  288    HA   TYR  37           HA       TYR  37  11.188   3.702   2.622
  289   1HB   TYR  37          2HB       TYR  37   8.443   3.317   1.423
  290   2HB   TYR  37          1HB       TYR  37   9.407   4.744   1.029
  291    HD1  TYR  37           HD1      TYR  37  10.817   4.590  -0.821
  292    HD2  TYR  37           HD2      TYR  37   9.828   1.037   1.375
  293    HE1  TYR  37           HE1      TYR  37  12.120   3.229  -2.432
  294    HE2  TYR  37           HE2      TYR  37  11.129  -0.325  -0.232
  295    HH   TYR  37           HH       TYR  37  13.303   1.015  -2.434
  296    HA   PRO  38           HA       PRO  38   9.263   6.171   5.921
  297   1HB   PRO  38          2HB       PRO  38  11.649   7.284   6.720
  298   2HB   PRO  38          1HB       PRO  38  11.040   5.729   7.315
  299   1HG   PRO  38          2HG       PRO  38  13.219   6.265   5.346
  300   2HG   PRO  38          1HG       PRO  38  13.005   4.885   6.435
  301   1HD   PRO  38          2HD       PRO  38  12.431   4.893   3.675
  302   2HD   PRO  38          1HD       PRO  38  11.870   3.679   4.844
  303    H    TYR  39           H        TYR  39  11.361   6.994   3.247
  304    HA   TYR  39           HA       TYR  39  11.146   9.859   3.477
  305   1HB   TYR  39          2HB       TYR  39  12.868   8.873   2.062
  306   2HB   TYR  39          1HB       TYR  39  11.645   8.079   1.070
  307    HD1  TYR  39           HD1      TYR  39  11.728  11.540   2.482
  308    HD2  TYR  39           HD2      TYR  39  11.766   9.098  -1.051
  309    HE1  TYR  39           HE1      TYR  39  11.544  13.574   1.076
  310    HE2  TYR  39           HE2      TYR  39  11.583  11.132  -2.459
  311    HH   TYR  39           HH       TYR  39  10.800  14.198  -1.159
  312    H    TYR  40           H        TYR  40   8.998   7.364   2.447
  313    HA   TYR  40           HA       TYR  40   7.263   9.230   0.956
  314   1HB   TYR  40          2HB       TYR  40   7.579   6.332   1.146
  315   2HB   TYR  40          1HB       TYR  40   5.887   6.824   1.251
  316    HD1  TYR  40           HD1      TYR  40   5.270   5.970  -0.955
  317    HD2  TYR  40           HD2      TYR  40   8.436   8.831  -0.476
  318    HE1  TYR  40           HE1      TYR  40   5.236   6.422  -3.397
  319    HE2  TYR  40           HE2      TYR  40   8.401   9.287  -2.911
  320    HH   TYR  40           HH       TYR  40   6.862   9.083  -4.795
  321    H    ARG  41           H        ARG  41   7.425  10.204   3.438
  322    HA   ARG  41           HA       ARG  41   4.729   9.616   4.535
  323   1HB   ARG  41          2HB       ARG  41   7.235   8.939   5.818
  324   2HB   ARG  41          1HB       ARG  41   6.346  10.120   6.784
  325   1HG   ARG  41          2HG       ARG  41   4.285   8.601   6.353
  326   2HG   ARG  41          1HG       ARG  41   5.468   7.376   5.895
  327   1HD   ARG  41          2HD       ARG  41   6.416   7.308   8.046
  328   2HD   ARG  41          1HD       ARG  41   5.748   8.878   8.490
  329    HE   ARG  41           HE       ARG  41   3.994   7.590   9.391
  330   1HH1  ARG  41          1HH2      ARG  41   5.219   4.973   8.407
  331   2HH1  ARG  41          2HH2      ARG  41   3.934   4.353   7.426
  332   1HH2  ARG  41          1HH1      ARG  41   2.254   7.380   7.243
  333   2HH2  ARG  41          2HH1      ARG  41   2.256   5.714   6.767
  334    H    THR  42           H        THR  42   7.556  11.752   4.423
  335    HA   THR  42           HA       THR  42   5.712  14.029   5.014
  336    HB   THR  42           HB       THR  42   7.828  15.140   5.974
  337    HG1  THR  42           HG1      THR  42   9.066  13.120   6.876
  338   1HG2  THR  42          1HG2      THR  42   5.933  14.317   7.347
  339   2HG2  THR  42          2HG2      THR  42   7.480  14.106   8.166
  340   3HG2  THR  42          3HG2      THR  42   6.688  12.725   7.407
  341    H    ALA  43           H        ALA  43   6.120  13.193   2.408
  342    HA   ALA  43           HA       ALA  43   8.136  15.127   1.345
  343   1HB   ALA  43          1HB       ALA  43   7.828  13.756  -0.799
  344   2HB   ALA  43          2HB       ALA  43   6.951  12.594   0.196
  345   3HB   ALA  43          3HB       ALA  43   8.647  12.943   0.535
  346    H    ASP  44           H        ASP  44   5.462  13.724  -0.461
  347    HA   ASP  44           HA       ASP  44   3.904  16.222  -0.315
  348   1HB   ASP  44          2HB       ASP  44   4.871  15.240  -3.010
  349   2HB   ASP  44          1HB       ASP  44   4.036  16.750  -2.644
  350    H    LYS  45           H        LYS  45   1.803  15.967  -1.477
  351    HA   LYS  45           HA       LYS  45   0.875  13.177  -1.234
  352   1HB   LYS  45          2HB       LYS  45  -0.558  15.809  -1.669
  353   2HB   LYS  45          1HB       LYS  45  -1.387  14.251  -1.663
  354   1HG   LYS  45          2HG       LYS  45  -0.866  13.844   0.602
  355   2HG   LYS  45          1HG       LYS  45   0.416  15.055   0.617
  356   1HD   LYS  45          2HD       LYS  45  -1.049  16.806   0.876
  357   2HD   LYS  45          1HD       LYS  45  -2.329  16.009  -0.039
  358   1HE   LYS  45          2HE       LYS  45  -2.374  14.343   1.985
  359   2HE   LYS  45          1HE       LYS  45  -1.565  15.652   2.848
  360   1HZ   LYS  45          1HZ       LYS  45  -3.359  17.073   2.532
  361   2HZ   LYS  45          2HZ       LYS  45  -4.097  15.586   2.894
  362   3HZ   LYS  45          3HZ       LYS  45  -4.026  16.133   1.286
  363    H    GLY  46           H        GLY  46   2.638  13.651  -3.425
  364   1HA   GLY  46          2HA       GLY  46   1.088  14.033  -5.861
  365   2HA   GLY  46          1HA       GLY  46   2.759  13.464  -5.777
  366    H    TRP  47           H        TRP  47   2.928  11.158  -4.783
  367    HA   TRP  47           HA       TRP  47   1.462   9.357  -6.441
  368   1HB   TRP  47          2HB       TRP  47   2.557   7.577  -5.249
  369   2HB   TRP  47          1HB       TRP  47   3.715   8.889  -5.438
  370    HD1  TRP  47           HD1      TRP  47   3.417  10.737  -3.143
  371    HE1  TRP  47           HE1      TRP  47   3.634  10.012  -0.689
  372    HE3  TRP  47           HE3      TRP  47   2.394   5.734  -3.592
  373    HZ2  TRP  47           HZ2      TRP  47   3.417   7.651   0.881
  374    HZ3  TRP  47           HZ3      TRP  47   2.424   4.282  -1.588
  375    HH2  TRP  47           HH2      TRP  47   2.930   5.235   0.644
  376    H    GLN  48           H        GLN  48   0.406  10.993  -3.700
  377    HA   GLN  48           HA       GLN  48  -1.176   8.966  -2.430
  378   1HB   GLN  48          2HB       GLN  48  -0.787  11.799  -2.197
  379   2HB   GLN  48          1HB       GLN  48  -2.518  11.476  -2.268
  380   1HG   GLN  48          2HG       GLN  48  -1.652  11.399   0.059
  381   2HG   GLN  48          1HG       GLN  48  -2.313   9.844  -0.450
  382   1HE2  GLN  48          1HE2      GLN  48  -0.960   8.090  -0.056
  383   2HE2  GLN  48          2HE2      GLN  48   0.728   8.176   0.110
  384    H    ASN  49           H        ASN  49  -2.254  11.590  -4.629
  385    HA   ASN  49           HA       ASN  49  -4.760  10.246  -5.226
  386   1HB   ASN  49          2HB       ASN  49  -3.347  12.540  -6.623
  387   2HB   ASN  49          1HB       ASN  49  -5.000  12.022  -6.956
  388   1HD2  ASN  49          1HD2      ASN  49  -3.935  14.617  -5.734
  389   2HD2  ASN  49          2HD2      ASN  49  -4.780  14.772  -4.270
  390    H    SER  50           H        SER  50  -1.572  10.378  -6.714
  391    HA   SER  50           HA       SER  50  -2.209   9.302  -9.255
  392   1HB   SER  50          2HB       SER  50   0.082  10.123  -8.245
  393   2HB   SER  50          1HB       SER  50   0.272   8.431  -7.796
  394    HG   SER  50           HG       SER  50   1.053   9.153  -9.955
  395    H    ILE  51           H        ILE  51  -1.489   7.651  -6.187
  396    HA   ILE  51           HA       ILE  51  -1.657   4.975  -7.175
  397    HB   ILE  51           HB       ILE  51  -1.957   6.265  -4.468
  398   1HG1  ILE  51          2HG1      ILE  51   0.169   5.527  -4.131
  399   2HG1  ILE  51          1HG1      ILE  51  -0.179   3.951  -4.833
  400   1HG2  ILE  51          1HG2      ILE  51  -2.415   3.326  -5.067
  401   2HG2  ILE  51          2HG2      ILE  51  -3.633   4.463  -4.487
  402   3HG2  ILE  51          3HG2      ILE  51  -2.267   4.031  -3.458
  403   1HD1  ILE  51          1HD1      ILE  51   0.193   6.435  -6.512
  404   2HD1  ILE  51          2HD1      ILE  51   0.190   4.756  -7.052
  405   3HD1  ILE  51          3HD1      ILE  51   1.529   5.367  -6.081
  406    H    ARG  52           H        ARG  52  -4.114   7.017  -5.586
  407    HA   ARG  52           HA       ARG  52  -6.295   5.273  -5.633
  408   1HB   ARG  52          2HB       ARG  52  -6.434   7.502  -4.636
  409   2HB   ARG  52          1HB       ARG  52  -6.246   8.249  -6.220
  410   1HG   ARG  52          2HG       ARG  52  -8.351   6.801  -6.843
  411   2HG   ARG  52          1HG       ARG  52  -8.607   6.777  -5.098
  412   1HD   ARG  52          2HD       ARG  52  -8.638   9.198  -5.007
  413   2HD   ARG  52          1HD       ARG  52  -8.187   9.308  -6.709
  414    HE   ARG  52           HE       ARG  52 -10.423   8.730  -7.305
  415   1HH1  ARG  52          1HH2      ARG  52 -10.414  10.024  -4.315
  416   2HH1  ARG  52          2HH2      ARG  52 -11.801   9.187  -3.703
  417   1HH2  ARG  52          1HH1      ARG  52 -11.962   6.964  -6.360
  418   2HH2  ARG  52          2HH1      ARG  52 -12.678   7.454  -4.861
  419    H    HIS  53           H        HIS  53  -5.205   7.426  -8.249
  420    HA   HIS  53           HA       HIS  53  -7.210   6.482 -10.122
  421   1HB   HIS  53          2HB       HIS  53  -6.002   8.745 -10.112
  422   2HB   HIS  53          1HB       HIS  53  -4.622   7.889 -10.799
  423    HD1  HIS  53           HD1      HIS  53  -4.725   7.279 -13.264
  424    HD2  HIS  53           HD2      HIS  53  -8.368   8.706 -11.822
  425    HE1  HIS  53           HE1      HIS  53  -6.221   7.594 -15.282
  426    H    ASN  54           H        ASN  54  -4.041   5.431  -9.181
  427    HA   ASN  54           HA       ASN  54  -3.384   3.974 -11.585
  428   1HB   ASN  54          2HB       ASN  54  -2.363   4.001  -8.758
  429   2HB   ASN  54          1HB       ASN  54  -1.830   2.741  -9.872
  430   1HD2  ASN  54          1HD2      ASN  54  -0.811   5.637  -8.723
  431   2HD2  ASN  54          2HD2      ASN  54  -0.001   6.238 -10.090
  432    H    LEU  55           H        LEU  55  -5.048   3.119  -8.586
  433    HA   LEU  55           HA       LEU  55  -5.150   0.285  -9.207
  434   1HB   LEU  55          2HB       LEU  55  -7.247   1.350  -7.410
  435   2HB   LEU  55          1HB       LEU  55  -6.125   0.022  -7.158
  436    HG   LEU  55           HG       LEU  55  -5.419   2.960  -6.948
  437   1HD1  LEU  55          1HD1      LEU  55  -5.074   1.400  -4.560
  438   2HD1  LEU  55          2HD1      LEU  55  -6.743   1.296  -5.125
  439   3HD1  LEU  55          3HD1      LEU  55  -6.017   2.870  -4.803
  440   1HD2  LEU  55          1HD2      LEU  55  -3.504   1.345  -5.692
  441   2HD2  LEU  55          2HD2      LEU  55  -3.303   2.210  -7.216
  442   3HD2  LEU  55          3HD2      LEU  55  -3.846   0.532  -7.219
  443    H    SER  56           H        SER  56  -6.741   2.955 -10.491
  444    HA   SER  56           HA       SER  56  -9.262   1.513 -11.033
  445   1HB   SER  56          2HB       SER  56  -9.430   3.890 -10.528
  446   2HB   SER  56          1HB       SER  56  -8.295   4.277 -11.820
  447    HG   SER  56           HG       SER  56  -9.797   3.806 -13.298
  448    H    LEU  57           H        LEU  57  -6.723   3.103 -13.003
  449    HA   LEU  57           HA       LEU  57  -7.649   1.800 -15.429
  450   1HB   LEU  57          2HB       LEU  57  -5.576   2.781 -16.416
  451   2HB   LEU  57          1HB       LEU  57  -6.558   3.973 -15.567
  452    HG   LEU  57           HG       LEU  57  -4.890   2.937 -13.587
  453   1HD1  LEU  57          1HD1      LEU  57  -3.596   1.909 -15.528
  454   2HD1  LEU  57          2HD1      LEU  57  -2.661   2.967 -14.472
  455   3HD1  LEU  57          3HD1      LEU  57  -3.221   3.555 -16.037
  456   1HD2  LEU  57          1HD2      LEU  57  -4.770   5.434 -15.297
  457   2HD2  LEU  57          2HD2      LEU  57  -3.726   5.193 -13.896
  458   3HD2  LEU  57          3HD2      LEU  57  -5.476   5.259 -13.690
  459    H    ASN  58           H        ASN  58  -5.122   1.156 -13.041
  460    HA   ASN  58           HA       ASN  58  -3.447  -0.630 -14.306
  461   1HB   ASN  58          2HB       ASN  58  -4.540  -0.445 -11.560
  462   2HB   ASN  58          1HB       ASN  58  -3.884  -2.021 -12.003
  463   1HD2  ASN  58          1HD2      ASN  58  -2.741   1.143 -13.228
  464   2HD2  ASN  58          2HD2      ASN  58  -1.190   1.025 -12.550
  465    H    ARG  59           H        ARG  59  -4.064  -2.088 -15.821
  466    HA   ARG  59           HA       ARG  59  -6.590  -3.326 -16.037
  467   1HB   ARG  59          2HB       ARG  59  -5.416  -4.973 -17.525
  468   2HB   ARG  59          1HB       ARG  59  -5.086  -3.288 -17.921
  469   1HG   ARG  59          2HG       ARG  59  -3.040  -3.563 -16.324
  470   2HG   ARG  59          1HG       ARG  59  -3.290  -5.291 -16.571
  471   1HD   ARG  59          2HD       ARG  59  -3.474  -4.119 -19.129
  472   2HD   ARG  59          1HD       ARG  59  -2.081  -3.364 -18.354
  473    HE   ARG  59           HE       ARG  59  -2.380  -6.336 -18.538
  474   1HH1  ARG  59          1HH1      ARG  59  -0.899  -5.071 -20.775
  475   2HH1  ARG  59          2HH1      ARG  59   0.740  -5.108 -20.215
  476   1HH2  ARG  59          1HH2      ARG  59  -0.129  -5.677 -16.906
  477   2HH2  ARG  59          2HH2      ARG  59   1.175  -5.451 -18.023
  478    H    TYR  60           H        TYR  60  -4.016  -4.109 -13.846
  479    HA   TYR  60           HA       TYR  60  -5.251  -6.782 -13.395
  480   1HB   TYR  60          2HB       TYR  60  -3.243  -7.057 -11.772
  481   2HB   TYR  60          1HB       TYR  60  -2.942  -7.151 -13.500
  482    HD1  TYR  60           HD1      TYR  60  -2.001  -5.562 -10.437
  483    HD2  TYR  60           HD2      TYR  60  -2.248  -4.927 -14.680
  484    HE1  TYR  60           HE1      TYR  60  -0.303  -3.766 -10.283
  485    HE2  TYR  60           HE2      TYR  60  -0.564  -3.121 -14.511
  486    HH   TYR  60           HH       TYR  60   0.717  -1.929 -13.156
  487    H    PHE  61           H        PHE  61  -4.812  -3.645 -11.960
  488    HA   PHE  61           HA       PHE  61  -5.768  -4.527  -9.332
  489   1HB   PHE  61          2HB       PHE  61  -5.244  -1.801 -10.528
  490   2HB   PHE  61          1HB       PHE  61  -5.845  -2.033  -8.892
  491    HD1  PHE  61           HD1      PHE  61  -3.296  -0.637  -9.361
  492    HD2  PHE  61           HD2      PHE  61  -4.061  -4.845  -8.914
  493    HE1  PHE  61           HE1      PHE  61  -0.993  -0.984  -8.586
  494    HE2  PHE  61           HE2      PHE  61  -1.752  -5.177  -8.136
  495    HZ   PHE  61           HZ       PHE  61  -0.216  -3.242  -7.964
  496    H    ILE  62           H        ILE  62  -7.835  -4.114  -8.499
  497    HA   ILE  62           HA       ILE  62  -9.862  -2.983 -10.358
  498    HB   ILE  62           HB       ILE  62 -11.374  -4.874  -9.994
  499   1HG1  ILE  62          2HG1      ILE  62  -9.081  -6.215  -8.533
  500   2HG1  ILE  62          1HG1      ILE  62 -10.409  -5.402  -7.702
  501   1HG2  ILE  62          1HG2      ILE  62  -8.938  -4.974 -11.456
  502   2HG2  ILE  62          2HG2      ILE  62 -10.427  -5.859 -11.779
  503   3HG2  ILE  62          3HG2      ILE  62  -9.183  -6.571 -10.753
  504   1HD1  ILE  62          1HD1      ILE  62 -10.557  -7.989  -8.199
  505   2HD1  ILE  62          2HD1      ILE  62 -11.041  -7.446  -9.806
  506   3HD1  ILE  62          3HD1      ILE  62 -11.984  -6.972  -8.394
  507    H    LYS  63           H        LYS  63 -11.998  -2.681  -9.125
  508    HA   LYS  63           HA       LYS  63 -11.406  -2.084  -6.251
  509   1HB   LYS  63          2HB       LYS  63 -12.197  -0.320  -8.349
  510   2HB   LYS  63          1HB       LYS  63 -13.552  -0.461  -7.229
  511   1HG   LYS  63          2HG       LYS  63 -12.291   1.269  -6.277
  512   2HG   LYS  63          1HG       LYS  63 -11.739  -0.144  -5.380
  513   1HD   LYS  63          2HD       LYS  63  -9.719  -0.277  -6.602
  514   2HD   LYS  63          1HD       LYS  63 -10.334   0.755  -7.894
  515   1HE   LYS  63          2HE       LYS  63 -10.015   1.765  -5.065
  516   2HE   LYS  63          1HE       LYS  63  -8.697   1.841  -6.235
  517   1HZ   LYS  63          1HZ       LYS  63  -9.770   3.381  -7.489
  518   2HZ   LYS  63          2HZ       LYS  63 -10.428   3.785  -5.976
  519   3HZ   LYS  63          3HZ       LYS  63 -11.318   2.833  -7.065
  520    H    VAL  64           H        VAL  64 -12.987  -2.701  -4.755
  521    HA   VAL  64           HA       VAL  64 -14.893  -4.714  -5.591
  522    HB   VAL  64           HB       VAL  64 -15.482  -4.859  -3.274
  523   1HG1  VAL  64          1HG1      VAL  64 -13.441  -5.691  -2.831
  524   2HG1  VAL  64          2HG1      VAL  64 -12.863  -4.062  -2.477
  525   3HG1  VAL  64          3HG1      VAL  64 -12.751  -4.701  -4.117
  526   1HG2  VAL  64          1HG2      VAL  64 -14.656  -1.993  -3.293
  527   2HG2  VAL  64          2HG2      VAL  64 -14.377  -2.897  -1.805
  528   3HG2  VAL  64          3HG2      VAL  64 -16.008  -2.766  -2.464
  529    HA   PRO  65           HA       PRO  65 -18.402  -2.204  -6.413
  530   1HB   PRO  65          2HB       PRO  65 -20.420  -3.849  -5.523
  531   2HB   PRO  65          1HB       PRO  65 -19.520  -4.124  -7.024
  532   1HG   PRO  65          2HG       PRO  65 -19.299  -5.552  -4.413
  533   2HG   PRO  65          1HG       PRO  65 -18.952  -6.142  -6.047
  534   1HD   PRO  65          2HD       PRO  65 -17.030  -5.320  -4.153
  535   2HD   PRO  65          1HD       PRO  65 -16.738  -5.556  -5.889
  536    H    ARG  66           H        ARG  66 -20.315  -1.113  -5.341
  537    HA   ARG  66           HA       ARG  66 -20.119  -1.044  -2.366
  538   1HB   ARG  66          2HB       ARG  66 -19.181   0.991  -4.135
  539   2HB   ARG  66          1HB       ARG  66 -20.623   1.605  -3.327
  540   1HG   ARG  66          2HG       ARG  66 -19.314   0.382  -1.250
  541   2HG   ARG  66          1HG       ARG  66 -17.964   0.988  -2.212
  542   1HD   ARG  66          2HD       ARG  66 -20.309   2.780  -1.640
  543   2HD   ARG  66          1HD       ARG  66 -19.060   2.554  -0.416
  544    HE   ARG  66           HE       ARG  66 -17.469   3.242  -2.398
  545   1HH1  ARG  66          1HH1      ARG  66 -19.981   3.922  -4.037
  546   2HH1  ARG  66          2HH1      ARG  66 -20.051   5.639  -3.818
  547   1HH2  ARG  66          1HH2      ARG  66 -17.847   5.654  -1.140
  548   2HH2  ARG  66          2HH2      ARG  66 -18.843   6.619  -2.178
  549    H    SER  67           H        SER  67 -21.964   1.095  -2.052
  550    HA   SER  67           HA       SER  67 -24.383   0.407  -3.577
  551   1HB   SER  67          2HB       SER  67 -24.702   0.196  -0.618
  552   2HB   SER  67          1HB       SER  67 -25.590  -0.620  -1.901
  553    HG   SER  67           HG       SER  67 -24.214  -2.199  -1.792
  554    H    GLN  68           H        GLN  68 -26.220   1.579  -1.746
  555    HA   GLN  68           HA       GLN  68 -25.519   4.405  -2.133
  556   1HB   GLN  68          2HB       GLN  68 -27.793   3.758  -2.635
  557   2HB   GLN  68          1HB       GLN  68 -27.989   3.032  -1.039
  558   1HG   GLN  68          2HG       GLN  68 -28.078   5.100   0.040
  559   2HG   GLN  68          1HG       GLN  68 -27.229   5.930  -1.265
  560   1HE2  GLN  68          1HE2      GLN  68 -28.677   7.361  -2.229
  561   2HE2  GLN  68          2HE2      GLN  68 -30.290   7.001  -2.617
  562    H    GLU  69           H        GLU  69 -23.658   4.124  -0.515
  563    HA   GLU  69           HA       GLU  69 -24.695   4.732   2.220
  564   1HB   GLU  69          2HB       GLU  69 -22.581   3.570   3.068
  565   2HB   GLU  69          1HB       GLU  69 -23.835   2.512   2.420
  566   1HG   GLU  69          2HG       GLU  69 -22.660   2.139   0.415
  567   2HG   GLU  69          1HG       GLU  69 -21.641   3.560   0.642
  568    H    GLU  70           H        GLU  70 -22.295   5.381   3.431
  569    HA   GLU  70           HA       GLU  70 -20.499   6.951   1.899
  570   1HB   GLU  70          2HB       GLU  70 -23.073   8.197   2.328
  571   2HB   GLU  70          1HB       GLU  70 -21.805   9.124   3.130
  572   1HG   GLU  70          2HG       GLU  70 -20.706   8.398   0.654
  573   2HG   GLU  70          1HG       GLU  70 -22.368   8.869   0.294
  574    HA   PRO  71           HA       PRO  71 -20.046   8.134   6.495
  575   1HB   PRO  71          2HB       PRO  71 -22.106   7.513   8.205
  576   2HB   PRO  71          1HB       PRO  71 -21.992   9.047   7.324
  577   1HG   PRO  71          2HG       PRO  71 -23.776   6.714   6.808
  578   2HG   PRO  71          1HG       PRO  71 -24.026   8.425   6.423
  579   1HD   PRO  71          2HD       PRO  71 -23.234   6.420   4.598
  580   2HD   PRO  71          1HD       PRO  71 -23.158   8.172   4.325
  581    H    GLY  72           H        GLY  72 -20.653   5.193   5.214
  582   1HA   GLY  72          2HA       GLY  72 -20.678   3.389   7.417
  583   2HA   GLY  72          1HA       GLY  72 -20.044   3.007   5.813
  584    H    LYS  73           H        LYS  73 -17.818   3.052   5.497
  585    HA   LYS  73           HA       LYS  73 -16.137   4.034   7.756
  586   1HB   LYS  73          2HB       LYS  73 -16.530   1.292   6.983
  587   2HB   LYS  73          1HB       LYS  73 -14.862   1.753   6.638
  588   1HG   LYS  73          2HG       LYS  73 -14.387   2.232   8.865
  589   2HG   LYS  73          1HG       LYS  73 -16.077   2.547   9.263
  590   1HD   LYS  73          2HD       LYS  73 -15.687   0.455  10.261
  591   2HD   LYS  73          1HD       LYS  73 -16.433   0.024   8.722
  592   1HE   LYS  73          2HE       LYS  73 -14.599  -1.366   8.618
  593   2HE   LYS  73          1HE       LYS  73 -13.877   0.081   7.916
  594   1HZ   LYS  73          1HZ       LYS  73 -13.654  -0.911  10.694
  595   2HZ   LYS  73          2HZ       LYS  73 -13.255   0.685  10.273
  596   3HZ   LYS  73          3HZ       LYS  73 -12.408  -0.615   9.582
  597    H    GLY  74           H        GLY  74 -15.324   2.278   4.767
  598   1HA   GLY  74          2HA       GLY  74 -14.432   4.706   3.414
  599   2HA   GLY  74          1HA       GLY  74 -13.099   3.715   4.008
  600    H    SER  75           H        SER  75 -12.804   3.724   1.503
  601    HA   SER  75           HA       SER  75 -14.547   1.750   0.145
  602   1HB   SER  75          2HB       SER  75 -13.195   4.023  -0.732
  603   2HB   SER  75          1HB       SER  75 -12.224   2.693  -1.357
  604    HG   SER  75           HG       SER  75 -13.900   2.003  -2.523
  605    H    PHE  76           H        PHE  76 -13.270   0.083  -1.249
  606    HA   PHE  76           HA       PHE  76 -10.713  -0.773  -0.068
  607   1HB   PHE  76          2HB       PHE  76 -13.034  -1.767   1.065
  608   2HB   PHE  76          1HB       PHE  76 -12.608  -3.009  -0.114
  609    HD1  PHE  76           HD1      PHE  76 -12.139  -2.040   3.188
  610    HD2  PHE  76           HD2      PHE  76  -9.921  -3.441  -0.211
  611    HE1  PHE  76           HE1      PHE  76 -10.352  -2.864   4.697
  612    HE2  PHE  76           HE2      PHE  76  -8.131  -4.266   1.298
  613    HZ   PHE  76           HZ       PHE  76  -8.347  -3.976   3.752
  614    H    TRP  77           H        TRP  77  -9.511  -1.904  -1.565
  615    HA   TRP  77           HA       TRP  77 -10.902  -3.112  -3.883
  616   1HB   TRP  77          2HB       TRP  77  -9.699  -1.861  -5.511
  617   2HB   TRP  77          1HB       TRP  77 -10.280  -0.670  -4.354
  618    HD1  TRP  77           HD1      TRP  77  -8.466   0.224  -2.525
  619    HE1  TRP  77           HE1      TRP  77  -5.916   0.515  -2.762
  620    HE3  TRP  77           HE3      TRP  77  -7.620  -2.778  -6.555
  621    HZ2  TRP  77           HZ2      TRP  77  -3.799  -0.401  -4.454
  622    HZ3  TRP  77           HZ3      TRP  77  -5.335  -3.054  -7.453
  623    HH2  TRP  77           HH2      TRP  77  -3.432  -1.863  -6.421
  624    H    ARG  78           H        ARG  78  -9.178  -4.308  -5.292
  625    HA   ARG  78           HA       ARG  78  -6.777  -5.134  -3.771
  626   1HB   ARG  78          2HB       ARG  78  -8.139  -7.516  -4.718
  627   2HB   ARG  78          1HB       ARG  78  -7.530  -7.162  -3.106
  628   1HG   ARG  78          2HG       ARG  78  -9.567  -6.052  -2.488
  629   2HG   ARG  78          1HG       ARG  78 -10.145  -6.055  -4.155
  630   1HD   ARG  78          2HD       ARG  78 -10.522  -8.388  -4.147
  631   2HD   ARG  78          1HD       ARG  78  -9.513  -8.633  -2.721
  632    HE   ARG  78           HE       ARG  78 -11.646  -6.947  -1.943
  633   1HH1  ARG  78          1HH1      ARG  78 -13.362  -8.589  -3.649
  634   2HH1  ARG  78          2HH1      ARG  78 -13.744  -9.949  -2.647
  635   1HH2  ARG  78          1HH2      ARG  78 -11.156  -9.370  -0.414
  636   2HH2  ARG  78          2HH2      ARG  78 -12.497 -10.391  -0.817
  637    H    ILE  79           H        ILE  79  -5.373  -6.585  -5.129
  638    HA   ILE  79           HA       ILE  79  -5.447  -5.691  -7.920
  639    HB   ILE  79           HB       ILE  79  -3.317  -6.754  -8.163
  640   1HG1  ILE  79          2HG1      ILE  79  -4.177  -8.309  -5.711
  641   2HG1  ILE  79          1HG1      ILE  79  -3.679  -8.937  -7.283
  642   1HG2  ILE  79          1HG2      ILE  79  -2.055  -5.753  -6.409
  643   2HG2  ILE  79          2HG2      ILE  79  -3.404  -5.873  -5.280
  644   3HG2  ILE  79          3HG2      ILE  79  -3.486  -4.747  -6.635
  645   1HD1  ILE  79          1HD1      ILE  79  -2.039  -8.258  -4.976
  646   2HD1  ILE  79          2HD1      ILE  79  -1.501  -7.399  -6.419
  647   3HD1  ILE  79          3HD1      ILE  79  -1.602  -9.160  -6.427
  648    H    ASP  80           H        ASP  80  -4.917  -7.590  -9.584
  649    HA   ASP  80           HA       ASP  80  -7.269  -9.279  -9.605
  650   1HB   ASP  80          2HB       ASP  80  -5.023  -8.667 -11.404
  651   2HB   ASP  80          1HB       ASP  80  -5.622 -10.321 -11.533
  652    HA   PRO  81           HA       PRO  81  -5.625 -12.748  -7.501
  653   1HB   PRO  81          2HB       PRO  81  -7.273 -14.682  -8.541
  654   2HB   PRO  81          1HB       PRO  81  -7.795 -13.481  -7.347
  655   1HG   PRO  81          2HG       PRO  81  -8.406 -13.616 -10.260
  656   2HG   PRO  81          1HG       PRO  81  -9.329 -12.853  -8.954
  657   1HD   PRO  81          2HD       PRO  81  -7.646 -11.526 -10.820
  658   2HD   PRO  81          1HD       PRO  81  -8.356 -10.819  -9.352
  659    H    ALA  82           H        ALA  82  -6.271 -13.558 -10.958
  660    HA   ALA  82           HA       ALA  82  -4.092 -15.526 -10.900
  661   1HB   ALA  82          1HB       ALA  82  -6.245 -14.757 -12.800
  662   2HB   ALA  82          2HB       ALA  82  -5.698 -16.358 -12.302
  663   3HB   ALA  82          3HB       ALA  82  -4.782 -15.447 -13.503
  664    H    SER  83           H        SER  83  -4.109 -12.212 -11.264
  665    HA   SER  83           HA       SER  83  -1.764 -12.342 -13.110
  666   1HB   SER  83          2HB       SER  83  -3.962 -10.454 -12.858
  667   2HB   SER  83          1HB       SER  83  -2.400  -9.654 -12.771
  668    HG   SER  83           HG       SER  83  -2.453  -9.864 -14.863
  669    H    GLU  84           H        GLU  84  -2.524 -12.253  -9.901
  670    HA   GLU  84           HA       GLU  84  -0.857 -10.197  -8.893
  671   1HB   GLU  84          2HB       GLU  84  -0.964 -11.332  -6.786
  672   2HB   GLU  84          1HB       GLU  84  -2.505 -11.648  -7.584
  673   1HG   GLU  84          2HG       GLU  84  -1.750 -13.836  -8.309
  674   2HG   GLU  84          1HG       GLU  84  -0.124 -13.518  -7.705
  675    H    ALA  85           H        ALA  85  -0.101 -13.456 -10.017
  676    HA   ALA  85           HA       ALA  85   2.615 -13.460  -9.028
  677   1HB   ALA  85          1HB       ALA  85   2.231 -15.610  -9.641
  678   2HB   ALA  85          2HB       ALA  85   2.622 -15.087 -11.279
  679   3HB   ALA  85          3HB       ALA  85   0.941 -15.146 -10.750
  680    H    LYS  86           H        LYS  86   1.066 -11.999 -11.769
  681    HA   LYS  86           HA       LYS  86   3.601 -11.571 -13.205
  682   1HB   LYS  86          2HB       LYS  86   1.848 -11.839 -14.727
  683   2HB   LYS  86          1HB       LYS  86   0.705 -10.956 -13.720
  684   1HG   LYS  86          2HG       LYS  86   1.319  -9.619 -15.693
  685   2HG   LYS  86          1HG       LYS  86   1.908  -8.847 -14.221
  686   1HD   LYS  86          2HD       LYS  86   4.026 -10.456 -14.843
  687   2HD   LYS  86          1HD       LYS  86   3.426 -10.050 -16.451
  688   1HE   LYS  86          2HE       LYS  86   3.332  -7.652 -14.966
  689   2HE   LYS  86          1HE       LYS  86   4.891  -8.389 -14.595
  690   1HZ   LYS  86          1HZ       LYS  86   3.851  -8.081 -17.353
  691   2HZ   LYS  86          2HZ       LYS  86   5.425  -8.509 -16.880
  692   3HZ   LYS  86          3HZ       LYS  86   4.852  -6.934 -16.607
  693    H    LEU  87           H        LEU  87   1.107  -9.451 -11.729
  694    HA   LEU  87           HA       LEU  87   2.512  -7.037 -11.973
  695   1HB   LEU  87          2HB       LEU  87   1.273  -6.532  -9.678
  696   2HB   LEU  87          1HB       LEU  87   0.387  -6.646 -11.180
  697    HG   LEU  87           HG       LEU  87   0.667  -9.277 -10.032
  698   1HD1  LEU  87          1HD1      LEU  87  -1.113  -8.306  -8.177
  699   2HD1  LEU  87          2HD1      LEU  87   0.152  -7.080  -8.169
  700   3HD1  LEU  87          3HD1      LEU  87   0.554  -8.766  -7.840
  701   1HD2  LEU  87          1HD2      LEU  87  -1.708  -7.437 -10.473
  702   2HD2  LEU  87          2HD2      LEU  87  -1.817  -9.164 -10.131
  703   3HD2  LEU  87          3HD2      LEU  87  -1.082  -8.609 -11.635
  704    H    VAL  88           H        VAL  88   2.497  -9.249  -9.225
  705    HA   VAL  88           HA       VAL  88   4.246  -7.939  -7.516
  706    HB   VAL  88           HB       VAL  88   4.895 -10.215  -6.795
  707   1HG1  VAL  88          1HG1      VAL  88   2.988  -9.824  -5.622
  708   2HG1  VAL  88          2HG1      VAL  88   2.214 -10.888  -6.795
  709   3HG1  VAL  88          3HG1      VAL  88   2.184  -9.141  -7.035
  710   1HG2  VAL  88          1HG2      VAL  88   3.557 -10.825  -9.388
  711   2HG2  VAL  88          2HG2      VAL  88   3.406 -11.994  -8.079
  712   3HG2  VAL  88          3HG2      VAL  88   5.001 -11.550  -8.686
  713    H    GLU  89           H        GLU  89   5.014  -9.615 -10.491
  714    HA   GLU  89           HA       GLU  89   7.761 -10.106 -10.127
  715   1HB   GLU  89          2HB       GLU  89   6.516 -10.808 -12.149
  716   2HB   GLU  89          1HB       GLU  89   6.395  -9.122 -12.654
  717   1HG   GLU  89          2HG       GLU  89   9.118  -9.509 -12.110
  718   2HG   GLU  89          1HG       GLU  89   8.616 -10.972 -12.959
  719    H    GLN  90           H        GLN  90   6.144  -7.115 -11.186
  720    HA   GLN  90           HA       GLN  90   8.674  -5.643 -11.263
  721   1HB   GLN  90          2HB       GLN  90   5.781  -4.739 -11.429
  722   2HB   GLN  90          1HB       GLN  90   7.166  -3.662 -11.616
  723   1HG   GLN  90          2HG       GLN  90   7.495  -5.994 -13.293
  724   2HG   GLN  90          1HG       GLN  90   5.943  -5.223 -13.624
  725   1HE2  GLN  90          1HE2      GLN  90   5.986  -2.920 -14.296
  726   2HE2  GLN  90          2HE2      GLN  90   7.401  -2.245 -14.946
  727    H    ALA  91           H        ALA  91   6.368  -6.526  -8.884
  728    HA   ALA  91           HA       ALA  91   6.603  -4.304  -7.099
  729   1HB   ALA  91          1HB       ALA  91   6.183  -7.126  -6.163
  730   2HB   ALA  91          2HB       ALA  91   4.918  -6.254  -7.029
  731   3HB   ALA  91          3HB       ALA  91   5.525  -5.633  -5.495
  732    H    PHE  92           H        PHE  92   8.528  -7.248  -7.503
  733    HA   PHE  92           HA       PHE  92  10.204  -6.541  -5.179
  734   1HB   PHE  92          2HB       PHE  92  10.571  -8.813  -7.146
  735   2HB   PHE  92          1HB       PHE  92  11.293  -8.664  -5.544
  736    HD1  PHE  92           HD1      PHE  92   8.747 -10.245  -7.302
  737    HD2  PHE  92           HD2      PHE  92   9.418  -8.112  -3.636
  738    HE1  PHE  92           HE1      PHE  92   6.759 -11.341  -6.302
  739    HE2  PHE  92           HE2      PHE  92   7.430  -9.207  -2.635
  740    HZ   PHE  92           HZ       PHE  92   6.100 -10.821  -3.968
  741    H    ARG  93           H        ARG  93  10.690  -6.994  -8.701
  742    HA   ARG  93           HA       ARG  93  13.431  -6.073  -8.588
  743   1HB   ARG  93          2HB       ARG  93  11.488  -6.465 -10.872
  744   2HB   ARG  93          1HB       ARG  93  13.153  -5.935 -11.110
  745   1HG   ARG  93          2HG       ARG  93  13.474  -8.094  -9.433
  746   2HG   ARG  93          1HG       ARG  93  12.117  -8.605 -10.437
  747   1HD   ARG  93          2HD       ARG  93  13.433  -8.036 -12.467
  748   2HD   ARG  93          1HD       ARG  93  14.799  -7.606 -11.439
  749    HE   ARG  93           HE       ARG  93  14.578 -10.077 -10.619
  750   1HH1  ARG  93          1HH1      ARG  93  12.635  -9.684 -13.267
  751   2HH1  ARG  93          2HH1      ARG  93  13.445 -10.832 -14.281
  752   1HH2  ARG  93          1HH2      ARG  93  16.138 -11.229 -12.132
  753   2HH2  ARG  93          2HH2      ARG  93  15.428 -11.706 -13.639
  754    H    LYS  94           H        LYS  94  13.867  -3.994  -8.016
  755    HA   LYS  94           HA       LYS  94  12.443  -1.850  -9.502
  756   1HB   LYS  94          2HB       LYS  94  11.546  -2.175  -7.112
  757   2HB   LYS  94          1HB       LYS  94  13.101  -1.536  -6.575
  758   1HG   LYS  94          2HG       LYS  94  11.468   0.289  -6.759
  759   2HG   LYS  94          1HG       LYS  94  12.728   0.485  -7.972
  760   1HD   LYS  94          2HD       LYS  94  10.765  -1.146  -9.173
  761   2HD   LYS  94          1HD       LYS  94   9.886   0.150  -8.364
  762   1HE   LYS  94          2HE       LYS  94  10.934   1.826  -9.610
  763   2HE   LYS  94          1HE       LYS  94  12.319   0.806 -10.000
  764   1HZ   LYS  94          1HZ       LYS  94   9.822   1.091 -11.373
  765   2HZ   LYS  94          2HZ       LYS  94  10.206  -0.535 -11.060
  766   3HZ   LYS  94          3HZ       LYS  94  11.291   0.446 -11.923
  767    H    ARG  95           H        ARG  95  14.270  -0.275  -7.274
  768    HA   ARG  95           HA       ARG  95  16.594  -0.207  -9.133
  769   1HB   ARG  95          2HB       ARG  95  16.067   1.742  -6.889
  770   2HB   ARG  95          1HB       ARG  95  17.032   1.984  -8.345
  771   1HG   ARG  95          2HG       ARG  95  14.020   1.797  -8.130
  772   2HG   ARG  95          1HG       ARG  95  14.978   3.157  -8.711
  773   1HD   ARG  95          2HD       ARG  95  14.801   0.441 -10.047
  774   2HD   ARG  95          1HD       ARG  95  13.984   1.903 -10.595
  775    HE   ARG  95           HE       ARG  95  16.641   2.653 -10.494
  776   1HH1  ARG  95          1HH1      ARG  95  15.910  -0.508 -11.251
  777   2HH1  ARG  95          2HH1      ARG  95  16.522  -0.460 -12.870
  778   1HH2  ARG  95          1HH2      ARG  95  16.988   2.977 -12.874
  779   2HH2  ARG  95          2HH2      ARG  95  17.135   1.513 -13.790
  780    H    ARG  96           H        ARG  96  18.577  -0.921  -8.436
  781    HA   ARG  96           HA       ARG  96  19.288  -1.008  -5.617
  782   1HB   ARG  96          2HB       ARG  96  17.746  -3.040  -6.031
  783   2HB   ARG  96          1HB       ARG  96  19.083  -3.695  -6.977
  784   1HG   ARG  96          2HG       ARG  96  20.563  -3.271  -4.947
  785   2HG   ARG  96          1HG       ARG  96  19.081  -2.962  -4.042
  786   1HD   ARG  96          2HD       ARG  96  19.845  -5.523  -5.469
  787   2HD   ARG  96          1HD       ARG  96  19.658  -5.289  -3.731
  788    HE   ARG  96           HE       ARG  96  17.193  -4.580  -4.892
  789   1HH1  ARG  96          1HH1      ARG  96  18.643  -7.090  -6.331
  790   2HH1  ARG  96          2HH1      ARG  96  17.644  -8.345  -5.677
  791   1HH2  ARG  96          1HH2      ARG  96  16.162  -6.295  -3.307
  792   2HH2  ARG  96          2HH2      ARG  96  16.238  -7.895  -3.965
  793    H    GLN  97           H        GLN  97  21.404  -0.464  -5.715
  794    HA   GLN  97           HA       GLN  97  23.208  -1.949  -7.505
  795   1HB   GLN  97          2HB       GLN  97  22.293   0.055  -8.806
  796   2HB   GLN  97          1HB       GLN  97  23.163   1.072  -7.657
  797   1HG   GLN  97          2HG       GLN  97  25.264  -0.176  -8.234
  798   2HG   GLN  97          1HG       GLN  97  24.360  -1.025  -9.490
  799   1HE2  GLN  97          1HE2      GLN  97  24.406  -0.034 -11.509
  800   2HE2  GLN  97          2HE2      GLN  97  24.725   1.612 -11.781
  801    H    ARG  98           H        ARG  98  23.069   0.966  -5.418
  802    HA   ARG  98           HA       ARG  98  25.488  -0.102  -4.013
  803   1HB   ARG  98          2HB       ARG  98  25.369   2.241  -5.443
  804   2HB   ARG  98          1HB       ARG  98  24.990   2.798  -3.813
  805   1HG   ARG  98          2HG       ARG  98  27.049   2.138  -2.959
  806   2HG   ARG  98          1HG       ARG  98  27.284   0.906  -4.201
  807   1HD   ARG  98          2HD       ARG  98  27.844   2.526  -5.852
  808   2HD   ARG  98          1HD       ARG  98  27.235   3.854  -4.863
  809    HE   ARG  98           HE       ARG  98  29.874   2.638  -4.649
  810   1HH1  ARG  98          1HH1      ARG  98  28.864   5.531  -4.102
  811   2HH1  ARG  98          2HH1      ARG  98  29.207   5.654  -2.409
  812   1HH2  ARG  98          1HH2      ARG  98  29.667   2.245  -1.981
  813   2HH2  ARG  98          2HH2      ARG  98  29.662   3.795  -1.209
  814    H    GLY  99           H        GLY  99  24.001  -1.170  -2.510
  815   1HA   GLY  99          2HA       GLY  99  23.461   0.361  -0.160
  816   2HA   GLY  99          1HA       GLY  99  21.955   0.144  -1.050
  817    H    VAL 100           H        VAL 100  23.034  -1.039   1.566
  818    HA   VAL 100           HA       VAL 100  21.971  -3.721   1.118
  819    HB   VAL 100           HB       VAL 100  24.247  -4.134   0.377
  820   1HG1  VAL 100          1HG1      VAL 100  25.312  -3.229   3.039
  821   2HG1  VAL 100          2HG1      VAL 100  25.061  -2.052   1.749
  822   3HG1  VAL 100          3HG1      VAL 100  26.163  -3.407   1.505
  823   1HG2  VAL 100          1HG2      VAL 100  24.426  -5.123   3.182
  824   2HG2  VAL 100          2HG2      VAL 100  24.586  -6.010   1.666
  825   3HG2  VAL 100          3HG2      VAL 100  22.986  -5.577   2.270
  826    H    SER 101           HN       SER 101  20.562  -2.569   2.741
  827    HA   SER 101           HA       SER 101  21.189  -3.452   5.414
  828   1HB   SER 101          2HB       SER 101  21.605  -0.555   4.718
  829   2HB   SER 101          1HB       SER 101  21.057  -1.004   6.330
  830    HG   SER 101           HG       SER 101  22.899  -2.191   6.613
  Start of MODEL   12
    1   1H    GLU   1          1HT       GLU   1  13.691  16.219  -6.234
    2   2H    GLU   1          2HT       GLU   1  12.289  16.337  -5.283
    3   3H    GLU   1          3HT       GLU   1  12.373  17.139  -6.778
    4    HA   GLU   1           HA       GLU   1  11.151  14.816  -6.475
    5   1HB   GLU   1          2HB       GLU   1  11.626  14.474  -8.939
    6   2HB   GLU   1          1HB       GLU   1  11.060  16.091  -8.521
    7   1HG   GLU   1          2HG       GLU   1  13.123  17.063  -8.891
    8   2HG   GLU   1          1HG       GLU   1  14.006  15.590  -8.490
    9    H    SER   2           H        SER   2  12.892  13.894  -4.819
   10    HA   SER   2           HA       SER   2  14.734  12.095  -6.339
   11   1HB   SER   2          2HB       SER   2  15.145  13.738  -4.021
   12   2HB   SER   2          1HB       SER   2  15.343  12.049  -3.563
   13    HG   SER   2           HG       SER   2  16.484  12.945  -5.956
   14    H    LYS   3           H        LYS   3  12.520  10.911  -6.575
   15    HA   LYS   3           HA       LYS   3  11.865   9.356  -4.140
   16   1HB   LYS   3          2HB       LYS   3   9.960   8.523  -5.656
   17   2HB   LYS   3          1HB       LYS   3   9.900  10.210  -5.148
   18   1HG   LYS   3          2HG       LYS   3  11.405   9.655  -7.647
   19   2HG   LYS   3          1HG       LYS   3   9.656   9.444  -7.732
   20   1HD   LYS   3          2HD       LYS   3  10.561  11.891  -6.334
   21   2HD   LYS   3          1HD       LYS   3  10.902  11.844  -8.064
   22   1HE   LYS   3          2HE       LYS   3   8.736  12.205  -8.562
   23   2HE   LYS   3          1HE       LYS   3   8.231  10.860  -7.539
   24   1HZ   LYS   3          1HZ       LYS   3   7.939  13.581  -7.043
   25   2HZ   LYS   3          2HZ       LYS   3   9.073  13.000  -5.919
   26   3HZ   LYS   3          3HZ       LYS   3   7.533  12.290  -6.021
   27    HA   PRO   4           HA       PRO   4  14.210   6.066  -6.100
   28   1HB   PRO   4          2HB       PRO   4  14.527   4.636  -3.791
   29   2HB   PRO   4          1HB       PRO   4  15.506   6.051  -4.212
   30   1HG   PRO   4          2HG       PRO   4  13.374   5.805  -2.164
   31   2HG   PRO   4          1HG       PRO   4  14.685   6.990  -2.278
   32   1HD   PRO   4          2HD       PRO   4  11.931   7.361  -3.027
   33   2HD   PRO   4          1HD       PRO   4  13.267   8.515  -3.211
   34    HA   PRO   5           HA       PRO   5  10.691   2.994  -4.878
   35   1HB   PRO   5          2HB       PRO   5   8.238   3.952  -5.663
   36   2HB   PRO   5          1HB       PRO   5   8.877   4.116  -4.020
   37   1HG   PRO   5          2HG       PRO   5   8.591   6.179  -6.135
   38   2HG   PRO   5          1HG       PRO   5   8.685   6.377  -4.377
   39   1HD   PRO   5          2HD       PRO   5  10.776   6.804  -6.254
   40   2HD   PRO   5          1HD       PRO   5  10.921   6.801  -4.482
   41    H    TYR   6           H        TYR   6   8.908   1.972  -6.510
   42    HA   TYR   6           HA       TYR   6  10.280   1.899  -9.117
   43   1HB   TYR   6          2HB       TYR   6   7.912   0.234  -8.996
   44   2HB   TYR   6          1HB       TYR   6   9.590  -0.252  -9.205
   45    HD1  TYR   6           HD1      TYR   6  10.982  -0.859  -7.279
   46    HD2  TYR   6           HD2      TYR   6   6.882   0.315  -6.775
   47    HE1  TYR   6           HE1      TYR   6  11.013  -1.732  -4.956
   48    HE2  TYR   6           HE2      TYR   6   6.912  -0.560  -4.455
   49    HH   TYR   6           HH       TYR   6   9.857  -2.051  -3.097
   50    H    SER   7           H        SER   7   8.540   1.538 -11.031
   51    HA   SER   7           HA       SER   7   7.432   4.035 -11.626
   52   1HB   SER   7          2HB       SER   7   6.830   1.249 -12.558
   53   2HB   SER   7          1HB       SER   7   5.754   2.553 -13.046
   54    HG   SER   7           HG       SER   7   7.422   2.334 -14.545
   55    H    TYR   8           H        TYR   8   5.012   4.545 -11.789
   56    HA   TYR   8           HA       TYR   8   3.843   4.152  -9.149
   57   1HB   TYR   8          2HB       TYR   8   3.228   5.807 -11.520
   58   2HB   TYR   8          1HB       TYR   8   1.815   5.257 -10.618
   59    HD1  TYR   8           HD1      TYR   8   4.028   7.892 -10.846
   60    HD2  TYR   8           HD2      TYR   8   2.348   5.246  -7.913
   61    HE1  TYR   8           HE1      TYR   8   4.506   9.555  -9.068
   62    HE2  TYR   8           HE2      TYR   8   2.825   6.905  -6.135
   63    HH   TYR   8           HH       TYR   8   3.834  10.139  -6.878
   64    H    ALA   9           H        ALA   9   3.663   1.863  -9.137
   65    HA   ALA   9           HA       ALA   9   1.101   0.831  -9.780
   66   1HB   ALA   9          1HB       ALA   9   3.150   0.603 -11.900
   67   2HB   ALA   9          2HB       ALA   9   1.394   0.491 -12.017
   68   3HB   ALA   9          3HB       ALA   9   2.332  -0.907 -11.495
   69    H    GLN  10           H        GLN  10   4.499   0.278  -9.113
   70    HA   GLN  10           HA       GLN  10   4.052  -2.415  -8.047
   71   1HB   GLN  10          2HB       GLN  10   6.401  -0.571  -8.320
   72   2HB   GLN  10          1HB       GLN  10   6.492  -1.912  -7.179
   73   1HG   GLN  10          2HG       GLN  10   6.038  -3.516  -8.930
   74   2HG   GLN  10          1HG       GLN  10   5.718  -2.226 -10.090
   75   1HE2  GLN  10          1HE2      GLN  10   7.485  -2.763 -11.517
   76   2HE2  GLN  10          2HE2      GLN  10   9.108  -2.579 -11.057
   77    H    LEU  11           H        LEU  11   4.366   0.890  -6.830
   78    HA   LEU  11           HA       LEU  11   4.645   0.242  -4.054
   79   1HB   LEU  11          2HB       LEU  11   2.786   2.492  -4.570
   80   2HB   LEU  11          1HB       LEU  11   4.221   2.446  -3.559
   81    HG   LEU  11           HG       LEU  11   4.801   3.946  -5.243
   82   1HD1  LEU  11          1HD1      LEU  11   6.010   1.380  -5.236
   83   2HD1  LEU  11          2HD1      LEU  11   6.723   2.911  -5.728
   84   3HD1  LEU  11          3HD1      LEU  11   5.908   1.901  -6.917
   85   1HD2  LEU  11          1HD2      LEU  11   4.348   2.870  -7.712
   86   2HD2  LEU  11          2HD2      LEU  11   3.252   3.982  -6.889
   87   3HD2  LEU  11          3HD2      LEU  11   2.978   2.242  -6.796
   88    H    ILE  12           H        ILE  12   2.102  -0.089  -6.338
   89    HA   ILE  12           HA       ILE  12   0.095  -0.442  -4.229
   90    HB   ILE  12           HB       ILE  12  -0.464  -1.182  -7.053
   91   1HG1  ILE  12          2HG1      ILE  12   0.765   0.847  -7.457
   92   2HG1  ILE  12          1HG1      ILE  12  -0.948   1.273  -7.515
   93   1HG2  ILE  12          1HG2      ILE  12  -2.193   0.658  -5.545
   94   2HG2  ILE  12          2HG2      ILE  12  -1.949  -0.916  -4.785
   95   3HG2  ILE  12          3HG2      ILE  12  -2.602  -0.816  -6.420
   96   1HD1  ILE  12          1HD1      ILE  12   0.531   1.478  -4.907
   97   2HD1  ILE  12          2HD1      ILE  12  -0.886   2.365  -5.459
   98   3HD1  ILE  12          3HD1      ILE  12   0.705   2.752  -6.110
   99    H    VAL  13           H        VAL  13   1.253  -2.393  -6.985
  100    HA   VAL  13           HA       VAL  13   0.159  -4.843  -6.268
  101    HB   VAL  13           HB       VAL  13   2.879  -4.249  -7.462
  102   1HG1  VAL  13          1HG1      VAL  13   3.050  -6.483  -6.736
  103   2HG1  VAL  13          2HG1      VAL  13   2.500  -6.634  -8.403
  104   3HG1  VAL  13          3HG1      VAL  13   1.354  -6.819  -7.075
  105   1HG2  VAL  13          1HG2      VAL  13   0.168  -4.914  -8.652
  106   2HG2  VAL  13          2HG2      VAL  13   1.662  -4.789  -9.581
  107   3HG2  VAL  13          3HG2      VAL  13   1.013  -3.369  -8.762
  108    H    GLN  14           H        GLN  14   3.569  -3.987  -5.483
  109    HA   GLN  14           HA       GLN  14   3.909  -6.068  -3.587
  110   1HB   GLN  14          2HB       GLN  14   5.530  -4.117  -4.607
  111   2HB   GLN  14          1HB       GLN  14   5.292  -3.529  -2.961
  112   1HG   GLN  14          2HG       GLN  14   5.743  -6.137  -2.434
  113   2HG   GLN  14          1HG       GLN  14   6.687  -5.975  -3.914
  114   1HE2  GLN  14          1HE2      GLN  14   8.265  -4.038  -3.923
  115   2HE2  GLN  14          2HE2      GLN  14   9.004  -3.630  -2.451
  116    H    ALA  15           H        ALA  15   2.247  -3.034  -3.360
  117    HA   ALA  15           HA       ALA  15   2.225  -2.799  -0.486
  118   1HB   ALA  15          1HB       ALA  15   1.631  -0.781  -1.401
  119   2HB   ALA  15          2HB       ALA  15   0.004  -1.440  -1.241
  120   3HB   ALA  15          3HB       ALA  15   0.840  -1.526  -2.789
  121    H    ILE  16           H        ILE  16  -0.216  -3.999  -2.790
  122    HA   ILE  16           HA       ILE  16  -1.899  -4.996  -0.611
  123    HB   ILE  16           HB       ILE  16  -2.701  -5.932  -3.241
  124   1HG1  ILE  16          2HG1      ILE  16  -2.038  -2.989  -2.933
  125   2HG1  ILE  16          1HG1      ILE  16  -1.536  -4.079  -4.225
  126   1HG2  ILE  16          1HG2      ILE  16  -4.125  -3.746  -1.821
  127   2HG2  ILE  16          2HG2      ILE  16  -3.922  -5.261  -0.943
  128   3HG2  ILE  16          3HG2      ILE  16  -4.754  -5.246  -2.497
  129   1HD1  ILE  16          1HD1      ILE  16  -4.289  -4.287  -4.306
  130   2HD1  ILE  16          2HD1      ILE  16  -3.317  -3.268  -5.368
  131   3HD1  ILE  16          3HD1      ILE  16  -4.044  -2.586  -3.912
  132    H    SER  17           H        SER  17  -0.392  -6.532  -3.474
  133    HA   SER  17           HA       SER  17  -0.924  -9.197  -2.776
  134   1HB   SER  17          2HB       SER  17   1.745  -8.836  -3.937
  135   2HB   SER  17          1HB       SER  17   0.349  -9.696  -4.578
  136    HG   SER  17           HG       SER  17   1.280  -7.312  -5.264
  137    H    SER  18           H        SER  18   1.722  -7.109  -1.653
  138    HA   SER  18           HA       SER  18   2.884  -9.343  -0.114
  139   1HB   SER  18          2HB       SER  18   3.750  -6.483   0.171
  140   2HB   SER  18          1HB       SER  18   4.717  -7.951   0.280
  141    HG   SER  18           HG       SER  18   4.946  -7.946  -1.819
  142    H    ALA  19           H        ALA  19   0.547  -6.876   0.349
  143    HA   ALA  19           HA       ALA  19   0.903  -6.401   3.158
  144   1HB   ALA  19          1HB       ALA  19  -0.695  -4.902   2.633
  145   2HB   ALA  19          2HB       ALA  19  -1.855  -6.229   2.591
  146   3HB   ALA  19          3HB       ALA  19  -1.032  -5.731   1.114
  147    H    GLN  20           H        GLN  20  -1.587  -7.059   4.289
  148    HA   GLN  20           HA       GLN  20  -1.219  -9.566   5.395
  149   1HB   GLN  20          2HB       GLN  20  -3.884  -9.584   5.417
  150   2HB   GLN  20          1HB       GLN  20  -2.972  -8.445   6.408
  151   1HG   GLN  20          2HG       GLN  20  -3.424  -6.646   5.001
  152   2HG   GLN  20          1HG       GLN  20  -3.688  -7.681   3.596
  153   1HE2  GLN  20          1HE2      GLN  20  -5.531  -5.601   4.797
  154   2HE2  GLN  20          2HE2      GLN  20  -6.973  -6.433   5.132
  155    H    ASP  21           H        ASP  21  -4.077  -9.517   3.367
  156    HA   ASP  21           HA       ASP  21  -3.245 -12.105   2.208
  157   1HB   ASP  21          2HB       ASP  21  -5.693 -11.056   3.027
  158   2HB   ASP  21          1HB       ASP  21  -5.786 -11.009   1.266
  159    H    ARG  22           H        ARG  22  -4.937  -9.333   0.737
  160    HA   ARG  22           HA       ARG  22  -2.922  -8.644  -1.144
  161   1HB   ARG  22          2HB       ARG  22  -4.149  -9.690  -3.179
  162   2HB   ARG  22          1HB       ARG  22  -3.103 -10.737  -2.219
  163   1HG   ARG  22          2HG       ARG  22  -5.666 -10.770  -0.987
  164   2HG   ARG  22          1HG       ARG  22  -5.920 -11.001  -2.717
  165   1HD   ARG  22          2HD       ARG  22  -3.634 -12.534  -1.794
  166   2HD   ARG  22          1HD       ARG  22  -5.084 -12.949  -0.879
  167    HE   ARG  22           HE       ARG  22  -5.720 -12.856  -3.671
  168   1HH1  ARG  22          1HH2      ARG  22  -5.158 -14.874  -1.047
  169   2HH1  ARG  22          2HH2      ARG  22  -4.822 -16.292  -1.985
  170   1HH2  ARG  22          1HH1      ARG  22  -4.785 -14.603  -5.013
  171   2HH2  ARG  22          2HH1      ARG  22  -4.611 -16.138  -4.230
  172    H    GLN  23           H        GLN  23  -5.059  -7.491   0.502
  173    HA   GLN  23           HA       GLN  23  -6.421  -5.932  -1.642
  174   1HB   GLN  23          2HB       GLN  23  -8.537  -6.049  -0.525
  175   2HB   GLN  23          1HB       GLN  23  -7.940  -7.707  -0.596
  176   1HG   GLN  23          2HG       GLN  23  -6.924  -7.266   1.724
  177   2HG   GLN  23          1HG       GLN  23  -7.949  -5.834   1.770
  178   1HE2  GLN  23          1HE2      GLN  23  -8.463  -7.807   3.668
  179   2HE2  GLN  23          2HE2      GLN  23  -9.902  -8.623   3.287
  180    H    LEU  24           H        LEU  24  -6.121  -3.764  -1.301
  181    HA   LEU  24           HA       LEU  24  -5.508  -2.882   1.487
  182   1HB   LEU  24          2HB       LEU  24  -4.234  -2.059  -1.132
  183   2HB   LEU  24          1HB       LEU  24  -4.149  -1.057   0.308
  184    HG   LEU  24           HG       LEU  24  -3.207  -3.924   0.125
  185   1HD1  LEU  24          1HD1      LEU  24  -1.849  -1.249  -0.036
  186   2HD1  LEU  24          2HD1      LEU  24  -1.570  -2.698  -1.001
  187   3HD1  LEU  24          3HD1      LEU  24  -0.985  -2.620   0.661
  188   1HD2  LEU  24          1HD2      LEU  24  -2.144  -2.691   2.390
  189   2HD2  LEU  24          2HD2      LEU  24  -3.463  -3.863   2.371
  190   3HD2  LEU  24          3HD2      LEU  24  -3.817  -2.135   2.351
  191    H    THR  25           H        THR  25  -6.566  -1.019   2.150
  192    HA   THR  25           HA       THR  25  -8.792  -0.099   0.480
  193    HB   THR  25           HB       THR  25  -9.463   1.175   2.381
  194    HG1  THR  25           HG1      THR  25  -8.064   1.887   3.876
  195   1HG2  THR  25          1HG2      THR  25  -9.174  -1.456   2.609
  196   2HG2  THR  25          2HG2      THR  25  -9.685  -0.478   3.985
  197   3HG2  THR  25          3HG2      THR  25  -8.003  -0.987   3.841
  198    H    LEU  26           H        LEU  26  -8.845   2.620   0.712
  199    HA   LEU  26           HA       LEU  26  -6.804   3.432  -1.147
  200   1HB   LEU  26          2HB       LEU  26  -9.173   4.594  -0.166
  201   2HB   LEU  26          1HB       LEU  26  -7.883   5.685   0.339
  202    HG   LEU  26           HG       LEU  26  -7.557   4.699  -2.414
  203   1HD1  LEU  26          1HD1      LEU  26  -9.551   6.790  -2.496
  204   2HD1  LEU  26          2HD1      LEU  26 -10.183   5.398  -1.619
  205   3HD1  LEU  26          3HD1      LEU  26  -9.580   5.204  -3.265
  206   1HD2  LEU  26          1HD2      LEU  26  -6.245   6.529  -1.360
  207   2HD2  LEU  26          2HD2      LEU  26  -7.726   7.472  -1.182
  208   3HD2  LEU  26          3HD2      LEU  26  -7.112   7.089  -2.791
  209    H    SER  27           H        SER  27  -7.048   3.492   2.354
  210    HA   SER  27           HA       SER  27  -4.469   4.962   2.531
  211   1HB   SER  27          2HB       SER  27  -6.775   5.055   4.086
  212   2HB   SER  27          1HB       SER  27  -5.654   4.108   5.060
  213    HG   SER  27           HG       SER  27  -4.889   6.015   5.543
  214    H    GLY  28           H        GLY  28  -4.911   2.022   1.707
  215   1HA   GLY  28          2HA       GLY  28  -3.295   0.711   3.851
  216   2HA   GLY  28          1HA       GLY  28  -4.171  -0.145   2.572
  217    H    ILE  29           H        ILE  29  -3.515   1.356   0.433
  218    HA   ILE  29           HA       ILE  29  -0.996   0.401  -0.414
  219    HB   ILE  29           HB       ILE  29  -3.071   1.232  -1.728
  220   1HG1  ILE  29          2HG1      ILE  29  -0.931   0.438  -2.730
  221   2HG1  ILE  29          1HG1      ILE  29  -1.696   1.715  -3.680
  222   1HG2  ILE  29          1HG2      ILE  29  -1.615   3.828  -1.892
  223   2HG2  ILE  29          2HG2      ILE  29  -2.694   3.559  -0.522
  224   3HG2  ILE  29          3HG2      ILE  29  -3.322   3.480  -2.169
  225   1HD1  ILE  29          1HD1      ILE  29   0.310   2.745  -3.550
  226   2HD1  ILE  29          2HD1      ILE  29   0.836   1.745  -2.197
  227   3HD1  ILE  29          3HD1      ILE  29  -0.181   3.156  -1.909
  228    H    TYR  30           H        TYR  30  -2.030   3.192   1.320
  229    HA   TYR  30           HA       TYR  30   0.508   4.638   0.971
  230   1HB   TYR  30          2HB       TYR  30  -1.778   5.256   2.865
  231   2HB   TYR  30          1HB       TYR  30  -0.494   6.357   2.358
  232    HD1  TYR  30           HD1      TYR  30  -3.594   6.662   1.992
  233    HD2  TYR  30           HD2      TYR  30  -0.427   5.265  -0.538
  234    HE1  TYR  30           HE1      TYR  30  -4.914   7.280  -0.013
  235    HE2  TYR  30           HE2      TYR  30  -1.731   5.880  -2.524
  236    HH   TYR  30           HH       TYR  30  -4.506   7.850  -2.379
  237    H    ALA  31           H        ALA  31  -1.283   3.403   3.819
  238    HA   ALA  31           HA       ALA  31   0.851   3.665   5.656
  239   1HB   ALA  31          1HB       ALA  31  -1.675   2.133   5.518
  240   2HB   ALA  31          2HB       ALA  31  -1.015   3.098   6.839
  241   3HB   ALA  31          3HB       ALA  31  -0.449   1.447   6.584
  242    H    HIS  32           H        HIS  32   0.479   1.496   3.016
  243    HA   HIS  32           HA       HIS  32   2.163  -0.621   4.080
  244   1HB   HIS  32          2HB       HIS  32   0.467  -1.055   2.335
  245   2HB   HIS  32          1HB       HIS  32   1.347  -0.011   1.218
  246    HD1  HIS  32           HD1      HIS  32   1.043  -3.461   2.104
  247    HD2  HIS  32           HD2      HIS  32   4.253  -1.027   1.029
  248    HE1  HIS  32           HE1      HIS  32   2.915  -5.014   1.399
  249    H    ILE  33           H        ILE  33   2.725   1.518   1.261
  250    HA   ILE  33           HA       ILE  33   5.531   1.099   1.119
  251    HB   ILE  33           HB       ILE  33   5.563   3.209  -0.173
  252   1HG1  ILE  33          2HG1      ILE  33   3.084   4.135  -0.452
  253   2HG1  ILE  33          1HG1      ILE  33   2.927   3.512   1.193
  254   1HG2  ILE  33          1HG2      ILE  33   3.138   2.306  -1.353
  255   2HG2  ILE  33          2HG2      ILE  33   3.946   0.892  -0.675
  256   3HG2  ILE  33          3HG2      ILE  33   4.787   1.914  -1.841
  257   1HD1  ILE  33          1HD1      ILE  33   4.370   5.863   0.236
  258   2HD1  ILE  33          2HD1      ILE  33   5.390   4.804   1.209
  259   3HD1  ILE  33          3HD1      ILE  33   3.887   5.437   1.878
  260    H    THR  34           H        THR  34   3.658   3.434   2.998
  261    HA   THR  34           HA       THR  34   5.775   5.115   3.847
  262    HB   THR  34           HB       THR  34   4.243   5.329   5.974
  263    HG1  THR  34           HG1      THR  34   3.181   3.303   5.368
  264   1HG2  THR  34          1HG2      THR  34   2.574   6.137   3.738
  265   2HG2  THR  34          2HG2      THR  34   4.272   6.502   3.431
  266   3HG2  THR  34          3HG2      THR  34   3.480   7.137   4.873
  267    H    LYS  35           H        LYS  35   4.865   1.894   4.901
  268    HA   LYS  35           HA       LYS  35   6.510   2.015   7.320
  269   1HB   LYS  35          2HB       LYS  35   4.434   0.555   6.992
  270   2HB   LYS  35          1HB       LYS  35   5.448  -0.482   5.989
  271   1HG   LYS  35          2HG       LYS  35   5.765  -1.494   8.047
  272   2HG   LYS  35          1HG       LYS  35   7.083  -0.321   8.080
  273   1HD   LYS  35          2HD       LYS  35   4.749   1.017   9.002
  274   2HD   LYS  35          1HD       LYS  35   4.836  -0.525   9.854
  275   1HE   LYS  35          2HE       LYS  35   6.652   0.113  11.044
  276   2HE   LYS  35          1HE       LYS  35   7.440   0.799   9.624
  277   1HZ   LYS  35          1HZ       LYS  35   5.353   2.481  10.103
  278   2HZ   LYS  35          2HZ       LYS  35   6.976   2.763  10.520
  279   3HZ   LYS  35          3HZ       LYS  35   5.905   2.097  11.659
  280    H    HIS  36           H        HIS  36   6.732   0.047   4.321
  281    HA   HIS  36           HA       HIS  36   9.498  -0.660   4.898
  282   1HB   HIS  36          2HB       HIS  36   7.499  -1.261   2.798
  283   2HB   HIS  36          1HB       HIS  36   9.182  -1.282   2.265
  284    HD1  HIS  36           HD1      HIS  36  10.632  -3.222   3.027
  285    HD2  HIS  36           HD2      HIS  36   6.943  -3.134   4.968
  286    HE1  HIS  36           HE1      HIS  36  10.466  -5.378   4.347
  287    H    TYR  37           H        TYR  37   7.964   1.358   2.370
  288    HA   TYR  37           HA       TYR  37  10.545   2.395   1.510
  289   1HB   TYR  37          2HB       TYR  37   7.779   2.571   0.583
  290   2HB   TYR  37          1HB       TYR  37   8.608   4.127   0.504
  291    HD1  TYR  37           HD1      TYR  37   8.953   0.528  -0.392
  292    HD2  TYR  37           HD2      TYR  37  10.180   4.564  -1.180
  293    HE1  TYR  37           HE1      TYR  37  10.195  -0.245  -2.391
  294    HE2  TYR  37           HE2      TYR  37  11.420   3.796  -3.182
  295    HH   TYR  37           HH       TYR  37  12.213   1.980  -4.273
  296    HA   PRO  38           HA       PRO  38  10.473   5.517   4.719
  297   1HB   PRO  38          2HB       PRO  38  13.044   6.369   4.262
  298   2HB   PRO  38          1HB       PRO  38  12.646   4.922   5.204
  299   1HG   PRO  38          2HG       PRO  38  13.755   5.117   2.446
  300   2HG   PRO  38          1HG       PRO  38  13.902   3.802   3.623
  301   1HD   PRO  38          2HD       PRO  38  12.147   3.860   1.392
  302   2HD   PRO  38          1HD       PRO  38  12.104   2.695   2.733
  303    H    TYR  39           H        TYR  39  12.051   6.242   1.569
  304    HA   TYR  39           HA       TYR  39  11.660   9.055   1.678
  305   1HB   TYR  39          2HB       TYR  39  13.153   7.971   0.036
  306   2HB   TYR  39          1HB       TYR  39  11.749   7.274  -0.774
  307    HD1  TYR  39           HD1      TYR  39  10.192   8.673  -2.039
  308    HD2  TYR  39           HD2      TYR  39  13.626  10.366  -0.094
  309    HE1  TYR  39           HE1      TYR  39   9.883  10.770  -3.324
  310    HE2  TYR  39           HE2      TYR  39  13.319  12.463  -1.382
  311    HH   TYR  39           HH       TYR  39  10.703  12.783  -3.781
  312    H    TYR  40           H        TYR  40   9.492   6.456   0.736
  313    HA   TYR  40           HA       TYR  40   7.498   8.387  -0.266
  314   1HB   TYR  40          2HB       TYR  40   7.986   5.549  -0.561
  315   2HB   TYR  40          1HB       TYR  40   6.324   5.832  -0.043
  316    HD1  TYR  40           HD1      TYR  40   5.186   5.353  -2.118
  317    HD2  TYR  40           HD2      TYR  40   8.399   8.195  -1.985
  318    HE1  TYR  40           HE1      TYR  40   4.595   6.135  -4.399
  319    HE2  TYR  40           HE2      TYR  40   7.813   8.978  -4.264
  320    HH   TYR  40           HH       TYR  40   6.490   7.688  -6.359
  321    H    ARG  41           H        ARG  41   8.320   8.482   2.567
  322    HA   ARG  41           HA       ARG  41   5.647   7.904   3.775
  323   1HB   ARG  41          2HB       ARG  41   6.631   7.142   5.770
  324   2HB   ARG  41          1HB       ARG  41   7.672   6.445   4.529
  325   1HG   ARG  41          2HG       ARG  41   9.293   7.379   5.882
  326   2HG   ARG  41          1HG       ARG  41   8.964   8.765   4.842
  327   1HD   ARG  41          2HD       ARG  41   7.821   9.906   6.483
  328   2HD   ARG  41          1HD       ARG  41   7.250   8.428   7.260
  329    HE   ARG  41           HE       ARG  41   9.904   8.294   7.798
  330   1HH1  ARG  41          1HH1      ARG  41   8.037   9.176   9.939
  331   2HH1  ARG  41          2HH1      ARG  41   8.658  10.740  10.357
  332   1HH2  ARG  41          1HH2      ARG  41  10.550  11.054   7.470
  333   2HH2  ARG  41          2HH2      ARG  41  10.079  11.800   8.960
  334    H    THR  42           H        THR  42   8.383  10.091   3.511
  335    HA   THR  42           HA       THR  42   7.280  11.981   5.464
  336    HB   THR  42           HB       THR  42   9.728  11.779   5.115
  337    HG1  THR  42           HG1      THR  42  10.003  14.120   4.628
  338   1HG2  THR  42          1HG2      THR  42   9.178  13.005   2.399
  339   2HG2  THR  42          2HG2      THR  42   9.559  11.302   2.657
  340   3HG2  THR  42          3HG2      THR  42  10.750  12.541   3.054
  341    H    ALA  43           H        ALA  43   7.626  11.824   1.916
  342    HA   ALA  43           HA       ALA  43   6.238  14.346   1.505
  343   1HB   ALA  43          1HB       ALA  43   7.516  13.919  -0.355
  344   2HB   ALA  43          2HB       ALA  43   6.030  13.140  -0.898
  345   3HB   ALA  43          3HB       ALA  43   7.333  12.171  -0.208
  346    H    ASP  44           H        ASP  44   4.116  14.492   0.392
  347    HA   ASP  44           HA       ASP  44   2.378  12.108   0.652
  348   1HB   ASP  44          2HB       ASP  44   0.658  13.470   1.874
  349   2HB   ASP  44          1HB       ASP  44   2.112  13.159   2.823
  350    H    LYS  45           H        LYS  45   2.549  15.574  -0.204
  351    HA   LYS  45           HA       LYS  45   0.313  15.302  -2.065
  352   1HB   LYS  45          2HB       LYS  45   0.991  17.664  -2.717
  353   2HB   LYS  45          1HB       LYS  45   0.565  17.447  -1.020
  354   1HG   LYS  45          2HG       LYS  45   2.865  17.407  -0.352
  355   2HG   LYS  45          1HG       LYS  45   3.414  17.275  -2.024
  356   1HD   LYS  45          2HD       LYS  45   1.915  19.651  -0.883
  357   2HD   LYS  45          1HD       LYS  45   3.661  19.586  -1.130
  358   1HE   LYS  45          2HE       LYS  45   3.017  18.927  -3.586
  359   2HE   LYS  45          1HE       LYS  45   1.462  19.655  -3.179
  360   1HZ   LYS  45          1HZ       LYS  45   4.086  21.001  -2.838
  361   2HZ   LYS  45          2HZ       LYS  45   2.552  21.692  -2.611
  362   3HZ   LYS  45          3HZ       LYS  45   3.057  21.232  -4.166
  363    H    GLY  46           H        GLY  46   1.287  13.535  -3.342
  364   1HA   GLY  46          2HA       GLY  46   2.371  14.430  -5.808
  365   2HA   GLY  46          1HA       GLY  46   3.707  13.814  -4.829
  366    H    TRP  47           H        TRP  47   2.588  11.691  -3.539
  367    HA   TRP  47           HA       TRP  47   1.908   9.856  -5.785
  368   1HB   TRP  47          2HB       TRP  47   2.837   8.076  -4.436
  369   2HB   TRP  47          1HB       TRP  47   3.995   9.404  -4.437
  370    HD1  TRP  47           HD1      TRP  47   3.641  11.169  -2.246
  371    HE1  TRP  47           HE1      TRP  47   3.289  10.531   0.212
  372    HE3  TRP  47           HE3      TRP  47   1.963   6.373  -2.821
  373    HZ2  TRP  47           HZ2      TRP  47   2.439   8.281   1.748
  374    HZ3  TRP  47           HZ3      TRP  47   1.406   5.008  -0.831
  375    HH2  TRP  47           HH2      TRP  47   1.643   5.954   1.447
  376    H    GLN  48           H        GLN  48   0.556  11.419  -3.111
  377    HA   GLN  48           HA       GLN  48  -1.147   9.418  -2.046
  378   1HB   GLN  48          2HB       GLN  48  -0.730  12.002  -1.436
  379   2HB   GLN  48          1HB       GLN  48  -2.250  12.168  -2.315
  380   1HG   GLN  48          2HG       GLN  48  -2.607  11.801   0.120
  381   2HG   GLN  48          1HG       GLN  48  -3.301  10.506  -0.857
  382   1HE2  GLN  48          1HE2      GLN  48   0.185  10.581  -0.595
  383   2HE2  GLN  48          2HE2      GLN  48   0.330   9.283   0.488
  384    H    ASN  49           H        ASN  49  -2.268  12.019  -4.246
  385    HA   ASN  49           HA       ASN  49  -4.543  10.458  -5.115
  386   1HB   ASN  49          2HB       ASN  49  -3.406  12.743  -6.710
  387   2HB   ASN  49          1HB       ASN  49  -5.095  12.298  -6.460
  388   1HD2  ASN  49          1HD2      ASN  49  -4.235  14.961  -5.947
  389   2HD2  ASN  49          2HD2      ASN  49  -4.305  15.246  -4.275
  390    H    SER  50           H        SER  50  -1.239  10.494  -5.980
  391    HA   SER  50           HA       SER  50  -1.457   9.711  -8.736
  392   1HB   SER  50          2HB       SER  50   0.628  10.356  -7.109
  393   2HB   SER  50          1HB       SER  50   0.792   8.604  -7.151
  394    HG   SER  50           HG       SER  50   0.261   9.463  -9.616
  395    H    ILE  51           H        ILE  51  -1.358   7.894  -5.688
  396    HA   ILE  51           HA       ILE  51  -1.316   5.281  -6.886
  397    HB   ILE  51           HB       ILE  51  -1.964   6.406  -4.189
  398   1HG1  ILE  51          2HG1      ILE  51  -0.119   5.155  -3.480
  399   2HG1  ILE  51          1HG1      ILE  51  -0.272   4.004  -4.795
  400   1HG2  ILE  51          1HG2      ILE  51  -3.126   3.930  -5.269
  401   2HG2  ILE  51          2HG2      ILE  51  -3.536   4.814  -3.799
  402   3HG2  ILE  51          3HG2      ILE  51  -2.189   3.676  -3.801
  403   1HD1  ILE  51          1HD1      ILE  51   0.731   5.417  -6.342
  404   2HD1  ILE  51          2HD1      ILE  51   1.630   5.801  -4.873
  405   3HD1  ILE  51          3HD1      ILE  51   0.336   6.868  -5.420
  406    H    ARG  52           H        ARG  52  -4.038   7.164  -5.469
  407    HA   ARG  52           HA       ARG  52  -6.117   5.401  -6.085
  408   1HB   ARG  52          2HB       ARG  52  -6.411   7.552  -4.857
  409   2HB   ARG  52          1HB       ARG  52  -6.228   8.419  -6.383
  410   1HG   ARG  52          2HG       ARG  52  -8.230   6.222  -6.349
  411   2HG   ARG  52          1HG       ARG  52  -8.636   7.667  -5.421
  412   1HD   ARG  52          2HD       ARG  52  -7.510   8.249  -8.075
  413   2HD   ARG  52          1HD       ARG  52  -9.041   7.373  -8.130
  414    HE   ARG  52           HE       ARG  52  -9.826   9.262  -6.496
  415   1HH1  ARG  52          1HH1      ARG  52  -7.190  10.738  -6.814
  416   2HH1  ARG  52          2HH1      ARG  52  -7.597  11.902  -8.031
  417   1HH2  ARG  52          1HH2      ARG  52 -10.490  10.260  -9.012
  418   2HH2  ARG  52          2HH2      ARG  52  -9.464  11.631  -9.274
  419    H    HIS  53           H        HIS  53  -4.780   7.947  -8.201
  420    HA   HIS  53           HA       HIS  53  -6.407   7.273 -10.469
  421   1HB   HIS  53          2HB       HIS  53  -4.709   9.316  -9.868
  422   2HB   HIS  53          1HB       HIS  53  -3.701   8.375 -10.966
  423    HD1  HIS  53           HD1      HIS  53  -4.706  11.093 -11.925
  424    HD2  HIS  53           HD2      HIS  53  -6.810   7.551 -12.565
  425    HE1  HIS  53           HE1      HIS  53  -6.221  11.508 -13.913
  426    H    ASN  54           H        ASN  54  -3.388   6.033  -9.202
  427    HA   ASN  54           HA       ASN  54  -2.590   4.590 -11.574
  428   1HB   ASN  54          2HB       ASN  54  -1.817   4.505  -8.669
  429   2HB   ASN  54          1HB       ASN  54  -1.244   3.250  -9.771
  430   1HD2  ASN  54          1HD2      ASN  54  -0.046   5.902  -8.417
  431   2HD2  ASN  54          2HD2      ASN  54   0.840   6.570  -9.700
  432    H    LEU  55           H        LEU  55  -4.726   3.877  -8.873
  433    HA   LEU  55           HA       LEU  55  -4.821   1.029  -9.377
  434   1HB   LEU  55          2HB       LEU  55  -6.800   2.798  -7.905
  435   2HB   LEU  55          1HB       LEU  55  -6.681   1.041  -7.785
  436    HG   LEU  55           HG       LEU  55  -4.512   3.017  -7.003
  437   1HD1  LEU  55          1HD1      LEU  55  -6.563   2.780  -5.492
  438   2HD1  LEU  55          2HD1      LEU  55  -4.996   2.463  -4.744
  439   3HD1  LEU  55          3HD1      LEU  55  -6.036   1.119  -5.218
  440   1HD2  LEU  55          1HD2      LEU  55  -4.106   0.369  -6.009
  441   2HD2  LEU  55          2HD2      LEU  55  -3.086   1.284  -7.121
  442   3HD2  LEU  55          3HD2      LEU  55  -4.380   0.262  -7.747
  443    H    SER  56           H        SER  56  -6.076   3.725 -10.990
  444    HA   SER  56           HA       SER  56  -8.432   2.294 -12.061
  445   1HB   SER  56          2HB       SER  56  -7.874   4.723 -13.476
  446   2HB   SER  56          1HB       SER  56  -9.206   4.384 -12.376
  447    HG   SER  56           HG       SER  56  -8.193   5.882 -11.256
  448    H    LEU  57           H        LEU  57  -5.170   3.228 -12.968
  449    HA   LEU  57           HA       LEU  57  -5.503   2.467 -15.772
  450   1HB   LEU  57          2HB       LEU  57  -3.212   3.343 -14.035
  451   2HB   LEU  57          1HB       LEU  57  -2.871   2.575 -15.585
  452    HG   LEU  57           HG       LEU  57  -2.962   4.971 -15.931
  453   1HD1  LEU  57          1HD1      LEU  57  -5.649   4.011 -16.891
  454   2HD1  LEU  57          2HD1      LEU  57  -4.168   3.288 -17.521
  455   3HD1  LEU  57          3HD1      LEU  57  -4.466   5.013 -17.732
  456   1HD2  LEU  57          1HD2      LEU  57  -4.978   4.827 -13.926
  457   2HD2  LEU  57          2HD2      LEU  57  -5.729   5.505 -15.370
  458   3HD2  LEU  57          3HD2      LEU  57  -4.302   6.274 -14.675
  459    H    ASN  58           H        ASN  58  -3.646   1.128 -13.018
  460    HA   ASN  58           HA       ASN  58  -2.657  -1.198 -14.136
  461   1HB   ASN  58          2HB       ASN  58  -4.035  -1.201 -11.444
  462   2HB   ASN  58          1HB       ASN  58  -2.633  -2.147 -11.945
  463   1HD2  ASN  58          1HD2      ASN  58  -1.634   0.420 -13.407
  464   2HD2  ASN  58          2HD2      ASN  58  -0.946   1.341 -12.158
  465    H    ARG  59           H        ARG  59  -3.707  -2.598 -15.456
  466    HA   ARG  59           HA       ARG  59  -6.596  -2.958 -15.287
  467   1HB   ARG  59          2HB       ARG  59  -6.262  -4.549 -17.154
  468   2HB   ARG  59          1HB       ARG  59  -5.459  -3.010 -17.464
  469   1HG   ARG  59          2HG       ARG  59  -3.320  -3.963 -16.691
  470   2HG   ARG  59          1HG       ARG  59  -4.119  -5.505 -16.382
  471   1HD   ARG  59          2HD       ARG  59  -4.892  -5.181 -18.920
  472   2HD   ARG  59          1HD       ARG  59  -3.412  -4.225 -18.984
  473    HE   ARG  59           HE       ARG  59  -2.151  -6.232 -18.414
  474   1HH1  ARG  59          1HH2      ARG  59  -4.059  -7.024 -20.693
  475   2HH1  ARG  59          2HH2      ARG  59  -4.613  -8.563 -20.126
  476   1HH2  ARG  59          1HH1      ARG  59  -3.503  -8.066 -16.880
  477   2HH2  ARG  59          2HH1      ARG  59  -4.299  -9.152 -17.970
  478    H    TYR  60           H        TYR  60  -4.268  -4.080 -13.310
  479    HA   TYR  60           HA       TYR  60  -5.468  -6.800 -13.113
  480   1HB   TYR  60          2HB       TYR  60  -3.496  -6.993 -11.341
  481   2HB   TYR  60          1HB       TYR  60  -3.208  -7.236 -13.059
  482    HD1  TYR  60           HD1      TYR  60  -2.478  -5.176 -14.439
  483    HD2  TYR  60           HD2      TYR  60  -2.317  -5.331 -10.149
  484    HE1  TYR  60           HE1      TYR  60  -0.816  -3.344 -14.440
  485    HE2  TYR  60           HE2      TYR  60  -0.655  -3.495 -10.154
  486    HH   TYR  60           HH       TYR  60   0.889  -2.414 -11.547
  487    H    PHE  61           H        PHE  61  -5.153  -3.742 -11.462
  488    HA   PHE  61           HA       PHE  61  -6.108  -4.796  -8.912
  489   1HB   PHE  61          2HB       PHE  61  -5.868  -1.960  -9.959
  490   2HB   PHE  61          1HB       PHE  61  -6.331  -2.376  -8.309
  491    HD1  PHE  61           HD1      PHE  61  -3.831  -0.777  -9.256
  492    HD2  PHE  61           HD2      PHE  61  -4.444  -4.909  -8.246
  493    HE1  PHE  61           HE1      PHE  61  -1.453  -0.988  -8.639
  494    HE2  PHE  61           HE2      PHE  61  -2.069  -5.112  -7.634
  495    HZ   PHE  61           HZ       PHE  61  -0.568  -3.148  -7.817
  496    H    ILE  62           H        ILE  62  -8.215  -4.389  -8.031
  497    HA   ILE  62           HA       ILE  62 -10.302  -3.539  -9.967
  498    HB   ILE  62           HB       ILE  62 -11.541  -5.551  -9.827
  499   1HG1  ILE  62          2HG1      ILE  62 -10.083  -7.267  -8.113
  500   2HG1  ILE  62          1HG1      ILE  62 -10.262  -5.748  -7.236
  501   1HG2  ILE  62          1HG2      ILE  62 -10.005  -7.284 -10.553
  502   2HG2  ILE  62          2HG2      ILE  62  -8.650  -6.469  -9.770
  503   3HG2  ILE  62          3HG2      ILE  62  -9.425  -5.740 -11.177
  504   1HD1  ILE  62          1HD1      ILE  62 -12.697  -6.627  -8.653
  505   2HD1  ILE  62          2HD1      ILE  62 -12.512  -6.001  -7.014
  506   3HD1  ILE  62          3HD1      ILE  62 -12.183  -7.700  -7.350
  507    H    LYS  63           H        LYS  63 -12.550  -3.763  -8.716
  508    HA   LYS  63           HA       LYS  63 -12.130  -2.558  -6.010
  509   1HB   LYS  63          2HB       LYS  63 -14.375  -2.196  -8.021
  510   2HB   LYS  63          1HB       LYS  63 -14.423  -1.564  -6.375
  511   1HG   LYS  63          2HG       LYS  63 -12.086  -0.941  -8.165
  512   2HG   LYS  63          1HG       LYS  63 -13.575  -0.006  -8.291
  513   1HD   LYS  63          2HD       LYS  63 -13.332   0.123  -5.654
  514   2HD   LYS  63          1HD       LYS  63 -11.631  -0.172  -6.020
  515   1HE   LYS  63          2HE       LYS  63 -11.537   1.769  -7.462
  516   2HE   LYS  63          1HE       LYS  63 -13.280   2.007  -7.332
  517   1HZ   LYS  63          1HZ       LYS  63 -11.616   3.333  -5.830
  518   2HZ   LYS  63          2HZ       LYS  63 -11.700   1.935  -4.868
  519   3HZ   LYS  63          3HZ       LYS  63 -13.112   2.809  -5.225
  520    H    VAL  64           H        VAL  64 -12.838  -3.798  -4.326
  521    HA   VAL  64           HA       VAL  64 -14.683  -6.056  -4.974
  522    HB   VAL  64           HB       VAL  64 -13.792  -6.870  -2.658
  523   1HG1  VAL  64          1HG1      VAL  64 -12.115  -6.754  -5.180
  524   2HG1  VAL  64          2HG1      VAL  64 -13.249  -8.022  -4.713
  525   3HG1  VAL  64          3HG1      VAL  64 -11.749  -7.805  -3.811
  526   1HG2  VAL  64          1HG2      VAL  64 -11.579  -4.966  -3.483
  527   2HG2  VAL  64          2HG2      VAL  64 -11.600  -6.011  -2.062
  528   3HG2  VAL  64          3HG2      VAL  64 -12.712  -4.646  -2.170
  529    HA   PRO  65           HA       PRO  65 -17.459  -3.530  -2.462
  530   1HB   PRO  65          2HB       PRO  65 -19.736  -4.737  -3.421
  531   2HB   PRO  65          1HB       PRO  65 -18.906  -3.412  -4.257
  532   1HG   PRO  65          2HG       PRO  65 -18.948  -6.318  -4.926
  533   2HG   PRO  65          1HG       PRO  65 -18.702  -4.925  -5.992
  534   1HD   PRO  65          2HD       PRO  65 -16.672  -6.631  -5.001
  535   2HD   PRO  65          1HD       PRO  65 -16.423  -5.055  -5.782
  536    H    ARG  66           H        ARG  66 -19.561  -4.477  -1.146
  537    HA   ARG  66           HA       ARG  66 -18.856  -7.174  -0.086
  538   1HB   ARG  66          2HB       ARG  66 -17.946  -5.166   1.310
  539   2HB   ARG  66          1HB       ARG  66 -19.630  -4.951   1.792
  540   1HG   ARG  66          2HG       ARG  66 -18.755  -7.745   1.930
  541   2HG   ARG  66          1HG       ARG  66 -17.833  -6.683   2.994
  542   1HD   ARG  66          2HD       ARG  66 -19.618  -6.284   4.348
  543   2HD   ARG  66          1HD       ARG  66 -20.747  -6.200   2.994
  544    HE   ARG  66           HE       ARG  66 -20.490  -8.794   2.989
  545   1HH1  ARG  66          1HH1      ARG  66 -21.700  -6.867   5.374
  546   2HH1  ARG  66          2HH1      ARG  66 -21.543  -8.013   6.665
  547   1HH2  ARG  66          1HH2      ARG  66 -19.637 -10.238   4.812
  548   2HH2  ARG  66          2HH2      ARG  66 -20.375  -9.920   6.346
  549    H    SER  67           H        SER  67 -21.202  -4.638   0.839
  550    HA   SER  67           HA       SER  67 -23.371  -6.573   0.143
  551   1HB   SER  67          2HB       SER  67 -22.796  -6.147   2.680
  552   2HB   SER  67          1HB       SER  67 -23.670  -4.638   2.421
  553    HG   SER  67           HG       SER  67 -25.370  -5.839   2.717
  554    H    GLN  68           H        GLN  68 -25.556  -5.009   0.558
  555    HA   GLN  68           HA       GLN  68 -25.367  -3.104  -1.653
  556   1HB   GLN  68          2HB       GLN  68 -27.380  -4.455  -1.438
  557   2HB   GLN  68          1HB       GLN  68 -27.648  -3.852   0.199
  558   1HG   GLN  68          2HG       GLN  68 -29.040  -2.712  -1.580
  559   2HG   GLN  68          1HG       GLN  68 -28.056  -1.621  -0.607
  560   1HE2  GLN  68          1HE2      GLN  68 -27.173  -3.710  -3.415
  561   2HE2  GLN  68          2HE2      GLN  68 -26.545  -2.439  -4.348
  562    H    GLU  69           H        GLU  69 -25.443  -2.984   1.849
  563    HA   GLU  69           HA       GLU  69 -25.451   0.002   1.695
  564   1HB   GLU  69          2HB       GLU  69 -27.232  -1.407   3.067
  565   2HB   GLU  69          1HB       GLU  69 -25.935  -1.467   4.260
  566   1HG   GLU  69          2HG       GLU  69 -26.192   0.712   4.807
  567   2HG   GLU  69          1HG       GLU  69 -26.314   1.206   3.117
  568    H    GLU  70           H        GLU  70 -23.642   1.068   2.507
  569    HA   GLU  70           HA       GLU  70 -21.398  -0.644   3.389
  570   1HB   GLU  70          2HB       GLU  70 -21.565   2.287   2.639
  571   2HB   GLU  70          1HB       GLU  70 -20.084   1.498   3.182
  572   1HG   GLU  70          2HG       GLU  70 -19.780   0.437   1.198
  573   2HG   GLU  70          1HG       GLU  70 -21.494   0.055   1.034
  574    HA   PRO  71           HA       PRO  71 -22.089   0.508   7.604
  575   1HB   PRO  71          2HB       PRO  71 -19.724  -0.484   8.595
  576   2HB   PRO  71          1HB       PRO  71 -21.110  -1.502   8.167
  577   1HG   PRO  71          2HG       PRO  71 -18.536  -1.131   6.711
  578   2HG   PRO  71          1HG       PRO  71 -19.649  -2.510   6.691
  579   1HD   PRO  71          2HD       PRO  71 -19.427  -0.515   4.685
  580   2HD   PRO  71          1HD       PRO  71 -20.725  -1.721   4.830
  581    H    GLY  72           H        GLY  72 -19.712   1.798   5.559
  582   1HA   GLY  72          2HA       GLY  72 -19.316   4.088   7.381
  583   2HA   GLY  72          1HA       GLY  72 -17.854   3.220   6.899
  584    H    LYS  73           H        LYS  73 -16.971   4.844   5.576
  585    HA   LYS  73           HA       LYS  73 -18.417   5.274   3.014
  586   1HB   LYS  73          2HB       LYS  73 -17.605   7.705   3.117
  587   2HB   LYS  73          1HB       LYS  73 -18.957   7.287   4.169
  588   1HG   LYS  73          2HG       LYS  73 -17.239   6.840   5.995
  589   2HG   LYS  73          1HG       LYS  73 -16.047   7.594   4.935
  590   1HD   LYS  73          2HD       LYS  73 -16.752   9.429   6.184
  591   2HD   LYS  73          1HD       LYS  73 -17.836   9.528   4.798
  592   1HE   LYS  73          2HE       LYS  73 -19.672   8.861   6.007
  593   2HE   LYS  73          1HE       LYS  73 -18.722   7.828   7.076
  594   1HZ   LYS  73          1HZ       LYS  73 -18.512   9.465   8.539
  595   2HZ   LYS  73          2HZ       LYS  73 -19.670  10.333   7.647
  596   3HZ   LYS  73          3HZ       LYS  73 -18.014  10.572   7.355
  597    H    GLY  74           H        GLY  74 -16.236   3.530   3.558
  598   1HA   GLY  74          2HA       GLY  74 -14.051   4.926   2.065
  599   2HA   GLY  74          1HA       GLY  74 -13.711   3.748   3.332
  600    H    SER  75           H        SER  75 -12.709   3.357   0.757
  601    HA   SER  75           HA       SER  75 -14.448   1.154  -0.283
  602   1HB   SER  75          2HB       SER  75 -12.623   3.105  -1.657
  603   2HB   SER  75          1HB       SER  75 -12.928   1.533  -2.389
  604    HG   SER  75           HG       SER  75 -15.181   2.022  -2.203
  605    H    PHE  76           H        PHE  76 -13.104  -0.647  -1.331
  606    HA   PHE  76           HA       PHE  76 -10.488  -0.979   0.065
  607   1HB   PHE  76          2HB       PHE  76 -12.723  -2.313   0.893
  608   2HB   PHE  76          1HB       PHE  76 -12.072  -3.446  -0.292
  609    HD1  PHE  76           HD1      PHE  76  -9.169  -2.936  -0.074
  610    HD2  PHE  76           HD2      PHE  76 -12.165  -3.262   2.987
  611    HE1  PHE  76           HE1      PHE  76  -7.433  -3.646   1.550
  612    HE2  PHE  76           HE2      PHE  76 -10.430  -3.974   4.610
  613    HZ   PHE  76           HZ       PHE  76  -8.064  -4.165   3.891
  614    H    TRP  77           H        TRP  77  -9.051  -1.067  -1.562
  615    HA   TRP  77           HA       TRP  77  -9.754  -2.056  -4.217
  616   1HB   TRP  77          2HB       TRP  77  -7.330  -0.884  -2.909
  617   2HB   TRP  77          1HB       TRP  77  -7.113  -1.805  -4.396
  618    HD1  TRP  77           HD1      TRP  77  -8.690   1.381  -3.037
  619    HE1  TRP  77           HE1      TRP  77  -9.334   2.899  -5.017
  620    HE3  TRP  77           HE3      TRP  77  -7.808  -1.816  -6.920
  621    HZ2  TRP  77           HZ2      TRP  77  -9.454   2.775  -7.870
  622    HZ3  TRP  77           HZ3      TRP  77  -8.195  -1.091  -9.258
  623    HH2  TRP  77           HH2      TRP  77  -9.016   1.199  -9.734
  624    H    ARG  78           H        ARG  78  -8.480  -3.821  -5.246
  625    HA   ARG  78           HA       ARG  78  -7.094  -5.729  -3.520
  626   1HB   ARG  78          2HB       ARG  78  -9.888  -5.990  -3.756
  627   2HB   ARG  78          1HB       ARG  78  -9.203  -7.192  -4.852
  628   1HG   ARG  78          2HG       ARG  78  -7.615  -7.318  -2.539
  629   2HG   ARG  78          1HG       ARG  78  -9.278  -7.211  -1.958
  630   1HD   ARG  78          2HD       ARG  78  -9.471  -8.983  -4.080
  631   2HD   ARG  78          1HD       ARG  78  -7.931  -9.415  -3.338
  632    HE   ARG  78           HE       ARG  78  -9.105 -10.063  -1.356
  633   1HH1  ARG  78          1HH1      ARG  78 -11.063 -11.307  -3.148
  634   2HH1  ARG  78          2HH1      ARG  78 -12.564 -10.597  -2.656
  635   1HH2  ARG  78          1HH2      ARG  78 -11.070  -7.968  -0.958
  636   2HH2  ARG  78          2HH2      ARG  78 -12.568  -8.707  -1.417
  637    H    ILE  79           H        ILE  79  -5.550  -6.656  -4.803
  638    HA   ILE  79           HA       ILE  79  -5.690  -6.206  -7.692
  639    HB   ILE  79           HB       ILE  79  -3.442  -6.808  -7.775
  640   1HG1  ILE  79          2HG1      ILE  79  -4.019  -8.542  -5.351
  641   2HG1  ILE  79          1HG1      ILE  79  -3.533  -9.073  -6.963
  642   1HG2  ILE  79          1HG2      ILE  79  -3.913  -4.907  -6.176
  643   2HG2  ILE  79          2HG2      ILE  79  -2.374  -5.726  -5.915
  644   3HG2  ILE  79          3HG2      ILE  79  -3.743  -6.064  -4.857
  645   1HD1  ILE  79          1HD1      ILE  79  -1.881  -7.938  -4.768
  646   2HD1  ILE  79          2HD1      ILE  79  -1.480  -7.402  -6.399
  647   3HD1  ILE  79          3HD1      ILE  79  -1.450  -9.119  -6.002
  648    H    ASP  80           H        ASP  80  -5.756  -7.898  -9.272
  649    HA   ASP  80           HA       ASP  80  -7.633  -9.942  -8.744
  650   1HB   ASP  80          2HB       ASP  80  -5.739  -9.353 -10.978
  651   2HB   ASP  80          1HB       ASP  80  -6.501 -10.943 -10.932
  652    HA   PRO  81           HA       PRO  81  -5.266 -13.189  -7.031
  653   1HB   PRO  81          2HB       PRO  81  -6.766 -15.323  -7.899
  654   2HB   PRO  81          1HB       PRO  81  -7.283 -14.224  -6.609
  655   1HG   PRO  81          2HG       PRO  81  -8.267 -14.414  -9.412
  656   2HG   PRO  81          1HG       PRO  81  -9.090 -13.785  -7.975
  657   1HD   PRO  81          2HD       PRO  81  -7.852 -12.245 -10.026
  658   2HD   PRO  81          1HD       PRO  81  -8.466 -11.631  -8.474
  659    H    ALA  82           H        ALA  82  -6.258 -13.860 -10.415
  660    HA   ALA  82           HA       ALA  82  -3.825 -15.487 -10.807
  661   1HB   ALA  82          1HB       ALA  82  -4.848 -15.554 -13.227
  662   2HB   ALA  82          2HB       ALA  82  -6.285 -14.906 -12.437
  663   3HB   ALA  82          3HB       ALA  82  -5.629 -16.464 -11.934
  664    H    SER  83           H        SER  83  -4.403 -12.255 -10.769
  665    HA   SER  83           HA       SER  83  -2.654 -11.683 -13.108
  666   1HB   SER  83          2HB       SER  83  -3.926  -9.637 -11.284
  667   2HB   SER  83          1HB       SER  83  -3.333  -9.406 -12.927
  668    HG   SER  83           HG       SER  83  -5.054 -10.526 -13.704
  669    H    GLU  84           H        GLU  84  -2.442 -12.377  -9.853
  670    HA   GLU  84           HA       GLU  84  -0.587 -10.493  -8.856
  671   1HB   GLU  84          2HB       GLU  84  -1.164 -13.380  -8.235
  672   2HB   GLU  84          1HB       GLU  84   0.172 -12.548  -7.437
  673   1HG   GLU  84          2HG       GLU  84  -1.557 -10.705  -6.909
  674   2HG   GLU  84          1HG       GLU  84  -2.773 -11.910  -7.326
  675    H    ALA  85           H        ALA  85   0.331 -13.813  -9.869
  676    HA   ALA  85           HA       ALA  85   3.053 -13.510 -10.001
  677   1HB   ALA  85          1HB       ALA  85   2.602 -14.890 -12.352
  678   2HB   ALA  85          2HB       ALA  85   1.098 -15.141 -11.468
  679   3HB   ALA  85          3HB       ALA  85   2.636 -15.610 -10.743
  680    H    LYS  86           H        LYS  86   0.759 -11.965 -12.160
  681    HA   LYS  86           HA       LYS  86   2.846 -11.175 -14.072
  682   1HB   LYS  86          2HB       LYS  86   0.449 -11.610 -14.726
  683   2HB   LYS  86          1HB       LYS  86   0.005 -10.147 -13.846
  684   1HG   LYS  86          2HG       LYS  86   1.870  -9.021 -15.304
  685   2HG   LYS  86          1HG       LYS  86   1.639 -10.419 -16.355
  686   1HD   LYS  86          2HD       LYS  86   0.074  -8.954 -17.250
  687   2HD   LYS  86          1HD       LYS  86  -0.921  -9.809 -16.070
  688   1HE   LYS  86          2HE       LYS  86  -1.420  -7.619 -15.502
  689   2HE   LYS  86          1HE       LYS  86  -0.036  -7.903 -14.447
  690   1HZ   LYS  86          1HZ       LYS  86   1.390  -6.963 -16.202
  691   2HZ   LYS  86          2HZ       LYS  86   0.261  -5.842 -15.604
  692   3HZ   LYS  86          3HZ       LYS  86   0.007  -6.588 -17.109
  693    H    LEU  87           H        LEU  87   0.900  -9.592 -11.558
  694    HA   LEU  87           HA       LEU  87   2.172  -7.026 -11.974
  695   1HB   LEU  87          2HB       LEU  87   1.102  -6.590  -9.599
  696   2HB   LEU  87          1HB       LEU  87   0.103  -6.651 -11.030
  697    HG   LEU  87           HG       LEU  87   0.314  -9.319 -10.069
  698   1HD1  LEU  87          1HD1      LEU  87  -0.764  -8.951  -7.818
  699   2HD1  LEU  87          2HD1      LEU  87  -0.255  -7.267  -7.934
  700   3HD1  LEU  87          3HD1      LEU  87   0.951  -8.553  -7.894
  701   1HD2  LEU  87          1HD2      LEU  87  -1.580  -8.182 -11.288
  702   2HD2  LEU  87          2HD2      LEU  87  -1.971  -7.356  -9.779
  703   3HD2  LEU  87          3HD2      LEU  87  -2.091  -9.113  -9.880
  704    H    VAL  88           H        VAL  88   2.257  -9.288  -9.271
  705    HA   VAL  88           HA       VAL  88   4.260  -8.076  -7.755
  706    HB   VAL  88           HB       VAL  88   4.716 -10.434  -7.004
  707   1HG1  VAL  88          1HG1      VAL  88   1.841 -10.443  -6.855
  708   2HG1  VAL  88          2HG1      VAL  88   2.433  -8.790  -6.689
  709   3HG1  VAL  88          3HG1      VAL  88   3.000 -10.046  -5.587
  710   1HG2  VAL  88          1HG2      VAL  88   2.429 -11.587  -8.272
  711   2HG2  VAL  88          2HG2      VAL  88   4.108 -12.122  -8.357
  712   3HG2  VAL  88          3HG2      VAL  88   3.499 -10.942  -9.514
  713    H    GLU  89           H        GLU  89   4.649 -10.074 -10.662
  714    HA   GLU  89           HA       GLU  89   7.363 -10.774 -10.363
  715   1HB   GLU  89          2HB       GLU  89   7.469 -10.879 -12.831
  716   2HB   GLU  89          1HB       GLU  89   5.994 -11.625 -12.221
  717   1HG   GLU  89          2HG       GLU  89   4.813 -10.255 -13.552
  718   2HG   GLU  89          1HG       GLU  89   5.375  -8.897 -12.580
  719    H    GLN  90           H        GLN  90   5.925  -7.703 -11.283
  720    HA   GLN  90           HA       GLN  90   8.587  -6.537 -11.829
  721   1HB   GLN  90          2HB       GLN  90   5.832  -5.259 -11.799
  722   2HB   GLN  90          1HB       GLN  90   7.318  -4.479 -12.339
  723   1HG   GLN  90          2HG       GLN  90   7.038  -7.021 -13.664
  724   2HG   GLN  90          1HG       GLN  90   5.561  -6.079 -13.879
  725   1HE2  GLN  90          1HE2      GLN  90   5.850  -3.820 -14.765
  726   2HE2  GLN  90          2HE2      GLN  90   7.180  -3.494 -15.768
  727    H    ALA  91           H        ALA  91   6.300  -6.921  -9.287
  728    HA   ALA  91           HA       ALA  91   6.809  -4.686  -7.652
  729   1HB   ALA  91          1HB       ALA  91   6.106  -6.093  -5.775
  730   2HB   ALA  91          2HB       ALA  91   6.324  -7.536  -6.766
  731   3HB   ALA  91          3HB       ALA  91   5.068  -6.368  -7.174
  732    H    PHE  92           H        PHE  92   8.575  -7.778  -7.851
  733    HA   PHE  92           HA       PHE  92  10.554  -6.867  -5.886
  734   1HB   PHE  92          2HB       PHE  92  10.853  -9.251  -7.715
  735   2HB   PHE  92          1HB       PHE  92  11.522  -9.018  -6.100
  736    HD1  PHE  92           HD1      PHE  92   8.871 -10.467  -7.964
  737    HD2  PHE  92           HD2      PHE  92   9.761  -8.651  -4.175
  738    HE1  PHE  92           HE1      PHE  92   6.864 -11.539  -6.978
  739    HE2  PHE  92           HE2      PHE  92   7.755  -9.724  -3.188
  740    HZ   PHE  92           HZ       PHE  92   6.306 -11.168  -4.590
  741    H    ARG  93           H        ARG  93  11.066  -4.885  -7.215
  742    HA   ARG  93           HA       ARG  93  13.552  -5.203  -8.584
  743   1HB   ARG  93          2HB       ARG  93  11.659  -6.022 -10.265
  744   2HB   ARG  93          1HB       ARG  93  11.473  -4.289 -10.533
  745   1HG   ARG  93          2HG       ARG  93  13.347  -4.221 -11.774
  746   2HG   ARG  93          1HG       ARG  93  14.276  -4.989 -10.486
  747   1HD   ARG  93          2HD       ARG  93  14.043  -7.089 -11.381
  748   2HD   ARG  93          1HD       ARG  93  12.438  -6.748 -12.028
  749    HE   ARG  93           HE       ARG  93  14.245  -5.173 -13.510
  750   1HH1  ARG  93          1HH1      ARG  93  13.144  -8.390 -13.059
  751   2HH1  ARG  93          2HH1      ARG  93  13.925  -9.007 -14.476
  752   1HH2  ARG  93          1HH2      ARG  93  15.467  -6.002 -15.258
  753   2HH2  ARG  93          2HH2      ARG  93  15.239  -7.655 -15.721
  754    H    LYS  94           H        LYS  94  14.525  -3.314  -8.057
  755    HA   LYS  94           HA       LYS  94  12.903  -0.948  -7.424
  756   1HB   LYS  94          2HB       LYS  94  15.922  -1.242  -7.479
  757   2HB   LYS  94          1HB       LYS  94  15.002   0.038  -6.687
  758   1HG   LYS  94          2HG       LYS  94  14.267  -1.356  -4.980
  759   2HG   LYS  94          1HG       LYS  94  14.428  -2.813  -5.962
  760   1HD   LYS  94          2HD       LYS  94  16.809  -1.177  -5.062
  761   2HD   LYS  94          1HD       LYS  94  16.176  -2.535  -4.131
  762   1HE   LYS  94          2HE       LYS  94  16.674  -4.090  -5.853
  763   2HE   LYS  94          1HE       LYS  94  16.896  -2.815  -7.051
  764   1HZ   LYS  94          1HZ       LYS  94  18.833  -2.053  -5.797
  765   2HZ   LYS  94          2HZ       LYS  94  19.018  -3.657  -6.324
  766   3HZ   LYS  94          3HZ       LYS  94  18.636  -3.332  -4.701
  767    H    ARG  95           H        ARG  95  12.456   0.636  -8.883
  768    HA   ARG  95           HA       ARG  95  13.822   0.549 -11.513
  769   1HB   ARG  95          2HB       ARG  95  11.195   0.902 -10.873
  770   2HB   ARG  95          1HB       ARG  95  11.722   2.579 -11.026
  771   1HG   ARG  95          2HG       ARG  95  11.734   2.403 -13.267
  772   2HG   ARG  95          1HG       ARG  95  12.860   1.048 -13.175
  773   1HD   ARG  95          2HD       ARG  95   9.952   0.590 -12.580
  774   2HD   ARG  95          1HD       ARG  95  10.489   0.693 -14.256
  775    HE   ARG  95           HE       ARG  95  11.692  -1.267 -12.342
  776   1HH1  ARG  95          1HH2      ARG  95   9.333  -1.139 -14.667
  777   2HH1  ARG  95          2HH2      ARG  95  10.028  -2.327 -15.719
  778   1HH2  ARG  95          1HH1      ARG  95  13.037  -2.475 -14.001
  779   2HH2  ARG  95          2HH1      ARG  95  12.123  -3.084 -15.341
  780    H    ARG  96           H        ARG  96  15.537   1.874 -11.845
  781    HA   ARG  96           HA       ARG  96  16.134   4.032  -9.964
  782   1HB   ARG  96          2HB       ARG  96  17.516   2.657 -12.189
  783   2HB   ARG  96          1HB       ARG  96  17.926   4.363 -12.000
  784   1HG   ARG  96          2HG       ARG  96  18.118   3.731  -9.448
  785   2HG   ARG  96          1HG       ARG  96  18.327   2.094 -10.074
  786   1HD   ARG  96          2HD       ARG  96  20.065   3.232 -11.685
  787   2HD   ARG  96          1HD       ARG  96  20.077   4.506 -10.465
  788    HE   ARG  96           HE       ARG  96  20.925   1.685 -10.004
  789   1HH1  ARG  96          1HH1      ARG  96  22.712   4.177  -9.871
  790   2HH1  ARG  96          2HH1      ARG  96  22.857   4.379  -8.158
  791   1HH2  ARG  96          1HH2      ARG  96  20.201   2.279  -7.416
  792   2HH2  ARG  96          2HH2      ARG  96  21.437   3.306  -6.768
  793    H    GLN  97           H        GLN  97  16.983   6.167 -11.236
  794    HA   GLN  97           HA       GLN  97  14.562   7.264 -12.486
  795   1HB   GLN  97          2HB       GLN  97  16.434   8.361 -10.849
  796   2HB   GLN  97          1HB       GLN  97  17.040   8.891 -12.418
  797   1HG   GLN  97          2HG       GLN  97  15.536  10.579 -12.190
  798   2HG   GLN  97          1HG       GLN  97  14.354   9.366 -12.684
  799   1HE2  GLN  97          1HE2      GLN  97  13.332   8.083 -10.821
  800   2HE2  GLN  97          2HE2      GLN  97  13.093   8.886  -9.345
  801    H    ARG  98           H        ARG  98  14.246   7.152 -14.653
  802    HA   ARG  98           HA       ARG  98  16.659   7.195 -16.418
  803   1HB   ARG  98          2HB       ARG  98  15.611   4.922 -16.303
  804   2HB   ARG  98          1HB       ARG  98  14.113   5.624 -16.915
  805   1HG   ARG  98          2HG       ARG  98  15.113   6.202 -18.998
  806   2HG   ARG  98          1HG       ARG  98  16.740   5.922 -18.378
  807   1HD   ARG  98          2HD       ARG  98  14.904   3.605 -18.201
  808   2HD   ARG  98          1HD       ARG  98  15.351   4.090 -19.836
  809    HE   ARG  98           HE       ARG  98  17.743   4.024 -18.354
  810   1HH1  ARG  98          1HH1      ARG  98  16.284   2.256 -20.652
  811   2HH1  ARG  98          2HH1      ARG  98  16.806   0.696 -20.110
  812   1HH2  ARG  98          1HH2      ARG  98  17.962   1.855 -17.052
  813   2HH2  ARG  98          2HH2      ARG  98  17.756   0.469 -18.070
  814    H    GLY  99           H        GLY  99  15.407   9.553 -15.776
  815   1HA   GLY  99          2HA       GLY  99  13.986  10.196 -18.323
  816   2HA   GLY  99          1HA       GLY  99  13.378  10.808 -16.784
  817    H    VAL 100           H        VAL 100  13.899  12.792 -18.424
  818    HA   VAL 100           HA       VAL 100  16.606  13.783 -17.617
  819    HB   VAL 100           HB       VAL 100  15.159  14.639 -20.131
  820   1HG1  VAL 100          1HG1      VAL 100  16.945  16.107 -19.275
  821   2HG1  VAL 100          2HG1      VAL 100  17.438  15.338 -20.784
  822   3HG1  VAL 100          3HG1      VAL 100  18.061  14.740 -19.246
  823   1HG2  VAL 100          1HG2      VAL 100  16.187  12.948 -21.371
  824   2HG2  VAL 100          2HG2      VAL 100  15.781  12.086 -19.886
  825   3HG2  VAL 100          3HG2      VAL 100  17.426  12.666 -20.147
  826    H    SER 101           HN       SER 101  14.707  14.301 -15.831
  827    HA   SER 101           HA       SER 101  13.698  17.041 -16.487
  828   1HB   SER 101          2HB       SER 101  12.511  14.750 -15.087
  829   2HB   SER 101          1HB       SER 101  12.385  16.256 -14.184
  830    HG   SER 101           HG       SER 101  11.612  15.817 -16.885
  Start of MODEL   13
    1   1H    GLU   1          1HT       GLU   1  16.022  11.498 -11.719
    2   2H    GLU   1          2HT       GLU   1  15.553  11.828 -10.120
    3   3H    GLU   1          3HT       GLU   1  14.521  12.225 -11.409
    4    HA   GLU   1           HA       GLU   1  13.510  10.295 -10.988
    5   1HB   GLU   1          2HB       GLU   1  15.383   9.975 -12.950
    6   2HB   GLU   1          1HB       GLU   1  15.839   8.681 -11.842
    7   1HG   GLU   1          2HG       GLU   1  14.240   7.651 -13.226
    8   2HG   GLU   1          1HG       GLU   1  13.297   8.121 -11.811
    9    H    SER   2           H        SER   2  13.395  10.170  -8.703
   10    HA   SER   2           HA       SER   2  15.612   8.677  -7.370
   11   1HB   SER   2          2HB       SER   2  13.425  10.364  -6.120
   12   2HB   SER   2          1HB       SER   2  14.772   9.613  -5.269
   13    HG   SER   2           HG       SER   2  16.080  11.107  -6.019
   14    H    LYS   3           H        LYS   3  12.884   7.908  -8.872
   15    HA   LYS   3           HA       LYS   3  12.218   5.784  -6.879
   16   1HB   LYS   3          2HB       LYS   3  10.428   7.442  -6.791
   17   2HB   LYS   3          1HB       LYS   3  10.267   7.401  -8.546
   18   1HG   LYS   3          2HG       LYS   3  10.069   4.722  -7.767
   19   2HG   LYS   3          1HG       LYS   3   9.137   5.604  -6.556
   20   1HD   LYS   3          2HD       LYS   3   8.782   5.683  -9.563
   21   2HD   LYS   3          1HD       LYS   3   7.632   5.089  -8.364
   22   1HE   LYS   3          2HE       LYS   3   6.737   7.170  -8.452
   23   2HE   LYS   3          1HE       LYS   3   8.130   7.658  -7.486
   24   1HZ   LYS   3          1HZ       LYS   3   7.498   8.607  -9.951
   25   2HZ   LYS   3          2HZ       LYS   3   8.715   7.470 -10.286
   26   3HZ   LYS   3          3HZ       LYS   3   9.013   8.742  -9.200
   27    HA   PRO   4           HA       PRO   4  13.054   4.289 -11.247
   28   1HB   PRO   4          2HB       PRO   4  15.392   2.946 -10.690
   29   2HB   PRO   4          1HB       PRO   4  15.304   4.611 -11.285
   30   1HG   PRO   4          2HG       PRO   4  15.908   3.631  -8.534
   31   2HG   PRO   4          1HG       PRO   4  16.415   5.129  -9.329
   32   1HD   PRO   4          2HD       PRO   4  14.345   4.919  -7.428
   33   2HD   PRO   4          1HD       PRO   4  14.613   6.290  -8.525
   34    HA   PRO   5           HA       PRO   5  12.966  -0.069  -9.208
   35   1HB   PRO   5          2HB       PRO   5  12.249  -0.169  -6.559
   36   2HB   PRO   5          1HB       PRO   5  13.929  -0.131  -7.124
   37   1HG   PRO   5          2HG       PRO   5  12.306   2.054  -5.896
   38   2HG   PRO   5          1HG       PRO   5  14.059   1.797  -5.854
   39   1HD   PRO   5          2HD       PRO   5  12.726   3.642  -7.508
   40   2HD   PRO   5          1HD       PRO   5  14.392   3.069  -7.720
   41    H    TYR   6           H        TYR   6  10.707   2.101  -7.444
   42    HA   TYR   6           HA       TYR   6   8.480   0.328  -8.328
   43   1HB   TYR   6          2HB       TYR   6   8.301   2.548  -6.300
   44   2HB   TYR   6          1HB       TYR   6   7.228   1.160  -6.504
   45    HD1  TYR   6           HD1      TYR   6   9.550  -0.832  -7.071
   46    HD2  TYR   6           HD2      TYR   6   8.838   2.058  -3.977
   47    HE1  TYR   6           HE1      TYR   6  10.963  -2.152  -5.514
   48    HE2  TYR   6           HE2      TYR   6  10.251   0.740  -2.418
   49    HH   TYR   6           HH       TYR   6  12.116  -0.929  -2.594
   50    H    SER   7           H        SER   7   6.466   1.385  -8.967
   51    HA   SER   7           HA       SER   7   6.838   4.072 -10.193
   52   1HB   SER   7          2HB       SER   7   6.851   1.660 -11.612
   53   2HB   SER   7          1HB       SER   7   5.222   2.299 -11.840
   54    HG   SER   7           HG       SER   7   6.061   4.124 -12.718
   55    H    TYR   8           H        TYR   8   4.274   4.141 -11.412
   56    HA   TYR   8           HA       TYR   8   2.598   4.174  -8.956
   57   1HB   TYR   8          2HB       TYR   8   2.539   5.680 -11.551
   58   2HB   TYR   8          1HB       TYR   8   1.075   5.557 -10.575
   59    HD1  TYR   8           HD1      TYR   8   4.082   5.319  -8.621
   60    HD2  TYR   8           HD2      TYR   8   1.386   8.128 -10.440
   61    HE1  TYR   8           HE1      TYR   8   4.926   7.095  -7.122
   62    HE2  TYR   8           HE2      TYR   8   2.232   9.905  -8.938
   63    HH   TYR   8           HH       TYR   8   4.741  10.135  -7.592
   64    H    ALA   9           H        ALA   9   2.844   1.688  -9.691
   65    HA   ALA   9           HA       ALA   9   0.218   0.762 -10.229
   66   1HB   ALA   9          1HB       ALA   9   0.087   0.562 -12.470
   67   2HB   ALA   9          2HB       ALA   9   1.658  -0.236 -12.537
   68   3HB   ALA   9          3HB       ALA   9   1.561   1.524 -12.584
   69    H    GLN  10           H        GLN  10   3.674   0.140 -10.499
   70    HA   GLN  10           HA       GLN  10   3.334  -2.708  -9.724
   71   1HB   GLN  10          2HB       GLN  10   5.055  -2.157 -11.416
   72   2HB   GLN  10          1HB       GLN  10   5.823  -1.046 -10.281
   73   1HG   GLN  10          2HG       GLN  10   5.553  -3.468  -8.879
   74   2HG   GLN  10          1HG       GLN  10   6.110  -3.920 -10.490
   75   1HE2  GLN  10          1HE2      GLN  10   8.146  -2.855 -11.270
   76   2HE2  GLN  10          2HE2      GLN  10   9.276  -2.288 -10.138
   77    H    LEU  11           H        LEU  11   4.145   0.426  -8.515
   78    HA   LEU  11           HA       LEU  11   5.383  -0.288  -6.036
   79   1HB   LEU  11          2HB       LEU  11   5.447   1.989  -6.908
   80   2HB   LEU  11          1HB       LEU  11   3.687   2.079  -6.898
   81    HG   LEU  11           HG       LEU  11   4.441   1.356  -4.278
   82   1HD1  LEU  11          1HD1      LEU  11   6.052   3.671  -5.386
   83   2HD1  LEU  11          2HD1      LEU  11   6.721   2.119  -4.882
   84   3HD1  LEU  11          3HD1      LEU  11   5.976   3.188  -3.693
   85   1HD2  LEU  11          1HD2      LEU  11   2.825   2.902  -3.978
   86   2HD2  LEU  11          2HD2      LEU  11   2.910   3.294  -5.696
   87   3HD2  LEU  11          3HD2      LEU  11   3.917   4.167  -4.542
   88    H    ILE  12           H        ILE  12   2.080   0.108  -7.142
   89    HA   ILE  12           HA       ILE  12   0.743  -0.250  -4.615
   90    HB   ILE  12           HB       ILE  12  -0.435  -1.212  -7.192
   91   1HG1  ILE  12          2HG1      ILE  12   0.413   0.761  -8.110
   92   2HG1  ILE  12          1HG1      ILE  12  -1.112   1.330  -7.453
   93   1HG2  ILE  12          1HG2      ILE  12  -2.380  -0.937  -6.106
   94   2HG2  ILE  12          2HG2      ILE  12  -1.908   0.644  -5.483
   95   3HG2  ILE  12          3HG2      ILE  12  -1.389  -0.824  -4.652
   96   1HD1  ILE  12          1HD1      ILE  12   0.481   1.643  -5.287
   97   2HD1  ILE  12          2HD1      ILE  12   0.221   2.910  -6.485
   98   3HD1  ILE  12          3HD1      ILE  12   1.658   1.896  -6.571
   99    H    VAL  13           H        VAL  13   1.522  -2.479  -7.274
  100    HA   VAL  13           HA       VAL  13   0.396  -4.828  -6.277
  101    HB   VAL  13           HB       VAL  13   3.022  -4.488  -7.745
  102   1HG1  VAL  13          1HG1      VAL  13   2.363  -6.845  -8.554
  103   2HG1  VAL  13          2HG1      VAL  13   1.266  -6.877  -7.174
  104   3HG1  VAL  13          3HG1      VAL  13   3.003  -6.711  -6.916
  105   1HG2  VAL  13          1HG2      VAL  13   1.218  -3.467  -8.962
  106   2HG2  VAL  13          2HG2      VAL  13   0.141  -4.815  -8.614
  107   3HG2  VAL  13          3HG2      VAL  13   1.503  -5.038  -9.709
  108    H    GLN  14           H        GLN  14   3.311  -3.179  -5.198
  109    HA   GLN  14           HA       GLN  14   4.231  -5.429  -3.576
  110   1HB   GLN  14          2HB       GLN  14   5.089  -2.669  -4.126
  111   2HB   GLN  14          1HB       GLN  14   5.333  -3.155  -2.448
  112   1HG   GLN  14          2HG       GLN  14   6.890  -4.749  -2.990
  113   2HG   GLN  14          1HG       GLN  14   6.117  -5.129  -4.530
  114   1HE2  GLN  14          1HE2      GLN  14   6.688  -1.753  -3.817
  115   2HE2  GLN  14          2HE2      GLN  14   7.993  -1.549  -4.878
  116    H    ALA  15           H        ALA  15   2.270  -2.550  -3.165
  117    HA   ALA  15           HA       ALA  15   1.984  -2.616  -0.335
  118   1HB   ALA  15          1HB       ALA  15  -0.003  -1.216  -0.710
  119   2HB   ALA  15          2HB       ALA  15   0.013  -1.641  -2.422
  120   3HB   ALA  15          3HB       ALA  15   1.333  -0.693  -1.736
  121    H    ILE  16           H        ILE  16  -0.492  -3.706  -2.747
  122    HA   ILE  16           HA       ILE  16  -1.917  -5.144  -0.677
  123    HB   ILE  16           HB       ILE  16  -2.967  -6.327  -2.753
  124   1HG1  ILE  16          2HG1      ILE  16  -2.802  -5.084  -4.790
  125   2HG1  ILE  16          1HG1      ILE  16  -1.737  -3.897  -4.068
  126   1HG2  ILE  16          1HG2      ILE  16  -3.230  -3.459  -1.893
  127   2HG2  ILE  16          2HG2      ILE  16  -4.313  -4.813  -1.570
  128   3HG2  ILE  16          3HG2      ILE  16  -4.253  -4.095  -3.180
  129   1HD1  ILE  16          1HD1      ILE  16  -0.833  -5.965  -5.518
  130   2HD1  ILE  16          2HD1      ILE  16  -0.901  -6.753  -3.946
  131   3HD1  ILE  16          3HD1      ILE  16   0.074  -5.300  -4.165
  132    H    SER  17           H        SER  17   0.782  -5.947  -2.652
  133    HA   SER  17           HA       SER  17   0.518  -8.799  -2.646
  134   1HB   SER  17          2HB       SER  17   2.826  -6.896  -2.911
  135   2HB   SER  17          1HB       SER  17   3.168  -8.594  -2.597
  136    HG   SER  17           HG       SER  17   2.922  -7.827  -4.883
  137    H    SER  18           H        SER  18   1.014  -6.509  -0.188
  138    HA   SER  18           HA       SER  18   2.037  -8.600   1.680
  139   1HB   SER  18          2HB       SER  18   2.811  -6.796   3.083
  140   2HB   SER  18          1HB       SER  18   3.346  -6.449   1.441
  141    HG   SER  18           HG       SER  18   1.092  -5.384   2.804
  142    H    ALA  19           H        ALA  19  -0.746  -6.843   0.753
  143    HA   ALA  19           HA       ALA  19  -2.060  -6.484   3.255
  144   1HB   ALA  19          1HB       ALA  19  -3.308  -5.500   1.599
  145   2HB   ALA  19          2HB       ALA  19  -4.143  -7.053   1.630
  146   3HB   ALA  19          3HB       ALA  19  -2.904  -6.744   0.415
  147    H    GLN  20           H        GLN  20  -3.657  -7.857   4.294
  148    HA   GLN  20           HA       GLN  20  -2.950 -10.447   4.898
  149   1HB   GLN  20          2HB       GLN  20  -5.628  -9.095   4.766
  150   2HB   GLN  20          1HB       GLN  20  -5.548 -10.815   5.147
  151   1HG   GLN  20          2HG       GLN  20  -4.916 -10.357   7.254
  152   2HG   GLN  20          1HG       GLN  20  -3.548  -9.408   6.668
  153   1HE2  GLN  20          1HE2      GLN  20  -6.176  -9.092   8.624
  154   2HE2  GLN  20          2HE2      GLN  20  -6.523  -7.446   8.393
  155    H    ASP  21           H        ASP  21  -5.774 -10.012   2.777
  156    HA   ASP  21           HA       ASP  21  -5.121 -12.548   1.432
  157   1HB   ASP  21          2HB       ASP  21  -7.489 -11.477   2.097
  158   2HB   ASP  21          1HB       ASP  21  -7.337 -10.794   0.478
  159    H    ARG  22           H        ARG  22  -6.135  -9.402   0.083
  160    HA   ARG  22           HA       ARG  22  -3.777  -8.926  -1.440
  161   1HB   ARG  22          2HB       ARG  22  -5.655 -10.881  -2.563
  162   2HB   ARG  22          1HB       ARG  22  -5.314  -9.541  -3.658
  163   1HG   ARG  22          2HG       ARG  22  -3.130 -10.150  -3.933
  164   2HG   ARG  22          1HG       ARG  22  -2.959 -10.670  -2.256
  165   1HD   ARG  22          2HD       ARG  22  -2.876 -12.513  -4.045
  166   2HD   ARG  22          1HD       ARG  22  -3.975 -12.774  -2.691
  167    HE   ARG  22           HE       ARG  22  -4.950 -11.690  -5.303
  168   1HH1  ARG  22          1HH2      ARG  22  -4.679 -14.709  -4.257
  169   2HH1  ARG  22          2HH2      ARG  22  -6.360 -15.035  -3.994
  170   1HH2  ARG  22          1HH1      ARG  22  -7.315 -11.711  -4.246
  171   2HH2  ARG  22          2HH1      ARG  22  -7.852 -13.337  -3.987
  172    H    GLN  23           H        GLN  23  -5.968  -7.571   0.047
  173    HA   GLN  23           HA       GLN  23  -6.680  -5.593  -2.072
  174   1HB   GLN  23          2HB       GLN  23  -8.870  -5.278  -0.799
  175   2HB   GLN  23          1HB       GLN  23  -8.726  -6.782  -1.707
  176   1HG   GLN  23          2HG       GLN  23  -8.121  -8.002   0.304
  177   2HG   GLN  23          1HG       GLN  23  -8.076  -6.508   1.240
  178   1HE2  GLN  23          1HE2      GLN  23  -9.823  -8.610   2.023
  179   2HE2  GLN  23          2HE2      GLN  23 -11.426  -8.125   1.749
  180    H    LEU  24           H        LEU  24  -6.141  -3.537  -1.481
  181    HA   LEU  24           HA       LEU  24  -5.576  -3.040   1.416
  182   1HB   LEU  24          2HB       LEU  24  -4.206  -2.108  -1.096
  183   2HB   LEU  24          1HB       LEU  24  -4.154  -1.106   0.350
  184    HG   LEU  24           HG       LEU  24  -3.301  -4.010   0.221
  185   1HD1  LEU  24          1HD1      LEU  24  -1.028  -2.991   0.648
  186   2HD1  LEU  24          2HD1      LEU  24  -1.743  -1.413   0.318
  187   3HD1  LEU  24          3HD1      LEU  24  -1.693  -2.641  -0.947
  188   1HD2  LEU  24          1HD2      LEU  24  -2.256  -2.873   2.505
  189   2HD2  LEU  24          2HD2      LEU  24  -3.715  -3.863   2.454
  190   3HD2  LEU  24          3HD2      LEU  24  -3.840  -2.105   2.402
  191    H    THR  25           H        THR  25  -6.333  -1.034   2.268
  192    HA   THR  25           HA       THR  25  -8.673   0.044   0.877
  193    HB   THR  25           HB       THR  25  -9.168   1.122   2.881
  194    HG1  THR  25           HG1      THR  25  -6.664   1.115   4.011
  195   1HG2  THR  25          1HG2      THR  25  -7.324  -0.633   4.346
  196   2HG2  THR  25          2HG2      THR  25  -8.241  -1.462   3.088
  197   3HG2  THR  25          3HG2      THR  25  -9.087  -0.588   4.363
  198    H    LEU  26           H        LEU  26  -8.736   2.636   0.845
  199    HA   LEU  26           HA       LEU  26  -6.747   3.452  -1.037
  200   1HB   LEU  26          2HB       LEU  26  -9.108   4.605  -0.027
  201   2HB   LEU  26          1HB       LEU  26  -7.824   5.731   0.412
  202    HG   LEU  26           HG       LEU  26  -7.516   4.680  -2.304
  203   1HD1  LEU  26          1HD1      LEU  26  -9.695   4.802  -2.908
  204   2HD1  LEU  26          2HD1      LEU  26  -9.502   6.550  -2.773
  205   3HD1  LEU  26          3HD1      LEU  26 -10.149   5.627  -1.416
  206   1HD2  LEU  26          1HD2      LEU  26  -7.667   7.348  -2.559
  207   2HD2  LEU  26          2HD2      LEU  26  -6.227   6.557  -1.919
  208   3HD2  LEU  26          3HD2      LEU  26  -7.404   7.270  -0.817
  209    H    SER  27           H        SER  27  -6.999   3.918   2.472
  210    HA   SER  27           HA       SER  27  -4.337   5.226   2.473
  211   1HB   SER  27          2HB       SER  27  -6.574   4.973   4.442
  212   2HB   SER  27          1HB       SER  27  -4.944   5.248   5.049
  213    HG   SER  27           HG       SER  27  -5.176   7.242   4.466
  214    H    GLY  28           H        GLY  28  -4.701   2.333   1.859
  215   1HA   GLY  28          2HA       GLY  28  -3.398   1.100   4.248
  216   2HA   GLY  28          1HA       GLY  28  -4.129   0.199   2.914
  217    H    ILE  29           H        ILE  29  -3.128   1.356   0.749
  218    HA   ILE  29           HA       ILE  29  -0.577   0.266   0.357
  219    HB   ILE  29           HB       ILE  29  -2.071   0.841  -1.452
  220   1HG1  ILE  29          2HG1      ILE  29   0.473   2.463  -1.488
  221   2HG1  ILE  29          1HG1      ILE  29   0.300   0.783  -1.997
  222   1HG2  ILE  29          1HG2      ILE  29  -2.936   2.912  -1.830
  223   2HG2  ILE  29          2HG2      ILE  29  -1.495   3.719  -1.228
  224   3HG2  ILE  29          3HG2      ILE  29  -2.671   3.062  -0.094
  225   1HD1  ILE  29          1HD1      ILE  29  -0.986   1.341  -3.865
  226   2HD1  ILE  29          2HD1      ILE  29   0.215   2.632  -3.807
  227   3HD1  ILE  29          3HD1      ILE  29  -1.416   2.921  -3.215
  228    H    TYR  30           H        TYR  30  -1.565   3.480   1.287
  229    HA   TYR  30           HA       TYR  30   1.021   4.699   1.110
  230   1HB   TYR  30          2HB       TYR  30  -1.220   5.493   2.983
  231   2HB   TYR  30          1HB       TYR  30   0.043   6.533   2.321
  232    HD1  TYR  30           HD1      TYR  30   0.092   5.387  -0.473
  233    HD2  TYR  30           HD2      TYR  30  -3.162   6.565   2.047
  234    HE1  TYR  30           HE1      TYR  30  -1.285   5.812  -2.477
  235    HE2  TYR  30           HE2      TYR  30  -4.555   6.986   0.046
  236    HH   TYR  30           HH       TYR  30  -3.203   6.802  -3.213
  237    H    ALA  31           H        ALA  31  -0.771   3.413   3.931
  238    HA   ALA  31           HA       ALA  31   1.407   3.790   5.767
  239   1HB   ALA  31          1HB       ALA  31  -1.125   2.192   5.753
  240   2HB   ALA  31          2HB       ALA  31  -0.587   3.425   6.893
  241   3HB   ALA  31          3HB       ALA  31   0.102   1.804   6.959
  242    H    HIS  32           H        HIS  32   0.958   1.607   3.187
  243    HA   HIS  32           HA       HIS  32   2.476  -0.612   4.304
  244   1HB   HIS  32          2HB       HIS  32   0.902  -1.070   2.525
  245   2HB   HIS  32          1HB       HIS  32   1.678   0.111   1.473
  246    HD1  HIS  32           HD1      HIS  32   2.130  -3.335   2.896
  247    HD2  HIS  32           HD2      HIS  32   4.122  -0.757   0.295
  248    HE1  HIS  32           HE1      HIS  32   3.931  -4.709   1.766
  249    H    ILE  33           H        ILE  33   3.232   1.515   1.536
  250    HA   ILE  33           HA       ILE  33   6.013   0.916   1.504
  251    HB   ILE  33           HB       ILE  33   6.200   3.025   0.158
  252   1HG1  ILE  33          2HG1      ILE  33   3.683   3.831  -0.359
  253   2HG1  ILE  33          1HG1      ILE  33   3.484   3.353   1.326
  254   1HG2  ILE  33          1HG2      ILE  33   3.797   1.359  -0.633
  255   2HG2  ILE  33          2HG2      ILE  33   5.455   0.771  -0.767
  256   3HG2  ILE  33          3HG2      ILE  33   4.939   2.174  -1.702
  257   1HD1  ILE  33          1HD1      ILE  33   5.916   4.756   1.252
  258   2HD1  ILE  33          2HD1      ILE  33   4.384   5.334   1.909
  259   3HD1  ILE  33          3HD1      ILE  33   4.817   5.691   0.237
  260    H    THR  34           H        THR  34   4.224   3.478   3.204
  261    HA   THR  34           HA       THR  34   6.453   5.027   4.017
  262    HB   THR  34           HB       THR  34   4.914   5.411   6.135
  263    HG1  THR  34           HG1      THR  34   3.267   4.136   6.094
  264   1HG2  THR  34          1HG2      THR  34   5.129   6.542   3.583
  265   2HG2  THR  34          2HG2      THR  34   4.365   7.272   4.995
  266   3HG2  THR  34          3HG2      THR  34   3.396   6.351   3.845
  267    H    LYS  35           H        LYS  35   5.284   1.936   5.158
  268    HA   LYS  35           HA       LYS  35   7.019   1.995   7.536
  269   1HB   LYS  35          2HB       LYS  35   4.719   0.540   6.749
  270   2HB   LYS  35          1HB       LYS  35   6.026  -0.634   6.904
  271   1HG   LYS  35          2HG       LYS  35   6.502   0.797   9.124
  272   2HG   LYS  35          1HG       LYS  35   4.767   1.086   8.986
  273   1HD   LYS  35          2HD       LYS  35   4.324  -0.984   9.749
  274   2HD   LYS  35          1HD       LYS  35   5.309  -1.694   8.470
  275   1HE   LYS  35          2HE       LYS  35   6.719  -2.344  10.111
  276   2HE   LYS  35          1HE       LYS  35   7.195  -0.649  10.216
  277   1HZ   LYS  35          1HZ       LYS  35   4.866  -1.732  11.688
  278   2HZ   LYS  35          2HZ       LYS  35   5.682  -0.264  11.946
  279   3HZ   LYS  35          3HZ       LYS  35   6.430  -1.737  12.343
  280    H    HIS  36           H        HIS  36   7.108   0.809   4.243
  281    HA   HIS  36           HA       HIS  36   9.635  -0.659   4.852
  282   1HB   HIS  36          2HB       HIS  36   7.690  -0.817   2.542
  283   2HB   HIS  36          1HB       HIS  36   9.274  -1.594   2.506
  284    HD1  HIS  36           HD1      HIS  36   9.734  -3.302   4.587
  285    HD2  HIS  36           HD2      HIS  36   5.753  -2.312   3.846
  286    HE1  HIS  36           HE1      HIS  36   8.329  -5.038   5.783
  287    H    TYR  37           H        TYR  37   8.358   1.221   2.077
  288    HA   TYR  37           HA       TYR  37  11.049   2.027   1.311
  289   1HB   TYR  37          2HB       TYR  37   8.429   3.167   0.307
  290   2HB   TYR  37          1HB       TYR  37   9.986   3.165  -0.521
  291    HD1  TYR  37           HD1      TYR  37  10.709   0.288   0.441
  292    HD2  TYR  37           HD2      TYR  37   7.261   1.976  -1.486
  293    HE1  TYR  37           HE1      TYR  37  10.183  -1.925  -0.550
  294    HE2  TYR  37           HE2      TYR  37   6.734  -0.237  -2.479
  295    HH   TYR  37           HH       TYR  37   8.958  -2.876  -2.376
  296    HA   PRO  38           HA       PRO  38  10.832   5.547   4.105
  297   1HB   PRO  38          2HB       PRO  38  13.518   6.098   3.952
  298   2HB   PRO  38          1HB       PRO  38  12.839   4.841   5.000
  299   1HG   PRO  38          2HG       PRO  38  14.347   4.539   2.451
  300   2HG   PRO  38          1HG       PRO  38  14.182   3.402   3.797
  301   1HD   PRO  38          2HD       PRO  38  12.785   3.290   1.328
  302   2HD   PRO  38          1HD       PRO  38  12.432   2.334   2.782
  303    H    TYR  39           H        TYR  39  12.098   5.374   0.846
  304    HA   TYR  39           HA       TYR  39  12.703   8.118   0.403
  305   1HB   TYR  39          2HB       TYR  39  13.398   6.679  -1.322
  306   2HB   TYR  39          1HB       TYR  39  11.849   5.840  -1.377
  307    HD1  TYR  39           HD1      TYR  39  10.007   6.680  -2.676
  308    HD2  TYR  39           HD2      TYR  39  13.625   8.963  -2.297
  309    HE1  TYR  39           HE1      TYR  39   9.241   8.194  -4.485
  310    HE2  TYR  39           HE2      TYR  39  12.860  10.476  -4.107
  311    HH   TYR  39           HH       TYR  39  10.950   9.963  -6.246
  312    H    TYR  40           H        TYR  40   9.675   6.431   0.703
  313    HA   TYR  40           HA       TYR  40   8.123   8.659  -0.443
  314   1HB   TYR  40          2HB       TYR  40   7.558   5.904   0.522
  315   2HB   TYR  40          1HB       TYR  40   6.257   7.080   0.722
  316    HD1  TYR  40           HD1      TYR  40   5.633   8.518  -1.330
  317    HD2  TYR  40           HD2      TYR  40   7.944   4.907  -1.579
  318    HE1  TYR  40           HE1      TYR  40   5.090   8.343  -3.744
  319    HE2  TYR  40           HE2      TYR  40   7.401   4.731  -3.994
  320    HH   TYR  40           HH       TYR  40   6.629   6.830  -5.862
  321    H    ARG  41           H        ARG  41   9.093  10.192   1.198
  322    HA   ARG  41           HA       ARG  41   7.363  10.227   3.617
  323   1HB   ARG  41          2HB       ARG  41   9.575   9.220   4.232
  324   2HB   ARG  41          1HB       ARG  41  10.355  10.712   3.704
  325   1HG   ARG  41          2HG       ARG  41   8.993  11.983   5.346
  326   2HG   ARG  41          1HG       ARG  41   8.282  10.468   5.903
  327   1HD   ARG  41          2HD       ARG  41  10.829   9.762   6.159
  328   2HD   ARG  41          1HD       ARG  41  11.063  11.507   6.275
  329    HE   ARG  41           HE       ARG  41   9.097  11.189   8.082
  330   1HH1  ARG  41          1HH2      ARG  41  12.217  11.014   8.557
  331   2HH1  ARG  41          2HH2      ARG  41  12.251   9.692   9.676
  332   1HH2  ARG  41          1HH1      ARG  41   8.982   8.725   9.041
  333   2HH2  ARG  41          2HH1      ARG  41  10.420   8.396   9.948
  334    H    THR  42           H        THR  42   9.927  12.056   1.894
  335    HA   THR  42           HA       THR  42   8.454  14.557   2.570
  336    HB   THR  42           HB       THR  42  10.564  15.679   1.776
  337    HG1  THR  42           HG1      THR  42  12.373  14.174   1.645
  338   1HG2  THR  42          1HG2      THR  42  11.885  14.177   3.725
  339   2HG2  THR  42          2HG2      THR  42  10.176  14.012   4.130
  340   3HG2  THR  42          3HG2      THR  42  10.903  15.614   4.002
  341    H    ALA  43           H        ALA  43   7.578  12.676   0.461
  342    HA   ALA  43           HA       ALA  43   7.311  14.655  -1.692
  343   1HB   ALA  43          1HB       ALA  43   9.467  13.119  -1.993
  344   2HB   ALA  43          2HB       ALA  43   8.448  13.534  -3.372
  345   3HB   ALA  43          3HB       ALA  43   8.273  11.964  -2.587
  346    H    ASP  44           H        ASP  44   5.148  14.219  -0.550
  347    HA   ASP  44           HA       ASP  44   3.855  11.774  -1.675
  348   1HB   ASP  44          2HB       ASP  44   3.785  11.955   0.793
  349   2HB   ASP  44          1HB       ASP  44   2.985  13.520   0.650
  350    H    LYS  45           H        LYS  45   4.328  14.622  -2.820
  351    HA   LYS  45           HA       LYS  45   1.539  15.514  -3.206
  352   1HB   LYS  45          2HB       LYS  45   2.654  17.325  -4.582
  353   2HB   LYS  45          1HB       LYS  45   3.153  17.277  -2.890
  354   1HG   LYS  45          2HG       LYS  45   5.209  16.193  -3.422
  355   2HG   LYS  45          1HG       LYS  45   4.674  15.826  -5.062
  356   1HD   LYS  45          2HD       LYS  45   4.791  18.119  -5.719
  357   2HD   LYS  45          1HD       LYS  45   4.963  18.659  -4.048
  358   1HE   LYS  45          2HE       LYS  45   7.196  18.334  -4.080
  359   2HE   LYS  45          1HE       LYS  45   7.016  16.721  -4.769
  360   1HZ   LYS  45          1HZ       LYS  45   8.149  18.630  -6.115
  361   2HZ   LYS  45          2HZ       LYS  45   6.546  19.049  -6.489
  362   3HZ   LYS  45          3HZ       LYS  45   7.141  17.509  -6.891
  363    H    GLY  46           H        GLY  46   3.228  13.069  -4.499
  364   1HA   GLY  46          2HA       GLY  46   2.098  13.553  -7.230
  365   2HA   GLY  46          1HA       GLY  46   3.617  12.693  -6.977
  366    H    TRP  47           H        TRP  47   3.025  10.893  -5.000
  367    HA   TRP  47           HA       TRP  47   1.306   9.024  -6.442
  368   1HB   TRP  47          2HB       TRP  47   2.202   7.351  -5.028
  369   2HB   TRP  47          1HB       TRP  47   3.528   8.469  -5.338
  370    HD1  TRP  47           HD1      TRP  47   3.134  10.713  -3.309
  371    HE1  TRP  47           HE1      TRP  47   3.278  10.291  -0.777
  372    HE3  TRP  47           HE3      TRP  47   2.116   5.713  -3.181
  373    HZ2  TRP  47           HZ2      TRP  47   3.008   8.137   1.062
  374    HZ3  TRP  47           HZ3      TRP  47   2.075   4.502  -1.022
  375    HH2  TRP  47           HH2      TRP  47   2.517   5.711   1.101
  376    H    GLN  48           H        GLN  48   0.858  11.048  -3.619
  377    HA   GLN  48           HA       GLN  48  -0.856   9.674  -2.016
  378   1HB   GLN  48          2HB       GLN  48  -2.204  11.777  -1.649
  379   2HB   GLN  48          1HB       GLN  48  -0.477  11.943  -1.428
  380   1HG   GLN  48          2HG       GLN  48  -2.268  13.282  -3.356
  381   2HG   GLN  48          1HG       GLN  48  -0.731  13.808  -2.699
  382   1HE2  GLN  48          1HE2      GLN  48  -2.225  12.035  -5.375
  383   2HE2  GLN  48          2HE2      GLN  48  -0.812  11.905  -6.296
  384    H    ASN  49           H        ASN  49  -3.060  11.749  -3.732
  385    HA   ASN  49           HA       ASN  49  -4.975   9.657  -4.007
  386   1HB   ASN  49          2HB       ASN  49  -6.317  11.264  -5.203
  387   2HB   ASN  49          1HB       ASN  49  -5.469  12.133  -3.924
  388   1HD2  ASN  49          1HD2      ASN  49  -4.434  14.005  -4.620
  389   2HD2  ASN  49          2HD2      ASN  49  -3.903  14.296  -6.206
  390    H    SER  50           H        SER  50  -2.197  10.230  -5.836
  391    HA   SER  50           HA       SER  50  -3.200   9.497  -8.445
  392   1HB   SER  50          2HB       SER  50  -0.942  10.637  -7.776
  393   2HB   SER  50          1HB       SER  50  -0.374   8.986  -7.552
  394    HG   SER  50           HG       SER  50  -1.314   8.660  -9.749
  395    H    ILE  51           H        ILE  51  -2.246   7.733  -5.600
  396    HA   ILE  51           HA       ILE  51  -1.772   5.193  -6.891
  397    HB   ILE  51           HB       ILE  51  -1.720   6.273  -4.232
  398   1HG1  ILE  51          2HG1      ILE  51  -0.201   4.450  -3.867
  399   2HG1  ILE  51          1HG1      ILE  51  -0.906   3.527  -5.191
  400   1HG2  ILE  51          1HG2      ILE  51  -3.189   3.619  -4.449
  401   2HG2  ILE  51          2HG2      ILE  51  -3.885   5.124  -3.850
  402   3HG2  ILE  51          3HG2      ILE  51  -2.587   4.340  -2.957
  403   1HD1  ILE  51          1HD1      ILE  51   0.164   6.242  -5.817
  404   2HD1  ILE  51          2HD1      ILE  51   0.135   4.788  -6.816
  405   3HD1  ILE  51          3HD1      ILE  51   1.328   4.949  -5.525
  406    H    ARG  52           H        ARG  52  -4.616   6.417  -5.055
  407    HA   ARG  52           HA       ARG  52  -6.318   4.222  -5.633
  408   1HB   ARG  52          2HB       ARG  52  -7.052   5.820  -3.998
  409   2HB   ARG  52          1HB       ARG  52  -6.923   7.151  -5.148
  410   1HG   ARG  52          2HG       ARG  52  -8.654   5.031  -6.149
  411   2HG   ARG  52          1HG       ARG  52  -9.226   5.667  -4.606
  412   1HD   ARG  52          2HD       ARG  52  -9.312   7.904  -5.458
  413   2HD   ARG  52          1HD       ARG  52  -8.425   7.453  -6.915
  414    HE   ARG  52           HE       ARG  52 -11.209   6.519  -6.337
  415   1HH1  ARG  52          1HH2      ARG  52  -9.744   5.065  -8.490
  416   2HH1  ARG  52          2HH2      ARG  52 -10.187   5.957  -9.907
  417   1HH2  ARG  52          1HH1      ARG  52 -11.320   8.717  -8.141
  418   2HH2  ARG  52          2HH1      ARG  52 -11.078   8.023  -9.710
  419    H    HIS  53           H        HIS  53  -5.549   7.128  -7.474
  420    HA   HIS  53           HA       HIS  53  -7.469   6.601  -9.588
  421   1HB   HIS  53          2HB       HIS  53  -6.271   8.834  -8.895
  422   2HB   HIS  53          1HB       HIS  53  -4.979   8.253  -9.947
  423    HD1  HIS  53           HD1      HIS  53  -5.579  10.243 -11.609
  424    HD2  HIS  53           HD2      HIS  53  -8.587   7.398 -11.124
  425    HE1  HIS  53           HE1      HIS  53  -7.229  10.616 -13.494
  426    H    ASN  54           H        ASN  54  -4.228   5.608  -8.848
  427    HA   ASN  54           HA       ASN  54  -3.464   4.764 -11.509
  428   1HB   ASN  54          2HB       ASN  54  -2.449   4.304  -8.725
  429   2HB   ASN  54          1HB       ASN  54  -1.892   3.230 -10.009
  430   1HD2  ASN  54          1HD2      ASN  54  -0.874   5.881  -8.412
  431   2HD2  ASN  54          2HD2      ASN  54  -0.065   6.709  -9.656
  432    H    LEU  55           H        LEU  55  -5.084   3.272  -8.764
  433    HA   LEU  55           HA       LEU  55  -5.037   0.588  -9.779
  434   1HB   LEU  55          2HB       LEU  55  -7.072   1.816  -7.913
  435   2HB   LEU  55          1HB       LEU  55  -6.647   0.110  -8.050
  436    HG   LEU  55           HG       LEU  55  -4.696   2.279  -7.249
  437   1HD1  LEU  55          1HD1      LEU  55  -6.546   1.966  -5.597
  438   2HD1  LEU  55          2HD1      LEU  55  -4.974   1.476  -4.967
  439   3HD1  LEU  55          3HD1      LEU  55  -6.127   0.255  -5.506
  440   1HD2  LEU  55          1HD2      LEU  55  -4.296  -0.569  -6.553
  441   2HD2  LEU  55          2HD2      LEU  55  -3.132   0.621  -7.135
  442   3HD2  LEU  55          3HD2      LEU  55  -4.201  -0.198  -8.275
  443    H    SER  56           H        SER  56  -6.822   3.356 -10.714
  444    HA   SER  56           HA       SER  56  -9.098   1.808 -11.775
  445   1HB   SER  56          2HB       SER  56  -8.390   4.684 -11.506
  446   2HB   SER  56          1HB       SER  56  -9.389   4.259 -12.892
  447    HG   SER  56           HG       SER  56 -10.768   4.614 -11.205
  448    H    LEU  57           H        LEU  57  -6.441   3.800 -13.085
  449    HA   LEU  57           HA       LEU  57  -6.928   2.684 -15.772
  450   1HB   LEU  57          2HB       LEU  57  -5.062   4.240 -16.417
  451   2HB   LEU  57          1HB       LEU  57  -6.434   5.054 -15.671
  452    HG   LEU  57           HG       LEU  57  -4.656   4.222 -13.592
  453   1HD1  LEU  57          1HD1      LEU  57  -3.227   4.636 -15.951
  454   2HD1  LEU  57          2HD1      LEU  57  -2.569   4.693 -14.316
  455   3HD1  LEU  57          3HD1      LEU  57  -3.104   6.178 -15.104
  456   1HD2  LEU  57          1HD2      LEU  57  -5.427   6.908 -14.769
  457   2HD2  LEU  57          2HD2      LEU  57  -4.526   6.723 -13.265
  458   3HD2  LEU  57          3HD2      LEU  57  -6.170   6.099 -13.390
  459    H    ASN  58           H        ASN  58  -5.744   1.164 -13.333
  460    HA   ASN  58           HA       ASN  58  -3.060   0.510 -14.392
  461   1HB   ASN  58          2HB       ASN  58  -4.457   0.085 -11.829
  462   2HB   ASN  58          1HB       ASN  58  -3.522  -1.303 -12.379
  463   1HD2  ASN  58          1HD2      ASN  58  -2.717   2.100 -13.096
  464   2HD2  ASN  58          2HD2      ASN  58  -1.263   2.109 -12.220
  465    H    ARG  59           H        ARG  59  -2.531  -1.882 -14.606
  466    HA   ARG  59           HA       ARG  59  -4.605  -3.113 -16.310
  467   1HB   ARG  59          2HB       ARG  59  -2.461  -3.118 -17.319
  468   2HB   ARG  59          1HB       ARG  59  -1.672  -3.646 -15.833
  469   1HG   ARG  59          2HG       ARG  59  -2.680  -5.838 -15.999
  470   2HG   ARG  59          1HG       ARG  59  -3.670  -5.328 -17.368
  471   1HD   ARG  59          2HD       ARG  59  -0.661  -5.157 -17.479
  472   2HD   ARG  59          1HD       ARG  59  -1.504  -6.654 -17.880
  473    HE   ARG  59           HE       ARG  59  -2.538  -4.313 -19.297
  474   1HH1  ARG  59          1HH2      ARG  59   0.525  -5.503 -19.416
  475   2HH1  ARG  59          2HH2      ARG  59   0.445  -6.129 -21.028
  476   1HH2  ARG  59          1HH1      ARG  59  -2.987  -5.712 -21.302
  477   2HH2  ARG  59          2HH1      ARG  59  -1.544  -6.248 -22.097
  478    H    TYR  60           H        TYR  60  -3.306  -3.508 -13.109
  479    HA   TYR  60           HA       TYR  60  -4.957  -5.978 -12.851
  480   1HB   TYR  60          2HB       TYR  60  -2.986  -6.620 -11.153
  481   2HB   TYR  60          1HB       TYR  60  -2.951  -7.084 -12.853
  482    HD1  TYR  60           HD1      TYR  60  -2.322  -3.777 -11.152
  483    HD2  TYR  60           HD2      TYR  60  -0.763  -6.946 -13.594
  484    HE1  TYR  60           HE1      TYR  60  -0.229  -2.491 -11.508
  485    HE2  TYR  60           HE2      TYR  60   1.323  -5.663 -13.943
  486    HH   TYR  60           HH       TYR  60   1.605  -2.389 -13.215
  487    H    PHE  61           H        PHE  61  -6.134  -3.778 -11.943
  488    HA   PHE  61           HA       PHE  61  -5.947  -4.141  -9.025
  489   1HB   PHE  61          2HB       PHE  61  -5.357  -1.543 -10.418
  490   2HB   PHE  61          1HB       PHE  61  -5.975  -1.571  -8.764
  491    HD1  PHE  61           HD1      PHE  61  -4.744  -3.493  -7.241
  492    HD2  PHE  61           HD2      PHE  61  -3.042  -1.495 -10.632
  493    HE1  PHE  61           HE1      PHE  61  -2.479  -4.034  -6.441
  494    HE2  PHE  61           HE2      PHE  61  -0.790  -2.033  -9.836
  495    HZ   PHE  61           HZ       PHE  61  -0.490  -3.302  -7.723
  496    H    ILE  62           H        ILE  62  -7.982  -4.930  -8.970
  497    HA   ILE  62           HA       ILE  62 -10.190  -3.386 -10.217
  498    HB   ILE  62           HB       ILE  62 -11.554  -5.325  -9.830
  499   1HG1  ILE  62          2HG1      ILE  62  -9.271  -6.305  -8.085
  500   2HG1  ILE  62          1HG1      ILE  62 -10.851  -5.767  -7.514
  501   1HG2  ILE  62          1HG2      ILE  62  -9.268  -5.391 -11.361
  502   2HG2  ILE  62          2HG2      ILE  62 -10.526  -6.627 -11.380
  503   3HG2  ILE  62          3HG2      ILE  62  -9.093  -6.843 -10.377
  504   1HD1  ILE  62          1HD1      ILE  62 -11.026  -7.826  -9.595
  505   2HD1  ILE  62          2HD1      ILE  62 -11.828  -7.744  -8.026
  506   3HD1  ILE  62          3HD1      ILE  62 -10.186  -8.378  -8.146
  507    H    LYS  63           H        LYS  63 -12.283  -3.467  -8.716
  508    HA   LYS  63           HA       LYS  63 -11.467  -2.537  -5.990
  509   1HB   LYS  63          2HB       LYS  63 -13.186  -1.292  -8.062
  510   2HB   LYS  63          1HB       LYS  63 -13.823  -1.242  -6.418
  511   1HG   LYS  63          2HG       LYS  63 -11.161  -0.573  -6.064
  512   2HG   LYS  63          1HG       LYS  63 -11.568   0.221  -7.587
  513   1HD   LYS  63          2HD       LYS  63 -12.198   1.830  -6.004
  514   2HD   LYS  63          1HD       LYS  63 -13.719   0.994  -6.314
  515   1HE   LYS  63          2HE       LYS  63 -13.730   0.899  -4.013
  516   2HE   LYS  63          1HE       LYS  63 -12.810  -0.570  -4.339
  517   1HZ   LYS  63          1HZ       LYS  63 -10.842   0.422  -3.769
  518   2HZ   LYS  63          2HZ       LYS  63 -11.902   1.207  -2.697
  519   3HZ   LYS  63          3HZ       LYS  63 -11.389   1.990  -4.115
  520    H    VAL  64           H        VAL  64 -12.408  -3.716  -4.377
  521    HA   VAL  64           HA       VAL  64 -14.587  -5.585  -5.101
  522    HB   VAL  64           HB       VAL  64 -14.182  -6.332  -2.642
  523   1HG1  VAL  64          1HG1      VAL  64 -12.258  -6.636  -4.945
  524   2HG1  VAL  64          2HG1      VAL  64 -13.459  -7.785  -4.354
  525   3HG1  VAL  64          3HG1      VAL  64 -11.993  -7.483  -3.420
  526   1HG2  VAL  64          1HG2      VAL  64 -12.748  -4.076  -2.445
  527   2HG2  VAL  64          2HG2      VAL  64 -11.465  -5.150  -3.005
  528   3HG2  VAL  64          3HG2      VAL  64 -12.339  -5.518  -1.517
  529    HA   PRO  65           HA       PRO  65 -17.372  -2.582  -3.275
  530   1HB   PRO  65          2HB       PRO  65 -19.656  -3.855  -4.125
  531   2HB   PRO  65          1HB       PRO  65 -18.684  -2.795  -5.161
  532   1HG   PRO  65          2HG       PRO  65 -18.881  -5.770  -5.178
  533   2HG   PRO  65          1HG       PRO  65 -18.467  -4.666  -6.499
  534   1HD   PRO  65          2HD       PRO  65 -16.635  -6.211  -4.989
  535   2HD   PRO  65          1HD       PRO  65 -16.221  -4.874  -6.083
  536    H    ARG  66           H        ARG  66 -19.338  -2.852  -1.755
  537    HA   ARG  66           HA       ARG  66 -19.074  -5.358  -0.141
  538   1HB   ARG  66          2HB       ARG  66 -18.925  -2.499   0.681
  539   2HB   ARG  66          1HB       ARG  66 -19.811  -3.588   1.750
  540   1HG   ARG  66          2HG       ARG  66 -17.575  -3.687   2.528
  541   2HG   ARG  66          1HG       ARG  66 -17.770  -5.147   1.560
  542   1HD   ARG  66          2HD       ARG  66 -16.677  -4.105  -0.338
  543   2HD   ARG  66          1HD       ARG  66 -16.616  -2.553   0.500
  544    HE   ARG  66           HE       ARG  66 -14.634  -4.536   0.737
  545   1HH1  ARG  66          1HH2      ARG  66 -14.721  -1.729   2.007
  546   2HH1  ARG  66          2HH2      ARG  66 -14.527  -2.134   3.680
  547   1HH2  ARG  66          1HH1      ARG  66 -15.254  -5.494   3.223
  548   2HH2  ARG  66          2HH1      ARG  66 -14.830  -4.266   4.369
  549    H    SER  67           H        SER  67 -21.199  -2.499   0.087
  550    HA   SER  67           HA       SER  67 -23.527  -4.282   0.310
  551   1HB   SER  67          2HB       SER  67 -23.726  -1.292   0.117
  552   2HB   SER  67          1HB       SER  67 -24.703  -2.413   1.062
  553    HG   SER  67           HG       SER  67 -22.983  -1.071   2.146
  554    H    GLN  68           H        GLN  68 -25.551  -3.118  -0.981
  555    HA   GLN  68           HA       GLN  68 -24.659  -3.066  -3.837
  556   1HB   GLN  68          2HB       GLN  68 -26.962  -4.357  -2.456
  557   2HB   GLN  68          1HB       GLN  68 -27.258  -3.697  -4.064
  558   1HG   GLN  68          2HG       GLN  68 -25.021  -5.622  -3.368
  559   2HG   GLN  68          1HG       GLN  68 -26.534  -6.075  -4.154
  560   1HE2  GLN  68          1HE2      GLN  68 -24.041  -6.477  -5.484
  561   2HE2  GLN  68          2HE2      GLN  68 -23.952  -5.414  -6.804
  562    H    GLU  69           H        GLU  69 -24.871  -0.760  -2.003
  563    HA   GLU  69           HA       GLU  69 -27.300   0.655  -2.887
  564   1HB   GLU  69          2HB       GLU  69 -26.012   0.832  -0.575
  565   2HB   GLU  69          1HB       GLU  69 -25.054   2.025  -1.453
  566   1HG   GLU  69          2HG       GLU  69 -27.173   3.183  -2.103
  567   2HG   GLU  69          1HG       GLU  69 -28.064   2.046  -1.090
  568    H    GLU  70           H        GLU  70 -23.788   0.800  -3.425
  569    HA   GLU  70           HA       GLU  70 -24.156   2.990  -5.379
  570   1HB   GLU  70          2HB       GLU  70 -21.639   1.513  -4.541
  571   2HB   GLU  70          1HB       GLU  70 -21.705   2.978  -5.523
  572   1HG   GLU  70          2HG       GLU  70 -23.172   3.786  -3.394
  573   2HG   GLU  70          1HG       GLU  70 -22.086   2.645  -2.599
  574    HA   PRO  71           HA       PRO  71 -24.295   0.254  -8.812
  575   1HB   PRO  71          2HB       PRO  71 -23.550   2.048 -10.757
  576   2HB   PRO  71          1HB       PRO  71 -25.154   2.028 -10.006
  577   1HG   PRO  71          2HG       PRO  71 -22.900   3.933  -9.568
  578   2HG   PRO  71          1HG       PRO  71 -24.642   4.191  -9.373
  579   1HD   PRO  71          2HD       PRO  71 -22.793   3.730  -7.280
  580   2HD   PRO  71          1HD       PRO  71 -24.564   3.653  -7.144
  581    H    GLY  72           H        GLY  72 -21.422   2.398  -8.706
  582   1HA   GLY  72          2HA       GLY  72 -19.692   0.040  -9.133
  583   2HA   GLY  72          1HA       GLY  72 -19.606   1.306 -10.362
  584    H    LYS  73           H        LYS  73 -19.452   0.928  -6.803
  585    HA   LYS  73           HA       LYS  73 -16.944   2.335  -6.624
  586   1HB   LYS  73          2HB       LYS  73 -19.062   4.052  -6.978
  587   2HB   LYS  73          1HB       LYS  73 -18.950   3.973  -5.219
  588   1HG   LYS  73          2HG       LYS  73 -17.329   5.548  -5.462
  589   2HG   LYS  73          1HG       LYS  73 -16.309   4.185  -5.928
  590   1HD   LYS  73          2HD       LYS  73 -16.015   5.235  -7.904
  591   2HD   LYS  73          1HD       LYS  73 -17.691   4.816  -8.265
  592   1HE   LYS  73          2HE       LYS  73 -18.495   6.919  -7.505
  593   2HE   LYS  73          1HE       LYS  73 -16.977   7.292  -6.689
  594   1HZ   LYS  73          1HZ       LYS  73 -16.134   6.929  -9.188
  595   2HZ   LYS  73          2HZ       LYS  73 -16.583   8.442  -8.560
  596   3HZ   LYS  73          3HZ       LYS  73 -17.685   7.543  -9.490
  597    H    GLY  74           H        GLY  74 -16.162   0.987  -5.055
  598   1HA   GLY  74          1HA       GLY  74 -17.924   0.381  -2.723
  599   2HA   GLY  74          2HA       GLY  74 -16.544  -0.599  -3.218
  600    H    SER  75           H        SER  75 -15.176  -0.447  -1.459
  601    HA   SER  75           HA       SER  75 -13.976   2.184  -0.931
  602   1HB   SER  75          2HB       SER  75 -14.397   2.086   1.500
  603   2HB   SER  75          1HB       SER  75 -15.907   2.183   0.599
  604    HG   SER  75           HG       SER  75 -15.888   0.554   2.254
  605    H    PHE  76           H        PHE  76 -13.275  -0.658  -1.838
  606    HA   PHE  76           HA       PHE  76 -10.855  -0.856  -0.140
  607   1HB   PHE  76          2HB       PHE  76 -12.945  -2.535   0.396
  608   2HB   PHE  76          1HB       PHE  76 -12.044  -3.480  -0.791
  609    HD1  PHE  76           HD1      PHE  76 -12.411  -3.231   2.564
  610    HD2  PHE  76           HD2      PHE  76  -9.288  -2.916  -0.370
  611    HE1  PHE  76           HE1      PHE  76 -10.726  -3.812   4.291
  612    HE2  PHE  76           HE2      PHE  76  -7.606  -3.496   1.358
  613    HZ   PHE  76           HZ       PHE  76  -8.326  -3.946   3.687
  614    H    TRP  77           H        TRP  77  -9.130  -1.052  -1.448
  615    HA   TRP  77           HA       TRP  77  -9.533  -1.602  -4.307
  616   1HB   TRP  77          2HB       TRP  77  -7.346  -0.506  -2.604
  617   2HB   TRP  77          1HB       TRP  77  -6.886  -1.262  -4.131
  618    HD1  TRP  77           HD1      TRP  77  -8.070   1.929  -2.757
  619    HE1  TRP  77           HE1      TRP  77  -8.864   3.496  -4.645
  620    HE3  TRP  77           HE3      TRP  77  -8.300  -1.402  -6.614
  621    HZ2  TRP  77           HZ2      TRP  77  -9.509   3.348  -7.431
  622    HZ3  TRP  77           HZ3      TRP  77  -9.003  -0.666  -8.872
  623    HH2  TRP  77           HH2      TRP  77  -9.596   1.700  -9.280
  624    H    ARG  78           H        ARG  78  -8.199  -3.191  -5.456
  625    HA   ARG  78           HA       ARG  78  -6.864  -5.304  -3.933
  626   1HB   ARG  78          2HB       ARG  78  -9.448  -5.707  -3.871
  627   2HB   ARG  78          1HB       ARG  78  -9.245  -6.176  -5.558
  628   1HG   ARG  78          2HG       ARG  78  -7.517  -7.823  -4.874
  629   2HG   ARG  78          1HG       ARG  78  -7.794  -7.386  -3.189
  630   1HD   ARG  78          2HD       ARG  78  -9.496  -8.850  -3.104
  631   2HD   ARG  78          1HD       ARG  78 -10.338  -7.920  -4.344
  632    HE   ARG  78           HE       ARG  78  -8.316  -9.676  -5.471
  633   1HH1  ARG  78          1HH2      ARG  78 -11.446  -8.833  -5.830
  634   2HH1  ARG  78          2HH2      ARG  78 -12.084 -10.429  -6.041
  635   1HH2  ARG  78          1HH1      ARG  78  -9.160 -12.013  -5.058
  636   2HH2  ARG  78          2HH1      ARG  78 -10.789 -12.231  -5.603
  637    H    ILE  79           H        ILE  79  -5.684  -6.740  -5.356
  638    HA   ILE  79           HA       ILE  79  -5.470  -5.706  -8.155
  639    HB   ILE  79           HB       ILE  79  -3.372  -5.591  -6.907
  640   1HG1  ILE  79          2HG1      ILE  79  -2.612  -7.953  -8.414
  641   2HG1  ILE  79          1HG1      ILE  79  -3.708  -6.942  -9.342
  642   1HG2  ILE  79          1HG2      ILE  79  -4.081  -8.426  -6.268
  643   2HG2  ILE  79          2HG2      ILE  79  -3.529  -7.145  -5.188
  644   3HG2  ILE  79          3HG2      ILE  79  -2.391  -7.926  -6.286
  645   1HD1  ILE  79          1HD1      ILE  79  -2.278  -5.016  -9.074
  646   2HD1  ILE  79          2HD1      ILE  79  -1.268  -6.350  -9.618
  647   3HD1  ILE  79          3HD1      ILE  79  -1.259  -5.874  -7.920
  648    H    ASP  80           H        ASP  80  -5.365  -7.291  -9.894
  649    HA   ASP  80           HA       ASP  80  -7.199  -9.440  -9.649
  650   1HB   ASP  80          2HB       ASP  80  -5.540  -8.329 -11.698
  651   2HB   ASP  80          1HB       ASP  80  -5.309 -10.077 -11.694
  652    HA   PRO  81           HA       PRO  81  -4.632 -12.355  -7.517
  653   1HB   PRO  81          2HB       PRO  81  -6.364 -14.477  -7.702
  654   2HB   PRO  81          1HB       PRO  81  -6.573 -13.138  -6.561
  655   1HG   PRO  81          2HG       PRO  81  -8.065 -13.707  -9.078
  656   2HG   PRO  81          1HG       PRO  81  -8.591 -12.817  -7.639
  657   1HD   PRO  81          2HD       PRO  81  -7.730 -11.670 -10.083
  658   2HD   PRO  81          1HD       PRO  81  -7.956 -10.811  -8.544
  659    H    ALA  82           H        ALA  82  -6.307 -13.613 -10.436
  660    HA   ALA  82           HA       ALA  82  -4.379 -15.675 -10.927
  661   1HB   ALA  82          1HB       ALA  82  -5.866 -14.435 -13.209
  662   2HB   ALA  82          2HB       ALA  82  -6.805 -15.217 -11.938
  663   3HB   ALA  82          3HB       ALA  82  -5.602 -16.139 -12.838
  664    H    SER  83           H        SER  83  -4.173 -12.298 -11.300
  665    HA   SER  83           HA       SER  83  -1.898 -12.635 -13.207
  666   1HB   SER  83          2HB       SER  83  -3.963 -10.538 -12.881
  667   2HB   SER  83          1HB       SER  83  -2.324  -9.939 -13.120
  668    HG   SER  83           HG       SER  83  -2.366 -10.658 -15.104
  669    H    GLU  84           H        GLU  84  -2.712 -12.180  -9.993
  670    HA   GLU  84           HA       GLU  84  -0.856 -10.247  -9.104
  671   1HB   GLU  84          2HB       GLU  84  -2.645 -11.274  -7.697
  672   2HB   GLU  84          1HB       GLU  84  -1.702 -12.765  -7.651
  673   1HG   GLU  84          2HG       GLU  84  -0.012 -10.532  -6.964
  674   2HG   GLU  84          1HG       GLU  84  -1.449 -10.526  -5.941
  675    H    ALA  85           H        ALA  85  -0.435 -13.784  -9.471
  676    HA   ALA  85           HA       ALA  85   2.254 -13.855  -8.539
  677   1HB   ALA  85          1HB       ALA  85   0.434 -15.644  -9.880
  678   2HB   ALA  85          2HB       ALA  85   1.851 -16.040  -8.909
  679   3HB   ALA  85          3HB       ALA  85   2.022 -15.751 -10.640
  680    H    LYS  86           H        LYS  86   0.963 -12.532 -11.457
  681    HA   LYS  86           HA       LYS  86   3.592 -12.631 -12.818
  682   1HB   LYS  86          2HB       LYS  86   1.559 -13.014 -14.165
  683   2HB   LYS  86          1HB       LYS  86   0.959 -11.416 -13.714
  684   1HG   LYS  86          2HG       LYS  86   3.152 -10.495 -14.682
  685   2HG   LYS  86          1HG       LYS  86   3.377 -12.091 -15.399
  686   1HD   LYS  86          2HD       LYS  86   1.828 -11.702 -16.998
  687   2HD   LYS  86          1HD       LYS  86   0.681 -11.042 -15.832
  688   1HE   LYS  86          2HE       LYS  86   1.100  -9.054 -16.845
  689   2HE   LYS  86          1HE       LYS  86   2.593  -9.072 -15.908
  690   1HZ   LYS  86          1HZ       LYS  86   2.323  -9.124 -18.671
  691   2HZ   LYS  86          2HZ       LYS  86   2.907 -10.653 -18.218
  692   3HZ   LYS  86          3HZ       LYS  86   3.753  -9.250 -17.767
  693    H    LEU  87           H        LEU  87   1.246 -10.079 -11.888
  694    HA   LEU  87           HA       LEU  87   2.880  -7.867 -12.378
  695   1HB   LEU  87          2HB       LEU  87   1.610  -6.902 -10.256
  696   2HB   LEU  87          1HB       LEU  87   0.762  -7.188 -11.759
  697    HG   LEU  87           HG       LEU  87   0.757  -9.622 -10.237
  698   1HD1  LEU  87          1HD1      LEU  87  -0.845  -8.497  -8.455
  699   2HD1  LEU  87          2HD1      LEU  87   0.191  -7.099  -8.741
  700   3HD1  LEU  87          3HD1      LEU  87   0.890  -8.612  -8.165
  701   1HD2  LEU  87          1HD2      LEU  87  -1.435  -7.642 -10.944
  702   2HD2  LEU  87          2HD2      LEU  87  -1.695  -9.306 -10.427
  703   3HD2  LEU  87          3HD2      LEU  87  -0.896  -8.974 -11.963
  704    H    VAL  88           H        VAL  88   2.481  -9.559  -9.306
  705    HA   VAL  88           HA       VAL  88   4.349  -8.245  -7.750
  706    HB   VAL  88           HB       VAL  88   4.705 -10.437  -6.667
  707   1HG1  VAL  88          1HG1      VAL  88   1.790 -10.169  -7.352
  708   2HG1  VAL  88          2HG1      VAL  88   2.607  -8.921  -6.411
  709   3HG1  VAL  88          3HG1      VAL  88   2.516 -10.572  -5.797
  710   1HG2  VAL  88          1HG2      VAL  88   4.681 -12.146  -8.182
  711   2HG2  VAL  88          2HG2      VAL  88   3.570 -11.290  -9.252
  712   3HG2  VAL  88          3HG2      VAL  88   2.949 -12.149  -7.844
  713    H    GLU  89           H        GLU  89   4.963 -10.589 -10.328
  714    HA   GLU  89           HA       GLU  89   7.675 -11.167  -9.820
  715   1HB   GLU  89          2HB       GLU  89   5.995 -11.885 -11.789
  716   2HB   GLU  89          1HB       GLU  89   6.874 -10.621 -12.648
  717   1HG   GLU  89          2HG       GLU  89   8.926 -11.738 -12.464
  718   2HG   GLU  89          1HG       GLU  89   8.379 -12.717 -11.102
  719    H    GLN  90           H        GLN  90   6.275  -8.481 -11.704
  720    HA   GLN  90           HA       GLN  90   8.870  -7.161 -11.972
  721   1HB   GLN  90          2HB       GLN  90   6.540  -6.994 -13.381
  722   2HB   GLN  90          1HB       GLN  90   6.386  -5.579 -12.339
  723   1HG   GLN  90          2HG       GLN  90   8.116  -4.482 -13.346
  724   2HG   GLN  90          1HG       GLN  90   9.049  -5.960 -13.580
  725   1HE2  GLN  90          1HE2      GLN  90   7.634  -7.561 -15.191
  726   2HE2  GLN  90          2HE2      GLN  90   7.157  -6.792 -16.626
  727    H    ALA  91           H        ALA  91   6.416  -7.388  -9.600
  728    HA   ALA  91           HA       ALA  91   6.768  -4.813  -8.361
  729   1HB   ALA  91          1HB       ALA  91   5.781  -7.317  -7.013
  730   2HB   ALA  91          2HB       ALA  91   4.768  -6.324  -8.062
  731   3HB   ALA  91          3HB       ALA  91   5.429  -5.647  -6.575
  732    H    PHE  92           H        PHE  92   7.527  -7.927  -6.797
  733    HA   PHE  92           HA       PHE  92   9.371  -7.014  -4.950
  734   1HB   PHE  92          2HB       PHE  92   9.873  -9.548  -6.517
  735   2HB   PHE  92          1HB       PHE  92  10.229  -9.227  -4.820
  736    HD1  PHE  92           HD1      PHE  92   8.552 -11.556  -5.996
  737    HD2  PHE  92           HD2      PHE  92   7.501  -7.711  -4.397
  738    HE1  PHE  92           HE1      PHE  92   6.318 -12.430  -5.362
  739    HE2  PHE  92           HE2      PHE  92   5.268  -8.583  -3.764
  740    HZ   PHE  92           HZ       PHE  92   4.676 -10.943  -4.247
  741    H    ARG  93           H        ARG  93  10.044  -7.873  -8.348
  742    HA   ARG  93           HA       ARG  93  12.861  -7.268  -8.196
  743   1HB   ARG  93          2HB       ARG  93  10.918  -7.999 -10.265
  744   2HB   ARG  93          1HB       ARG  93  12.132  -6.857 -10.843
  745   1HG   ARG  93          2HG       ARG  93  13.401  -8.863  -9.206
  746   2HG   ARG  93          1HG       ARG  93  12.443  -9.646 -10.464
  747   1HD   ARG  93          2HD       ARG  93  14.115  -9.195 -11.905
  748   2HD   ARG  93          1HD       ARG  93  13.706  -7.487 -11.745
  749    HE   ARG  93           HE       ARG  93  15.330  -7.580  -9.710
  750   1HH1  ARG  93          1HH2      ARG  93  16.611  -7.263 -12.430
  751   2HH1  ARG  93          2HH2      ARG  93  17.841  -8.481 -12.381
  752   1HH2  ARG  93          1HH1      ARG  93  16.450 -10.150  -9.678
  753   2HH2  ARG  93          2HH1      ARG  93  17.750 -10.117 -10.824
  754    H    LYS  94           H        LYS  94  13.518  -5.465 -10.079
  755    HA   LYS  94           HA       LYS  94  12.364  -2.945  -8.990
  756   1HB   LYS  94          2HB       LYS  94  15.013  -3.769 -10.000
  757   2HB   LYS  94          1HB       LYS  94  14.489  -2.171 -10.534
  758   1HG   LYS  94          2HG       LYS  94  14.904  -1.307  -8.500
  759   2HG   LYS  94          1HG       LYS  94  13.853  -2.506  -7.743
  760   1HD   LYS  94          2HD       LYS  94  15.711  -3.397  -6.827
  761   2HD   LYS  94          1HD       LYS  94  16.144  -3.945  -8.448
  762   1HE   LYS  94          2HE       LYS  94  17.928  -2.576  -8.393
  763   2HE   LYS  94          1HE       LYS  94  16.830  -1.199  -8.315
  764   1HZ   LYS  94          1HZ       LYS  94  17.282  -0.894  -6.176
  765   2HZ   LYS  94          2HZ       LYS  94  18.575  -1.979  -6.370
  766   3HZ   LYS  94          3HZ       LYS  94  17.073  -2.535  -5.803
  767    H    ARG  95           H        ARG  95  12.566  -1.111 -10.821
  768    HA   ARG  95           HA       ARG  95  10.748  -2.000 -12.953
  769   1HB   ARG  95          2HB       ARG  95  11.142   0.396 -11.551
  770   2HB   ARG  95          1HB       ARG  95  11.684   0.740 -13.195
  771   1HG   ARG  95          2HG       ARG  95   9.428  -0.633 -13.753
  772   2HG   ARG  95          1HG       ARG  95   8.966   0.065 -12.200
  773   1HD   ARG  95          2HD       ARG  95   9.142   2.256 -12.978
  774   2HD   ARG  95          1HD       ARG  95  10.262   1.814 -14.267
  775    HE   ARG  95           HE       ARG  95   7.563   0.689 -14.551
  776   1HH1  ARG  95          1HH2      ARG  95   9.694   1.466 -16.671
  777   2HH1  ARG  95          2HH2      ARG  95   8.887   2.790 -17.443
  778   1HH2  ARG  95          1HH1      ARG  95   6.537   3.172 -14.921
  779   2HH2  ARG  95          2HH1      ARG  95   7.099   3.756 -16.452
  780    H    ARG  96           H        ARG  96  12.452  -3.401 -13.967
  781    HA   ARG  96           HA       ARG  96  14.465  -1.828 -15.510
  782   1HB   ARG  96          2HB       ARG  96  14.658  -4.260 -14.114
  783   2HB   ARG  96          1HB       ARG  96  14.665  -4.706 -15.822
  784   1HG   ARG  96          2HG       ARG  96  16.318  -2.352 -15.218
  785   2HG   ARG  96          1HG       ARG  96  16.866  -3.823 -14.414
  786   1HD   ARG  96          2HD       ARG  96  17.930  -4.160 -16.416
  787   2HD   ARG  96          1HD       ARG  96  16.361  -4.824 -16.871
  788    HE   ARG  96           HE       ARG  96  16.496  -1.964 -17.340
  789   1HH1  ARG  96          1HH2      ARG  96  18.482  -4.386 -18.492
  790   2HH1  ARG  96          2HH2      ARG  96  18.044  -4.208 -20.158
  791   1HH2  ARG  96          1HH1      ARG  96  15.431  -2.023 -19.515
  792   2HH2  ARG  96          2HH1      ARG  96  16.318  -2.871 -20.736
  793    H    GLN  97           H        GLN  97  12.078  -1.359 -16.563
  794    HA   GLN  97           HA       GLN  97  12.189  -2.719 -19.149
  795   1HB   GLN  97          2HB       GLN  97  10.201  -3.458 -17.106
  796   2HB   GLN  97          1HB       GLN  97   9.497  -3.028 -18.666
  797   1HG   GLN  97          2HG       GLN  97  11.888  -4.756 -18.822
  798   2HG   GLN  97          1HG       GLN  97  10.481  -5.506 -18.067
  799   1HE2  GLN  97          1HE2      GLN  97   9.044  -6.443 -19.520
  800   2HE2  GLN  97          2HE2      GLN  97   8.878  -6.004 -21.151
  801    H    ARG  98           H        ARG  98  10.937  -1.575 -20.755
  802    HA   ARG  98           HA       ARG  98  10.365   1.219 -19.953
  803   1HB   ARG  98          2HB       ARG  98  10.535  -0.107 -22.676
  804   2HB   ARG  98          1HB       ARG  98  10.222   1.610 -22.417
  805   1HG   ARG  98          2HG       ARG  98  12.513   0.854 -20.865
  806   2HG   ARG  98          1HG       ARG  98  12.745   0.296 -22.522
  807   1HD   ARG  98          2HD       ARG  98  12.073   2.603 -23.302
  808   2HD   ARG  98          1HD       ARG  98  12.116   3.116 -21.614
  809    HE   ARG  98           HE       ARG  98  14.578   1.820 -22.534
  810   1HH1  ARG  98          1HH2      ARG  98  12.919   4.692 -23.193
  811   2HH1  ARG  98          2HH2      ARG  98  14.231   5.740 -22.767
  812   1HH2  ARG  98          1HH1      ARG  98  16.225   3.183 -21.538
  813   2HH2  ARG  98          2HH1      ARG  98  16.103   4.886 -21.830
  814    H    GLY  99           H        GLY  99   8.316   1.347 -19.094
  815   1HA   GLY  99          2HA       GLY  99   6.113  -0.279 -20.067
  816   2HA   GLY  99          1HA       GLY  99   5.983   1.048 -18.912
  817    H    VAL 100           H        VAL 100   4.377   2.305 -19.812
  818    HA   VAL 100           HA       VAL 100   4.693   3.075 -22.683
  819    HB   VAL 100           HB       VAL 100   2.538   2.015 -22.157
  820   1HG1  VAL 100          1HG1      VAL 100   2.174   4.312 -20.210
  821   2HG1  VAL 100          2HG1      VAL 100   2.527   2.649 -19.743
  822   3HG1  VAL 100          3HG1      VAL 100   1.007   3.034 -20.549
  823   1HG2  VAL 100          1HG2      VAL 100   1.988   4.968 -22.424
  824   2HG2  VAL 100          2HG2      VAL 100   1.176   3.621 -23.220
  825   3HG2  VAL 100          3HG2      VAL 100   2.804   4.086 -23.715
  826    H    SER 101           HN       SER 101   4.093   4.346 -19.418
  827    HA   SER 101           HA       SER 101   4.661   7.083 -20.476
  828   1HB   SER 101          2HB       SER 101   3.505   6.460 -17.758
  829   2HB   SER 101          1HB       SER 101   3.427   7.972 -18.657
  830    HG   SER 101           HG       SER 101   1.477   6.968 -18.920
  Start of MODEL   14
    1   1H    GLU   1          1HT       GLU   1  16.733  16.381  -0.823
    2   2H    GLU   1          2HT       GLU   1  16.453  17.329  -2.205
    3   3H    GLU   1          3HT       GLU   1  16.910  15.701  -2.368
    4    HA   GLU   1           HA       GLU   1  14.748  15.309  -0.952
    5   1HB   GLU   1          2HB       GLU   1  14.494  18.033  -2.202
    6   2HB   GLU   1          1HB       GLU   1  13.067  17.011  -2.030
    7   1HG   GLU   1          2HG       GLU   1  14.876  17.372   0.332
    8   2HG   GLU   1          1HG       GLU   1  13.758  18.669  -0.089
    9    H    SER   2           H        SER   2  15.457  13.573  -2.493
   10    HA   SER   2           HA       SER   2  14.030  13.877  -5.101
   11   1HB   SER   2          2HB       SER   2  15.992  11.945  -5.525
   12   2HB   SER   2          1HB       SER   2  16.038  13.610  -6.098
   13    HG   SER   2           HG       SER   2  17.755  13.678  -4.866
   14    H    LYS   3           H        LYS   3  12.549  12.254  -5.497
   15    HA   LYS   3           HA       LYS   3  12.377  10.091  -3.510
   16   1HB   LYS   3          2HB       LYS   3  10.123   9.827  -4.192
   17   2HB   LYS   3          1HB       LYS   3  10.394  11.566  -4.183
   18   1HG   LYS   3          2HG       LYS   3  11.108  11.078  -6.713
   19   2HG   LYS   3          1HG       LYS   3  10.011   9.717  -6.493
   20   1HD   LYS   3          2HD       LYS   3   8.194  11.053  -6.540
   21   2HD   LYS   3          1HD       LYS   3   8.916  12.192  -5.403
   22   1HE   LYS   3          2HE       LYS   3   9.491  13.607  -7.060
   23   2HE   LYS   3          1HE       LYS   3  10.238  12.308  -7.990
   24   1HZ   LYS   3          1HZ       LYS   3   7.636  13.488  -8.261
   25   2HZ   LYS   3          2HZ       LYS   3   7.588  11.790  -8.209
   26   3HZ   LYS   3          3HZ       LYS   3   8.535  12.580  -9.377
   27    HA   PRO   4           HA       PRO   4  13.972   7.379  -6.749
   28   1HB   PRO   4          2HB       PRO   4  14.857   5.490  -4.993
   29   2HB   PRO   4          1HB       PRO   4  15.730   7.001  -5.305
   30   1HG   PRO   4          2HG       PRO   4  14.218   6.196  -2.885
   31   2HG   PRO   4          1HG       PRO   4  15.450   7.455  -3.064
   32   1HD   PRO   4          2HD       PRO   4  12.572   7.797  -3.002
   33   2HD   PRO   4          1HD       PRO   4  13.823   9.046  -3.154
   34    HA   PRO   5           HA       PRO   5  10.529   4.298  -5.253
   35   1HB   PRO   5          2HB       PRO   5   8.198   5.321  -6.287
   36   2HB   PRO   5          1HB       PRO   5   8.745   5.605  -4.627
   37   1HG   PRO   5          2HG       PRO   5   8.824   7.442  -6.983
   38   2HG   PRO   5          1HG       PRO   5   8.662   7.833  -5.266
   39   1HD   PRO   5          2HD       PRO   5  11.019   8.070  -6.740
   40   2HD   PRO   5          1HD       PRO   5  10.919   7.988  -4.967
   41    H    TYR   6           H        TYR   6   8.788   3.248  -6.877
   42    HA   TYR   6           HA       TYR   6  10.120   3.135  -9.531
   43   1HB   TYR   6          2HB       TYR   6   8.181   1.056  -8.632
   44   2HB   TYR   6          1HB       TYR   6   9.635   0.876  -9.615
   45    HD1  TYR   6           HD1      TYR   6   8.590  -0.517  -6.880
   46    HD2  TYR   6           HD2      TYR   6  11.572   2.403  -7.890
   47    HE1  TYR   6           HE1      TYR   6   9.881  -1.137  -4.856
   48    HE2  TYR   6           HE2      TYR   6  12.864   1.784  -5.868
   49    HH   TYR   6           HH       TYR   6  12.004   0.601  -3.431
   50    H    SER   7           H        SER   7   8.122   2.026 -11.063
   51    HA   SER   7           HA       SER   7   6.560   4.215 -11.846
   52   1HB   SER   7          2HB       SER   7   6.816   1.853 -12.945
   53   2HB   SER   7          1HB       SER   7   5.433   1.416 -11.948
   54    HG   SER   7           HG       SER   7   4.183   2.741 -13.077
   55    H    TYR   8           H        TYR   8   4.006   4.261 -11.553
   56    HA   TYR   8           HA       TYR   8   3.610   4.126  -8.639
   57   1HB   TYR   8          2HB       TYR   8   2.297   5.596 -10.857
   58   2HB   TYR   8          1HB       TYR   8   1.285   5.172  -9.472
   59    HD1  TYR   8           HD1      TYR   8   1.161   7.665  -8.954
   60    HD2  TYR   8           HD2      TYR   8   4.848   5.462  -8.858
   61    HE1  TYR   8           HE1      TYR   8   2.221   9.458  -7.613
   62    HE2  TYR   8           HE2      TYR   8   5.897   7.245  -7.515
   63    HH   TYR   8           HH       TYR   8   4.179  10.275  -6.848
   64    H    ALA   9           H        ALA   9   3.826   1.710 -10.008
   65    HA   ALA   9           HA       ALA   9   1.189   0.519  -9.351
   66   1HB   ALA   9          1HB       ALA   9   0.998  -0.579 -11.339
   67   2HB   ALA   9          2HB       ALA   9   2.739  -0.822 -11.485
   68   3HB   ALA   9          3HB       ALA   9   2.024   0.727 -11.931
   69    H    GLN  10           H        GLN  10   4.616   0.526  -8.998
   70    HA   GLN  10           HA       GLN  10   4.733  -2.293  -8.106
   71   1HB   GLN  10          2HB       GLN  10   6.741  -0.082  -8.486
   72   2HB   GLN  10          1HB       GLN  10   7.145  -1.480  -7.492
   73   1HG   GLN  10          2HG       GLN  10   6.515  -2.961  -9.409
   74   2HG   GLN  10          1HG       GLN  10   6.286  -1.517 -10.396
   75   1HE2  GLN  10          1HE2      GLN  10   8.228  -3.203 -11.330
   76   2HE2  GLN  10          2HE2      GLN  10   9.779  -2.602 -10.991
   77    H    LEU  11           H        LEU  11   4.594   0.968  -6.827
   78    HA   LEU  11           HA       LEU  11   5.211   0.190  -4.084
   79   1HB   LEU  11          2HB       LEU  11   3.465   2.506  -4.125
   80   2HB   LEU  11          1HB       LEU  11   5.136   2.425  -3.611
   81    HG   LEU  11           HG       LEU  11   5.057   4.034  -5.335
   82   1HD1  LEU  11          1HD1      LEU  11   5.965   2.173  -7.270
   83   2HD1  LEU  11          2HD1      LEU  11   6.422   1.542  -5.687
   84   3HD1  LEU  11          3HD1      LEU  11   6.935   3.158  -6.175
   85   1HD2  LEU  11          1HD2      LEU  11   2.957   2.334  -6.295
   86   2HD2  LEU  11          2HD2      LEU  11   4.112   2.623  -7.595
   87   3HD2  LEU  11          3HD2      LEU  11   3.346   3.984  -6.776
   88    H    ILE  12           H        ILE  12   2.488   0.195  -6.203
   89    HA   ILE  12           HA       ILE  12   0.610  -0.214  -4.012
   90    HB   ILE  12           HB       ILE  12  -0.068  -0.727  -6.884
   91   1HG1  ILE  12          2HG1      ILE  12   1.081   1.435  -6.950
   92   2HG1  ILE  12          1HG1      ILE  12  -0.652   1.722  -7.032
   93   1HG2  ILE  12          1HG2      ILE  12  -1.459  -0.906  -4.569
   94   2HG2  ILE  12          2HG2      ILE  12  -2.208  -0.531  -6.120
   95   3HG2  ILE  12          3HG2      ILE  12  -1.793   0.768  -5.001
   96   1HD1  ILE  12          1HD1      ILE  12   0.400   1.588  -4.290
   97   2HD1  ILE  12          2HD1      ILE  12  -0.691   2.761  -5.012
   98   3HD1  ILE  12          3HD1      ILE  12   1.051   2.918  -5.236
   99    H    VAL  13           H        VAL  13   1.606  -2.168  -6.856
  100    HA   VAL  13           HA       VAL  13   0.386  -4.563  -6.046
  101    HB   VAL  13           HB       VAL  13   3.010  -4.123  -7.501
  102   1HG1  VAL  13          1HG1      VAL  13   1.406  -6.686  -7.359
  103   2HG1  VAL  13          2HG1      VAL  13   2.804  -6.379  -6.330
  104   3HG1  VAL  13          3HG1      VAL  13   2.995  -6.453  -8.081
  105   1HG2  VAL  13          1HG2      VAL  13   0.139  -4.617  -8.297
  106   2HG2  VAL  13          2HG2      VAL  13   1.466  -4.961  -9.406
  107   3HG2  VAL  13          3HG2      VAL  13   1.211  -3.319  -8.817
  108    H    GLN  14           H        GLN  14   3.746  -3.511  -5.319
  109    HA   GLN  14           HA       GLN  14   4.334  -5.627  -3.514
  110   1HB   GLN  14          2HB       GLN  14   6.074  -4.076  -4.274
  111   2HB   GLN  14          1HB       GLN  14   5.261  -2.734  -3.469
  112   1HG   GLN  14          2HG       GLN  14   5.617  -3.776  -1.288
  113   2HG   GLN  14          1HG       GLN  14   6.340  -5.192  -2.056
  114   1HE2  GLN  14          1HE2      GLN  14   7.936  -3.883  -4.029
  115   2HE2  GLN  14          2HE2      GLN  14   9.144  -2.987  -3.243
  116    H    ALA  15           H        ALA  15   2.458  -2.704  -3.203
  117    HA   ALA  15           HA       ALA  15   2.214  -2.679  -0.345
  118   1HB   ALA  15          1HB       ALA  15  -0.145  -1.586  -1.432
  119   2HB   ALA  15          2HB       ALA  15   1.117  -1.251  -2.615
  120   3HB   ALA  15          3HB       ALA  15   1.304  -0.703  -0.952
  121    H    ILE  16           H        ILE  16  -0.394  -3.564  -2.674
  122    HA   ILE  16           HA       ILE  16  -1.673  -5.194  -0.613
  123    HB   ILE  16           HB       ILE  16  -3.032  -5.873  -2.857
  124   1HG1  ILE  16          2HG1      ILE  16  -2.361  -2.993  -3.373
  125   2HG1  ILE  16          1HG1      ILE  16  -1.388  -4.255  -4.119
  126   1HG2  ILE  16          1HG2      ILE  16  -3.442  -3.233  -1.458
  127   2HG2  ILE  16          2HG2      ILE  16  -3.785  -4.787  -0.696
  128   3HG2  ILE  16          3HG2      ILE  16  -4.665  -4.301  -2.144
  129   1HD1  ILE  16          1HD1      ILE  16  -3.213  -3.649  -5.621
  130   2HD1  ILE  16          2HD1      ILE  16  -4.391  -3.962  -4.347
  131   3HD1  ILE  16          3HD1      ILE  16  -3.450  -5.288  -5.023
  132    H    SER  17           H        SER  17  -0.278  -5.932  -3.831
  133    HA   SER  17           HA       SER  17  -0.642  -8.709  -3.759
  134   1HB   SER  17          2HB       SER  17   1.771  -7.289  -4.910
  135   2HB   SER  17          1HB       SER  17   1.191  -8.890  -5.352
  136    HG   SER  17           HG       SER  17  -0.302  -6.482  -5.584
  137    H    SER  18           H        SER  18   1.457  -6.811  -1.785
  138    HA   SER  18           HA       SER  18   3.043  -9.222  -1.057
  139   1HB   SER  18          2HB       SER  18   4.054  -6.847  -1.493
  140   2HB   SER  18          1HB       SER  18   3.472  -6.493   0.131
  141    HG   SER  18           HG       SER  18   4.950  -8.833  -0.398
  142    H    ALA  19           H        ALA  19   0.526  -7.097   0.127
  143    HA   ALA  19           HA       ALA  19   0.767  -7.824   2.919
  144   1HB   ALA  19          1HB       ALA  19  -0.512  -5.833   2.038
  145   2HB   ALA  19          2HB       ALA  19  -1.426  -6.825   3.173
  146   3HB   ALA  19          3HB       ALA  19  -1.736  -6.954   1.442
  147    H    GLN  20           H        GLN  20  -0.846  -9.229   4.069
  148    HA   GLN  20           HA       GLN  20  -0.920 -11.857   3.201
  149   1HB   GLN  20          2HB       GLN  20  -3.257 -11.863   4.507
  150   2HB   GLN  20          1HB       GLN  20  -1.725 -11.693   5.362
  151   1HG   GLN  20          2HG       GLN  20  -2.112  -9.510   5.890
  152   2HG   GLN  20          1HG       GLN  20  -2.877  -9.167   4.338
  153   1HE2  GLN  20          1HE2      GLN  20  -3.519  -9.681   7.649
  154   2HE2  GLN  20          2HE2      GLN  20  -5.194  -9.927   7.532
  155    H    ASP  21           H        ASP  21  -3.994 -10.063   3.132
  156    HA   ASP  21           HA       ASP  21  -4.727 -11.524   0.674
  157   1HB   ASP  21          2HB       ASP  21  -6.221  -9.682   2.553
  158   2HB   ASP  21          1HB       ASP  21  -6.918 -10.219   1.024
  159    H    ARG  22           H        ARG  22  -4.218 -10.595  -1.288
  160    HA   ARG  22           HA       ARG  22  -3.088  -8.007  -1.554
  161   1HB   ARG  22          2HB       ARG  22  -4.551  -9.240  -3.860
  162   2HB   ARG  22          1HB       ARG  22  -2.994  -8.419  -3.838
  163   1HG   ARG  22          2HG       ARG  22  -3.634 -11.231  -2.929
  164   2HG   ARG  22          1HG       ARG  22  -2.477 -10.718  -4.152
  165   1HD   ARG  22          2HD       ARG  22  -0.890 -10.085  -2.587
  166   2HD   ARG  22          1HD       ARG  22  -2.088  -9.734  -1.347
  167    HE   ARG  22           HE       ARG  22  -2.265 -12.139  -0.923
  168   1HH1  ARG  22          1HH2      ARG  22  -0.635 -11.915  -3.824
  169   2HH1  ARG  22          2HH2      ARG  22   0.633 -13.020  -3.411
  170   1HH2  ARG  22          1HH1      ARG  22  -0.276 -13.232  -0.073
  171   2HH2  ARG  22          2HH1      ARG  22   0.837 -13.766  -1.289
  172    H    GLN  23           H        GLN  23  -4.507  -6.589  -0.422
  173    HA   GLN  23           HA       GLN  23  -6.414  -5.218  -2.069
  174   1HB   GLN  23          2HB       GLN  23  -8.424  -5.648  -0.628
  175   2HB   GLN  23          1HB       GLN  23  -7.899  -7.079  -1.513
  176   1HG   GLN  23          2HG       GLN  23  -6.567  -7.731   0.550
  177   2HG   GLN  23          1HG       GLN  23  -7.406  -6.434   1.402
  178   1HE2  GLN  23          1HE2      GLN  23  -9.463  -6.924   2.231
  179   2HE2  GLN  23          2HE2      GLN  23 -10.340  -8.328   1.850
  180    H    LEU  24           H        LEU  24  -6.577  -3.123  -1.248
  181    HA   LEU  24           HA       LEU  24  -5.869  -2.701   1.608
  182   1HB   LEU  24          2HB       LEU  24  -4.406  -1.705  -0.816
  183   2HB   LEU  24          1HB       LEU  24  -4.479  -0.693   0.621
  184    HG   LEU  24           HG       LEU  24  -3.594  -3.580   0.690
  185   1HD1  LEU  24          1HD1      LEU  24  -1.602  -2.958  -0.145
  186   2HD1  LEU  24          2HD1      LEU  24  -1.439  -1.761   1.140
  187   3HD1  LEU  24          3HD1      LEU  24  -2.211  -1.319  -0.382
  188   1HD2  LEU  24          1HD2      LEU  24  -4.438  -2.043   2.731
  189   2HD2  LEU  24          2HD2      LEU  24  -2.756  -1.518   2.671
  190   3HD2  LEU  24          3HD2      LEU  24  -3.141  -3.222   2.918
  191    H    THR  25           H        THR  25  -6.519  -0.577   2.381
  192    HA   THR  25           HA       THR  25  -8.941   0.407   1.053
  193    HB   THR  25           HB       THR  25  -9.197   1.826   2.986
  194    HG1  THR  25           HG1      THR  25  -7.422   1.946   4.494
  195   1HG2  THR  25          1HG2      THR  25  -8.783   0.186   4.873
  196   2HG2  THR  25          2HG2      THR  25  -7.987  -0.856   3.694
  197   3HG2  THR  25          3HG2      THR  25  -9.697  -0.463   3.512
  198    H    LEU  26           H        LEU  26  -8.966   3.029   0.965
  199    HA   LEU  26           HA       LEU  26  -7.103   3.730  -1.083
  200   1HB   LEU  26          2HB       LEU  26  -9.390   4.895  -0.171
  201   2HB   LEU  26          1HB       LEU  26  -8.182   5.975   0.525
  202    HG   LEU  26           HG       LEU  26  -7.935   5.135  -2.350
  203   1HD1  LEU  26          1HD1      LEU  26  -9.999   6.910  -1.146
  204   2HD1  LEU  26          2HD1      LEU  26 -10.046   5.986  -2.648
  205   3HD1  LEU  26          3HD1      LEU  26  -9.183   7.523  -2.585
  206   1HD2  LEU  26          1HD2      LEU  26  -6.074   6.382  -1.690
  207   2HD2  LEU  26          2HD2      LEU  26  -7.005   7.368  -0.562
  208   3HD2  LEU  26          3HD2      LEU  26  -7.133   7.655  -2.297
  209    H    SER  27           H        SER  27  -7.087   4.311   2.419
  210    HA   SER  27           HA       SER  27  -4.395   5.548   2.172
  211   1HB   SER  27          2HB       SER  27  -6.525   6.234   3.738
  212   2HB   SER  27          1HB       SER  27  -5.593   5.237   4.850
  213    HG   SER  27           HG       SER  27  -4.569   7.398   3.314
  214    H    GLY  28           H        GLY  28  -4.952   2.613   1.823
  215   1HA   GLY  28          2HA       GLY  28  -3.507   1.508   4.189
  216   2HA   GLY  28          1HA       GLY  28  -4.400   0.546   3.009
  217    H    ILE  29           H        ILE  29  -3.464   1.623   0.670
  218    HA   ILE  29           HA       ILE  29  -1.082   0.224   0.158
  219    HB   ILE  29           HB       ILE  29  -2.690   1.016  -1.537
  220   1HG1  ILE  29          2HG1      ILE  29  -0.174   0.524  -1.982
  221   2HG1  ILE  29          1HG1      ILE  29  -1.105   1.336  -3.238
  222   1HG2  ILE  29          1HG2      ILE  29  -1.459   3.728  -1.180
  223   2HG2  ILE  29          2HG2      ILE  29  -2.983   3.270  -0.440
  224   3HG2  ILE  29          3HG2      ILE  29  -2.826   3.300  -2.196
  225   1HD1  ILE  29          1HD1      ILE  29   1.263   2.259  -2.081
  226   2HD1  ILE  29          2HD1      ILE  29   0.003   3.240  -1.337
  227   3HD1  ILE  29          3HD1      ILE  29   0.160   3.197  -3.082
  228    H    TYR  30           H        TYR  30  -1.620   3.563   1.079
  229    HA   TYR  30           HA       TYR  30   1.097   4.451   0.773
  230   1HB   TYR  30          2HB       TYR  30  -0.910   5.568   2.743
  231   2HB   TYR  30          1HB       TYR  30   0.403   6.424   1.928
  232    HD1  TYR  30           HD1      TYR  30   0.208   5.415  -0.789
  233    HD2  TYR  30           HD2      TYR  30  -2.905   6.555   1.910
  234    HE1  TYR  30           HE1      TYR  30  -1.256   5.874  -2.712
  235    HE2  TYR  30           HE2      TYR  30  -4.399   7.014  -0.019
  236    HH   TYR  30           HH       TYR  30  -4.453   6.073  -2.567
  237    H    ALA  31           H        ALA  31  -0.670   3.801   3.833
  238    HA   ALA  31           HA       ALA  31   1.650   3.839   5.465
  239   1HB   ALA  31          1HB       ALA  31   0.263   2.545   7.095
  240   2HB   ALA  31          2HB       ALA  31  -0.960   2.342   5.839
  241   3HB   ALA  31          3HB       ALA  31  -0.574   3.954   6.444
  242    H    HIS  32           H        HIS  32   0.583   1.459   3.209
  243    HA   HIS  32           HA       HIS  32   1.923  -0.796   4.484
  244   1HB   HIS  32          2HB       HIS  32   0.024  -1.100   2.917
  245   2HB   HIS  32          1HB       HIS  32   1.016  -0.456   1.610
  246    HD1  HIS  32           HD1      HIS  32   0.006  -3.589   2.890
  247    HD2  HIS  32           HD2      HIS  32   3.683  -2.079   1.631
  248    HE1  HIS  32           HE1      HIS  32   1.478  -5.594   2.409
  249    H    ILE  33           H        ILE  33   2.608   1.030   1.489
  250    HA   ILE  33           HA       ILE  33   5.195  -0.088   1.065
  251    HB   ILE  33           HB       ILE  33   5.584   1.956  -0.330
  252   1HG1  ILE  33          2HG1      ILE  33   3.350   3.289  -0.610
  253   2HG1  ILE  33          1HG1      ILE  33   3.024   2.729   1.025
  254   1HG2  ILE  33          1HG2      ILE  33   3.957  -0.203  -0.787
  255   2HG2  ILE  33          2HG2      ILE  33   4.370   1.004  -2.005
  256   3HG2  ILE  33          3HG2      ILE  33   2.858   1.140  -1.106
  257   1HD1  ILE  33          1HD1      ILE  33   4.338   4.375   1.809
  258   2HD1  ILE  33          2HD1      ILE  33   4.772   4.850   0.168
  259   3HD1  ILE  33          3HD1      ILE  33   5.712   3.617   1.006
  260    H    THR  34           H        THR  34   4.137   2.563   3.090
  261    HA   THR  34           HA       THR  34   6.593   3.912   3.462
  262    HB   THR  34           HB       THR  34   5.673   4.455   5.774
  263    HG1  THR  34           HG1      THR  34   4.430   2.311   5.563
  264   1HG2  THR  34          1HG2      THR  34   4.360   6.072   4.845
  265   2HG2  THR  34          2HG2      THR  34   3.413   4.910   3.918
  266   3HG2  THR  34          3HG2      THR  34   4.992   5.427   3.329
  267    H    LYS  35           H        LYS  35   5.627   0.755   4.394
  268    HA   LYS  35           HA       LYS  35   7.687   0.474   6.477
  269   1HB   LYS  35          2HB       LYS  35   5.297  -0.859   5.881
  270   2HB   LYS  35          1HB       LYS  35   6.560  -2.013   5.454
  271   1HG   LYS  35          2HG       LYS  35   7.068  -0.604   7.981
  272   2HG   LYS  35          1HG       LYS  35   5.607  -1.593   8.006
  273   1HD   LYS  35          2HD       LYS  35   7.001  -3.326   8.433
  274   2HD   LYS  35          1HD       LYS  35   7.409  -3.236   6.719
  275   1HE   LYS  35          2HE       LYS  35   9.492  -2.503   7.172
  276   2HE   LYS  35          1HE       LYS  35   8.879  -1.254   8.256
  277   1HZ   LYS  35          1HZ       LYS  35   8.636  -3.887   9.351
  278   2HZ   LYS  35          2HZ       LYS  35   9.326  -2.491  10.030
  279   3HZ   LYS  35          3HZ       LYS  35  10.247  -3.484   9.003
  280    H    HIS  36           H        HIS  36   7.147  -0.366   3.093
  281    HA   HIS  36           HA       HIS  36   9.649  -1.893   2.914
  282   1HB   HIS  36          2HB       HIS  36   7.458  -1.134   1.001
  283   2HB   HIS  36          1HB       HIS  36   9.008  -1.690   0.369
  284    HD1  HIS  36           HD1      HIS  36   9.732  -4.141   0.953
  285    HD2  HIS  36           HD2      HIS  36   5.900  -3.139   2.254
  286    HE1  HIS  36           HE1      HIS  36   8.601  -6.315   1.589
  287    H    TYR  37           H        TYR  37   8.503   0.885   0.951
  288    HA   TYR  37           HA       TYR  37  11.269   1.737   0.539
  289   1HB   TYR  37          2HB       TYR  37   8.801   3.338  -0.146
  290   2HB   TYR  37          1HB       TYR  37  10.376   3.386  -0.931
  291    HD1  TYR  37           HD1      TYR  37   7.546   2.866  -2.151
  292    HD2  TYR  37           HD2      TYR  37  10.744   0.290  -0.896
  293    HE1  TYR  37           HE1      TYR  37   6.782   1.142  -3.757
  294    HE2  TYR  37           HE2      TYR  37   9.980  -1.439  -2.504
  295    HH   TYR  37           HH       TYR  37   7.874  -0.820  -5.002
  296    HA   PRO  38           HA       PRO  38  11.235   4.273   4.184
  297   1HB   PRO  38          2HB       PRO  38  13.734   5.346   3.804
  298   2HB   PRO  38          1HB       PRO  38  13.451   3.712   4.428
  299   1HG   PRO  38          2HG       PRO  38  14.398   4.551   1.731
  300   2HG   PRO  38          1HG       PRO  38  14.660   3.023   2.585
  301   1HD   PRO  38          2HD       PRO  38  12.785   3.475   0.501
  302   2HD   PRO  38          1HD       PRO  38  12.868   2.045   1.551
  303    H    TYR  39           H        TYR  39  12.457   5.737   1.137
  304    HA   TYR  39           HA       TYR  39  11.980   8.440   1.967
  305   1HB   TYR  39          2HB       TYR  39  13.490   8.007   0.123
  306   2HB   TYR  39          1HB       TYR  39  12.202   7.229  -0.798
  307    HD1  TYR  39           HD1      TYR  39  10.193   8.597  -1.503
  308    HD2  TYR  39           HD2      TYR  39  13.757  10.381   0.095
  309    HE1  TYR  39           HE1      TYR  39   9.499  10.795  -2.415
  310    HE2  TYR  39           HE2      TYR  39  13.064  12.580  -0.820
  311    HH   TYR  39           HH       TYR  39  11.584  13.409  -2.687
  312    H    TYR  40           H        TYR  40   9.827   5.980   0.822
  313    HA   TYR  40           HA       TYR  40   7.785   7.971   0.054
  314   1HB   TYR  40          2HB       TYR  40   8.268   5.174  -0.514
  315   2HB   TYR  40          1HB       TYR  40   6.624   5.404   0.082
  316    HD1  TYR  40           HD1      TYR  40   8.427   8.120  -1.636
  317    HD2  TYR  40           HD2      TYR  40   5.606   4.913  -2.103
  318    HE1  TYR  40           HE1      TYR  40   7.751   9.040  -3.830
  319    HE2  TYR  40           HE2      TYR  40   4.935   5.835  -4.305
  320    HH   TYR  40           HH       TYR  40   6.724   8.182  -5.936
  321    H    ARG  41           H        ARG  41   8.848   7.210   2.937
  322    HA   ARG  41           HA       ARG  41   6.548   6.236   4.355
  323   1HB   ARG  41          2HB       ARG  41   8.700   6.241   5.470
  324   2HB   ARG  41          1HB       ARG  41   8.862   7.984   5.251
  325   1HG   ARG  41          2HG       ARG  41   7.459   8.468   6.983
  326   2HG   ARG  41          1HG       ARG  41   6.391   7.109   6.627
  327   1HD   ARG  41          2HD       ARG  41   7.662   6.892   8.802
  328   2HD   ARG  41          1HD       ARG  41   7.898   5.551   7.680
  329    HE   ARG  41           HE       ARG  41   9.924   7.534   7.243
  330   1HH1  ARG  41          1HH2      ARG  41   9.968   4.427   7.786
  331   2HH1  ARG  41          2HH2      ARG  41  11.062   4.396   9.129
  332   1HH2  ARG  41          1HH1      ARG  41  10.870   7.809   9.704
  333   2HH2  ARG  41          2HH1      ARG  41  11.573   6.310  10.215
  334    H    THR  42           H        THR  42   7.742   9.516   3.668
  335    HA   THR  42           HA       THR  42   4.956  10.513   4.071
  336    HB   THR  42           HB       THR  42   6.217  11.211   6.033
  337    HG1  THR  42           HG1      THR  42   6.354  13.575   5.421
  338   1HG2  THR  42          1HG2      THR  42   8.327  11.554   4.026
  339   2HG2  THR  42          2HG2      THR  42   8.462  11.271   5.762
  340   3HG2  THR  42          3HG2      THR  42   8.211  12.907   5.151
  341    H    ALA  43           H        ALA  43   5.393   9.950   1.608
  342    HA   ALA  43           HA       ALA  43   7.045  11.618   0.011
  343   1HB   ALA  43          1HB       ALA  43   4.754   9.815  -0.429
  344   2HB   ALA  43          2HB       ALA  43   6.244   9.987  -1.355
  345   3HB   ALA  43          3HB       ALA  43   4.905  11.101  -1.627
  346    H    ASP  44           H        ASP  44   5.560  12.962  -1.818
  347    HA   ASP  44           HA       ASP  44   4.362  15.143  -0.177
  348   1HB   ASP  44          2HB       ASP  44   4.985  15.441  -3.092
  349   2HB   ASP  44          1HB       ASP  44   5.075  16.644  -1.803
  350    H    LYS  45           H        LYS  45   2.869  16.385  -2.228
  351    HA   LYS  45           HA       LYS  45   0.560  14.564  -2.312
  352   1HB   LYS  45          2HB       LYS  45   0.978  17.420  -2.338
  353   2HB   LYS  45          1HB       LYS  45  -0.037  16.949  -3.701
  354   1HG   LYS  45          2HG       LYS  45  -1.744  16.213  -2.356
  355   2HG   LYS  45          1HG       LYS  45  -0.648  15.667  -1.087
  356   1HD   LYS  45          2HD       LYS  45  -0.955  18.605  -1.662
  357   2HD   LYS  45          1HD       LYS  45  -2.128  17.771  -0.642
  358   1HE   LYS  45          2HE       LYS  45  -0.668  18.223   1.040
  359   2HE   LYS  45          1HE       LYS  45   0.237  16.855   0.394
  360   1HZ   LYS  45          1HZ       LYS  45   1.037  19.515   0.530
  361   2HZ   LYS  45          2HZ       LYS  45   0.826  19.152  -1.115
  362   3HZ   LYS  45          3HZ       LYS  45   1.873  18.213  -0.164
  363    H    GLY  46           H        GLY  46   1.105  13.015  -3.886
  364   1HA   GLY  46          2HA       GLY  46   0.707  13.843  -6.657
  365   2HA   GLY  46          1HA       GLY  46   2.343  13.249  -6.334
  366    H    TRP  47           H        TRP  47   2.322  11.121  -5.006
  367    HA   TRP  47           HA       TRP  47   0.830   9.145  -6.496
  368   1HB   TRP  47          2HB       TRP  47   1.982   7.531  -5.177
  369   2HB   TRP  47          1HB       TRP  47   3.123   8.849  -5.428
  370    HD1  TRP  47           HD1      TRP  47   2.413  10.901  -3.287
  371    HE1  TRP  47           HE1      TRP  47   2.650  10.372  -0.780
  372    HE3  TRP  47           HE3      TRP  47   2.165   5.813  -3.452
  373    HZ2  TRP  47           HZ2      TRP  47   2.719   8.077   0.938
  374    HZ3  TRP  47           HZ3      TRP  47   2.317   4.483  -1.380
  375    HH2  TRP  47           HH2      TRP  47   2.592   5.599   0.819
  376    H    GLN  48           H        GLN  48   0.340  10.782  -3.442
  377    HA   GLN  48           HA       GLN  48  -1.379   9.141  -2.047
  378   1HB   GLN  48          2HB       GLN  48  -2.819  11.549  -2.020
  379   2HB   GLN  48          1HB       GLN  48  -1.583  11.063  -0.870
  380   1HG   GLN  48          2HG       GLN  48  -0.888  13.192  -1.609
  381   2HG   GLN  48          1HG       GLN  48   0.116  12.092  -2.531
  382   1HE2  GLN  48          1HE2      GLN  48  -1.107  11.439  -4.787
  383   2HE2  GLN  48          2HE2      GLN  48  -1.786  12.732  -5.601
  384    H    ASN  49           H        ASN  49  -3.210  11.597  -3.820
  385    HA   ASN  49           HA       ASN  49  -5.382   9.836  -4.357
  386   1HB   ASN  49          2HB       ASN  49  -5.665  12.267  -4.331
  387   2HB   ASN  49          1HB       ASN  49  -4.602  12.425  -5.730
  388   1HD2  ASN  49          1HD2      ASN  49  -6.133  13.158  -7.282
  389   2HD2  ASN  49          2HD2      ASN  49  -7.486  12.251  -7.757
  390    H    SER  50           H        SER  50  -2.638  10.832  -6.412
  391    HA   SER  50           HA       SER  50  -3.470   9.659  -8.836
  392   1HB   SER  50          2HB       SER  50  -1.387  11.030  -8.504
  393   2HB   SER  50          1HB       SER  50  -0.640   9.627  -7.746
  394    HG   SER  50           HG       SER  50  -1.669   9.826 -10.388
  395    H    ILE  51           H        ILE  51  -2.603   8.147  -5.880
  396    HA   ILE  51           HA       ILE  51  -1.929   5.546  -7.035
  397    HB   ILE  51           HB       ILE  51  -2.200   6.729  -4.299
  398   1HG1  ILE  51          2HG1      ILE  51   0.036   6.633  -4.946
  399   2HG1  ILE  51          1HG1      ILE  51  -0.120   5.139  -4.041
  400   1HG2  ILE  51          1HG2      ILE  51  -3.477   4.901  -3.680
  401   2HG2  ILE  51          2HG2      ILE  51  -1.868   4.201  -3.510
  402   3HG2  ILE  51          3HG2      ILE  51  -2.822   3.875  -4.957
  403   1HD1  ILE  51          1HD1      ILE  51  -0.668   4.040  -6.294
  404   2HD1  ILE  51          2HD1      ILE  51   1.004   4.537  -6.028
  405   3HD1  ILE  51          3HD1      ILE  51  -0.061   5.522  -7.026
  406    H    ARG  52           H        ARG  52  -4.646   6.722  -4.991
  407    HA   ARG  52           HA       ARG  52  -6.320   4.490  -5.237
  408   1HB   ARG  52          2HB       ARG  52  -7.018   6.303  -3.820
  409   2HB   ARG  52          1HB       ARG  52  -6.995   7.442  -5.166
  410   1HG   ARG  52          2HG       ARG  52  -8.694   5.268  -5.898
  411   2HG   ARG  52          1HG       ARG  52  -9.162   5.802  -4.283
  412   1HD   ARG  52          2HD       ARG  52  -8.886   8.210  -5.410
  413   2HD   ARG  52          1HD       ARG  52  -9.248   7.289  -6.869
  414    HE   ARG  52           HE       ARG  52 -11.189   6.486  -5.045
  415   1HH1  ARG  52          1HH2      ARG  52 -11.005   8.582  -7.527
  416   2HH1  ARG  52          2HH2      ARG  52 -12.112   9.762  -6.907
  417   1HH2  ARG  52          1HH1      ARG  52 -12.213   8.384  -3.726
  418   2HH2  ARG  52          2HH1      ARG  52 -12.796   9.649  -4.754
  419    H    HIS  53           H        HIS  53  -5.664   7.077  -7.505
  420    HA   HIS  53           HA       HIS  53  -7.649   6.266  -9.465
  421   1HB   HIS  53          2HB       HIS  53  -6.272   8.550  -9.049
  422   2HB   HIS  53          1HB       HIS  53  -5.244   7.820 -10.282
  423    HD1  HIS  53           HD1      HIS  53  -7.543   6.379 -11.878
  424    HD2  HIS  53           HD2      HIS  53  -7.597  10.382 -10.717
  425    HE1  HIS  53           HE1      HIS  53  -9.146   7.557 -13.445
  426    H    ASN  54           H        ASN  54  -4.210   5.655  -8.921
  427    HA   ASN  54           HA       ASN  54  -3.662   4.425 -11.443
  428   1HB   ASN  54          2HB       ASN  54  -2.353   4.419  -8.745
  429   2HB   ASN  54          1HB       ASN  54  -1.801   3.280  -9.972
  430   1HD2  ASN  54          1HD2      ASN  54  -0.734   6.021  -8.775
  431   2HD2  ASN  54          2HD2      ASN  54  -0.242   6.851 -10.173
  432    H    LEU  55           H        LEU  55  -4.916   3.049  -8.385
  433    HA   LEU  55           HA       LEU  55  -4.558   0.337  -9.349
  434   1HB   LEU  55          2HB       LEU  55  -6.573   0.950  -7.218
  435   2HB   LEU  55          1HB       LEU  55  -5.500  -0.425  -7.368
  436    HG   LEU  55           HG       LEU  55  -4.362   0.640  -5.722
  437   1HD1  LEU  55          1HD1      LEU  55  -3.307   2.710  -7.558
  438   2HD1  LEU  55          2HD1      LEU  55  -3.126   1.036  -8.082
  439   3HD1  LEU  55          3HD1      LEU  55  -2.448   1.558  -6.543
  440   1HD2  LEU  55          1HD2      LEU  55  -5.885   2.300  -5.134
  441   2HD2  LEU  55          2HD2      LEU  55  -5.800   3.076  -6.715
  442   3HD2  LEU  55          3HD2      LEU  55  -4.462   3.241  -5.577
  443    H    SER  56           H        SER  56  -6.733   2.739 -10.210
  444    HA   SER  56           HA       SER  56  -8.977   0.881 -10.712
  445   1HB   SER  56          2HB       SER  56  -9.094   3.599 -11.857
  446   2HB   SER  56          1HB       SER  56 -10.279   2.738 -10.880
  447    HG   SER  56           HG       SER  56  -8.915   4.660 -10.022
  448    H    LEU  57           H        LEU  57  -6.957   3.101 -12.651
  449    HA   LEU  57           HA       LEU  57  -7.734   1.670 -15.107
  450   1HB   LEU  57          2HB       LEU  57  -6.486   3.443 -16.239
  451   2HB   LEU  57          1HB       LEU  57  -7.594   4.148 -15.065
  452    HG   LEU  57           HG       LEU  57  -5.326   3.715 -13.556
  453   1HD1  LEU  57          1HD1      LEU  57  -4.492   4.690 -16.305
  454   2HD1  LEU  57          2HD1      LEU  57  -4.065   3.128 -15.607
  455   3HD1  LEU  57          3HD1      LEU  57  -3.457   4.616 -14.879
  456   1HD2  LEU  57          1HD2      LEU  57  -4.979   6.283 -14.235
  457   2HD2  LEU  57          2HD2      LEU  57  -6.335   5.768 -13.231
  458   3HD2  LEU  57          3HD2      LEU  57  -6.570   6.041 -14.957
  459    H    ASN  58           H        ASN  58  -5.681   0.809 -12.807
  460    HA   ASN  58           HA       ASN  58  -3.171   0.552 -14.208
  461   1HB   ASN  58          2HB       ASN  58  -4.142  -0.135 -11.604
  462   2HB   ASN  58          1HB       ASN  58  -3.415  -1.574 -12.317
  463   1HD2  ASN  58          1HD2      ASN  58  -2.590   1.935 -12.590
  464   2HD2  ASN  58          2HD2      ASN  58  -0.967   1.734 -12.133
  465    H    ARG  59           H        ARG  59  -2.301  -1.909 -14.391
  466    HA   ARG  59           HA       ARG  59  -4.065  -3.108 -16.429
  467   1HB   ARG  59          2HB       ARG  59  -2.011  -4.643 -16.717
  468   2HB   ARG  59          1HB       ARG  59  -1.827  -2.947 -17.161
  469   1HG   ARG  59          2HG       ARG  59  -0.437  -2.491 -15.392
  470   2HG   ARG  59          1HG       ARG  59  -1.238  -3.652 -14.331
  471   1HD   ARG  59          2HD       ARG  59   1.165  -4.196 -15.190
  472   2HD   ARG  59          1HD       ARG  59  -0.052  -5.473 -15.215
  473    HE   ARG  59           HE       ARG  59  -0.389  -4.732 -17.681
  474   1HH1  ARG  59          1HH2      ARG  59   2.234  -3.091 -16.546
  475   2HH1  ARG  59          2HH2      ARG  59   3.390  -3.763 -17.646
  476   1HH2  ARG  59          1HH1      ARG  59   1.232  -6.204 -18.836
  477   2HH2  ARG  59          2HH1      ARG  59   2.823  -5.527 -18.944
  478    H    TYR  60           H        TYR  60  -3.122  -3.735 -13.128
  479    HA   TYR  60           HA       TYR  60  -4.581  -6.337 -13.338
  480   1HB   TYR  60          2HB       TYR  60  -2.972  -6.881 -11.267
  481   2HB   TYR  60          1HB       TYR  60  -2.522  -7.237 -12.931
  482    HD1  TYR  60           HD1      TYR  60  -2.594  -3.999 -10.967
  483    HD2  TYR  60           HD2      TYR  60  -0.272  -6.847 -13.193
  484    HE1  TYR  60           HE1      TYR  60  -0.606  -2.535 -10.806
  485    HE2  TYR  60           HE2      TYR  60   1.707  -5.384 -13.026
  486    HH   TYR  60           HH       TYR  60   1.729  -2.567 -10.972
  487    H    PHE  61           H        PHE  61  -4.351  -3.323 -11.765
  488    HA   PHE  61           HA       PHE  61  -5.461  -4.252  -9.229
  489   1HB   PHE  61          2HB       PHE  61  -5.122  -1.505 -10.439
  490   2HB   PHE  61          1HB       PHE  61  -5.784  -1.778  -8.825
  491    HD1  PHE  61           HD1      PHE  61  -2.969  -0.599 -10.083
  492    HD2  PHE  61           HD2      PHE  61  -4.173  -4.050  -7.849
  493    HE1  PHE  61           HE1      PHE  61  -0.670  -0.836  -9.233
  494    HE2  PHE  61           HE2      PHE  61  -1.870  -4.280  -6.982
  495    HZ   PHE  61           HZ       PHE  61  -0.122  -2.665  -7.663
  496    H    ILE  62           H        ILE  62  -7.620  -3.494  -8.473
  497    HA   ILE  62           HA       ILE  62  -9.606  -2.933 -10.578
  498    HB   ILE  62           HB       ILE  62 -10.813  -4.925 -10.402
  499   1HG1  ILE  62          2HG1      ILE  62  -9.372  -5.432  -7.777
  500   2HG1  ILE  62          1HG1      ILE  62 -11.053  -4.930  -7.959
  501   1HG2  ILE  62          1HG2      ILE  62  -8.549  -5.348 -11.382
  502   2HG2  ILE  62          2HG2      ILE  62  -9.243  -6.777 -10.615
  503   3HG2  ILE  62          3HG2      ILE  62  -7.990  -5.852  -9.787
  504   1HD1  ILE  62          1HD1      ILE  62 -10.582  -7.454  -7.600
  505   2HD1  ILE  62          2HD1      ILE  62 -10.032  -7.444  -9.276
  506   3HD1  ILE  62          3HD1      ILE  62 -11.696  -7.002  -8.889
  507    H    LYS  63           H        LYS  63 -11.918  -3.128  -9.286
  508    HA   LYS  63           HA       LYS  63 -11.521  -1.811  -6.633
  509   1HB   LYS  63          2HB       LYS  63 -13.115  -0.901  -9.002
  510   2HB   LYS  63          1HB       LYS  63 -13.749  -0.572  -7.388
  511   1HG   LYS  63          2HG       LYS  63 -11.509   0.426  -6.798
  512   2HG   LYS  63          1HG       LYS  63 -11.055   0.265  -8.495
  513   1HD   LYS  63          2HD       LYS  63 -12.012   2.279  -8.832
  514   2HD   LYS  63          1HD       LYS  63 -13.567   1.491  -8.565
  515   1HE   LYS  63          2HE       LYS  63 -13.430   3.359  -7.041
  516   2HE   LYS  63          1HE       LYS  63 -13.246   1.884  -6.091
  517   1HZ   LYS  63          1HZ       LYS  63 -10.710   2.432  -6.801
  518   2HZ   LYS  63          2HZ       LYS  63 -11.418   2.882  -5.323
  519   3HZ   LYS  63          3HZ       LYS  63 -11.347   3.993  -6.606
  520    H    VAL  64           H        VAL  64 -12.922  -2.533  -5.034
  521    HA   VAL  64           HA       VAL  64 -14.325  -5.006  -5.491
  522    HB   VAL  64           HB       VAL  64 -15.023  -4.831  -3.170
  523   1HG1  VAL  64          1HG1      VAL  64 -12.763  -4.247  -2.127
  524   2HG1  VAL  64          2HG1      VAL  64 -12.231  -3.829  -3.755
  525   3HG1  VAL  64          3HG1      VAL  64 -12.736  -5.478  -3.390
  526   1HG2  VAL  64          1HG2      VAL  64 -14.215  -2.586  -2.018
  527   2HG2  VAL  64          2HG2      VAL  64 -15.785  -2.659  -2.818
  528   3HG2  VAL  64          3HG2      VAL  64 -14.408  -1.932  -3.644
  529    HA   PRO  65           HA       PRO  65 -18.239  -3.426  -6.742
  530   1HB   PRO  65          2HB       PRO  65 -19.714  -5.686  -6.218
  531   2HB   PRO  65          1HB       PRO  65 -18.632  -5.527  -7.612
  532   1HG   PRO  65          2HG       PRO  65 -18.238  -7.087  -5.102
  533   2HG   PRO  65          1HG       PRO  65 -17.549  -7.358  -6.711
  534   1HD   PRO  65          2HD       PRO  65 -16.216  -6.177  -4.507
  535   2HD   PRO  65          1HD       PRO  65 -15.659  -6.174  -6.193
  536    H    ARG  66           H        ARG  66 -20.707  -4.001  -5.652
  537    HA   ARG  66           HA       ARG  66 -20.515  -2.685  -3.011
  538   1HB   ARG  66          2HB       ARG  66 -22.167  -2.086  -4.956
  539   2HB   ARG  66          1HB       ARG  66 -23.101  -3.449  -4.343
  540   1HG   ARG  66          2HG       ARG  66 -22.218  -1.804  -2.141
  541   2HG   ARG  66          1HG       ARG  66 -23.063  -0.810  -3.329
  542   1HD   ARG  66          2HD       ARG  66 -24.579  -3.167  -3.145
  543   2HD   ARG  66          1HD       ARG  66 -24.150  -2.768  -1.482
  544    HE   ARG  66           HE       ARG  66 -25.627  -0.941  -3.328
  545   1HH1  ARG  66          1HH2      ARG  66 -24.015   0.161  -0.928
  546   2HH1  ARG  66          2HH2      ARG  66 -25.277   0.321   0.247
  547   1HH2  ARG  66          1HH1      ARG  66 -27.523  -1.654  -1.504
  548   2HH2  ARG  66          2HH1      ARG  66 -27.261  -0.705  -0.079
  549    H    SER  67           H        SER  67 -20.956  -5.835  -4.304
  550    HA   SER  67           HA       SER  67 -22.389  -6.827  -1.920
  551   1HB   SER  67          2HB       SER  67 -21.865  -9.083  -3.194
  552   2HB   SER  67          1HB       SER  67 -23.123  -8.003  -3.787
  553    HG   SER  67           HG       SER  67 -20.441  -7.736  -4.620
  554    H    GLN  68           H        GLN  68 -20.451  -6.008  -0.593
  555    HA   GLN  68           HA       GLN  68 -18.206  -7.974  -0.660
  556   1HB   GLN  68          2HB       GLN  68 -18.079  -5.254  -0.570
  557   2HB   GLN  68          1HB       GLN  68 -18.041  -5.638   1.150
  558   1HG   GLN  68          2HG       GLN  68 -16.317  -7.510   0.048
  559   2HG   GLN  68          1HG       GLN  68 -15.984  -6.053  -0.888
  560   1HE2  GLN  68          1HE2      GLN  68 -14.945  -7.626   1.824
  561   2HE2  GLN  68          2HE2      GLN  68 -14.426  -6.300   2.748
  562    H    GLU  69           H        GLU  69 -17.310  -8.266   1.742
  563    HA   GLU  69           HA       GLU  69 -19.658  -9.119   3.373
  564   1HB   GLU  69          2HB       GLU  69 -16.751  -9.984   3.465
  565   2HB   GLU  69          1HB       GLU  69 -18.015 -10.594   4.532
  566   1HG   GLU  69          2HG       GLU  69 -19.235 -11.521   2.652
  567   2HG   GLU  69          1HG       GLU  69 -18.116 -10.780   1.509
  568    H    GLU  70           H        GLU  70 -18.899  -6.366   3.404
  569    HA   GLU  70           HA       GLU  70 -18.368  -6.070   6.276
  570   1HB   GLU  70          2HB       GLU  70 -16.093  -6.178   5.185
  571   2HB   GLU  70          1HB       GLU  70 -16.522  -4.722   4.286
  572   1HG   GLU  70          2HG       GLU  70 -17.146  -3.842   6.726
  573   2HG   GLU  70          1HG       GLU  70 -15.954  -5.053   7.199
  574    HA   PRO  71           HA       PRO  71 -21.225  -2.899   4.721
  575   1HB   PRO  71          2HB       PRO  71 -22.817  -2.967   6.961
  576   2HB   PRO  71          1HB       PRO  71 -23.006  -4.080   5.594
  577   1HG   PRO  71          2HG       PRO  71 -21.858  -4.604   8.295
  578   2HG   PRO  71          1HG       PRO  71 -22.621  -5.733   7.163
  579   1HD   PRO  71          2HD       PRO  71 -19.835  -5.435   7.597
  580   2HD   PRO  71          1HD       PRO  71 -20.599  -6.329   6.266
  581    H    GLY  72           H        GLY  72 -18.989  -1.728   5.316
  582   1HA   GLY  72          2HA       GLY  72 -19.427  -0.115   7.798
  583   2HA   GLY  72          1HA       GLY  72 -17.829  -0.451   7.120
  584    H    LYS  73           H        LYS  73 -17.544   1.920   7.060
  585    HA   LYS  73           HA       LYS  73 -18.901   3.116   4.676
  586   1HB   LYS  73          2HB       LYS  73 -17.912   4.773   6.990
  587   2HB   LYS  73          1HB       LYS  73 -19.109   5.191   5.765
  588   1HG   LYS  73          2HG       LYS  73 -19.473   3.076   7.909
  589   2HG   LYS  73          1HG       LYS  73 -20.177   4.693   7.947
  590   1HD   LYS  73          2HD       LYS  73 -20.682   3.235   5.441
  591   2HD   LYS  73          1HD       LYS  73 -21.401   2.481   6.864
  592   1HE   LYS  73          2HE       LYS  73 -23.069   3.990   6.211
  593   2HE   LYS  73          1HE       LYS  73 -22.193   4.907   7.437
  594   1HZ   LYS  73          1HZ       LYS  73 -21.492   5.063   4.568
  595   2HZ   LYS  73          2HZ       LYS  73 -21.071   6.135   5.817
  596   3HZ   LYS  73          3HZ       LYS  73 -22.673   6.068   5.255
  597    H    GLY  74           H        GLY  74 -16.838   2.030   3.747
  598   1HA   GLY  74          2HA       GLY  74 -14.853   4.128   3.348
  599   2HA   GLY  74          1HA       GLY  74 -14.219   2.749   4.247
  600    H    SER  75           H        SER  75 -13.899   3.861   1.353
  601    HA   SER  75           HA       SER  75 -14.888   1.757  -0.373
  602   1HB   SER  75          2HB       SER  75 -12.851   3.957  -0.697
  603   2HB   SER  75          1HB       SER  75 -13.096   2.750  -1.956
  604    HG   SER  75           HG       SER  75 -14.940   4.611  -0.882
  605    H    PHE  76           H        PHE  76 -13.572   0.109  -1.415
  606    HA   PHE  76           HA       PHE  76 -10.944  -0.453  -0.156
  607   1HB   PHE  76          2HB       PHE  76 -13.176  -1.707   0.819
  608   2HB   PHE  76          1HB       PHE  76 -12.659  -2.837  -0.432
  609    HD1  PHE  76           HD1      PHE  76 -12.354  -2.195   2.935
  610    HD2  PHE  76           HD2      PHE  76  -9.897  -2.988  -0.497
  611    HE1  PHE  76           HE1      PHE  76 -10.547  -3.022   4.420
  612    HE2  PHE  76           HE2      PHE  76  -8.090  -3.814   0.987
  613    HZ   PHE  76           HZ       PHE  76  -8.415  -3.831   3.445
  614    H    TRP  77           H        TRP  77  -9.632  -0.643  -1.891
  615    HA   TRP  77           HA       TRP  77 -10.714  -1.989  -4.333
  616   1HB   TRP  77          2HB       TRP  77  -9.157  -0.688  -5.610
  617   2HB   TRP  77          1HB       TRP  77  -9.861   0.435  -4.446
  618    HD1  TRP  77           HD1      TRP  77  -8.316   1.294  -2.463
  619    HE1  TRP  77           HE1      TRP  77  -5.763   1.178  -2.089
  620    HE3  TRP  77           HE3      TRP  77  -7.093  -2.105  -6.034
  621    HZ2  TRP  77           HZ2      TRP  77  -3.493  -0.201  -3.191
  622    HZ3  TRP  77           HZ3      TRP  77  -4.752  -2.807  -6.359
  623    HH2  TRP  77           HH2      TRP  77  -2.964  -1.869  -4.952
  624    H    ARG  78           H        ARG  78  -9.151  -3.495  -5.439
  625    HA   ARG  78           HA       ARG  78  -6.842  -4.388  -3.816
  626   1HB   ARG  78          2HB       ARG  78  -7.730  -6.789  -3.936
  627   2HB   ARG  78          1HB       ARG  78  -8.519  -5.721  -2.779
  628   1HG   ARG  78          2HG       ARG  78 -10.457  -5.552  -4.035
  629   2HG   ARG  78          1HG       ARG  78  -9.618  -5.852  -5.556
  630   1HD   ARG  78          2HD       ARG  78  -9.928  -8.086  -5.402
  631   2HD   ARG  78          1HD       ARG  78  -9.437  -8.114  -3.708
  632    HE   ARG  78           HE       ARG  78 -11.847  -7.193  -3.301
  633   1HH1  ARG  78          1HH1      ARG  78 -12.004  -7.812  -6.442
  634   2HH1  ARG  78          2HH1      ARG  78 -13.058  -9.184  -6.376
  635   1HH2  ARG  78          1HH2      ARG  78 -12.726  -9.605  -2.950
  636   2HH2  ARG  78          2HH2      ARG  78 -13.467 -10.200  -4.399
  637    H    ILE  79           H        ILE  79  -5.669  -6.244  -5.001
  638    HA   ILE  79           HA       ILE  79  -5.795  -5.675  -7.933
  639    HB   ILE  79           HB       ILE  79  -3.586  -5.401  -6.863
  640   1HG1  ILE  79          2HG1      ILE  79  -3.197  -7.876  -8.454
  641   2HG1  ILE  79          1HG1      ILE  79  -4.128  -6.594  -9.230
  642   1HG2  ILE  79          1HG2      ILE  79  -4.265  -7.524  -5.319
  643   2HG2  ILE  79          2HG2      ILE  79  -2.612  -6.946  -5.535
  644   3HG2  ILE  79          3HG2      ILE  79  -3.207  -8.297  -6.500
  645   1HD1  ILE  79          1HD1      ILE  79  -2.351  -5.123  -9.258
  646   2HD1  ILE  79          2HD1      ILE  79  -1.475  -6.641  -9.381
  647   3HD1  ILE  79          3HD1      ILE  79  -1.605  -5.836  -7.829
  648    H    ASP  80           H        ASP  80  -5.716  -7.497  -9.435
  649    HA   ASP  80           HA       ASP  80  -7.598  -9.522  -8.838
  650   1HB   ASP  80          2HB       ASP  80  -5.458  -9.404 -10.978
  651   2HB   ASP  80          1HB       ASP  80  -6.724 -10.631 -10.921
  652    HA   PRO  81           HA       PRO  81  -5.226 -12.519  -6.719
  653   1HB   PRO  81          2HB       PRO  81  -6.753 -14.726  -7.299
  654   2HB   PRO  81          1HB       PRO  81  -7.243 -13.466  -6.156
  655   1HG   PRO  81          2HG       PRO  81  -8.265 -14.004  -8.895
  656   2HG   PRO  81          1HG       PRO  81  -9.055 -13.172  -7.547
  657   1HD   PRO  81          2HD       PRO  81  -7.807 -11.951  -9.804
  658   2HD   PRO  81          1HD       PRO  81  -8.415 -11.121  -8.354
  659    H    ALA  82           H        ALA  82  -6.338 -13.987  -9.807
  660    HA   ALA  82           HA       ALA  82  -4.084 -15.742 -10.011
  661   1HB   ALA  82          1HB       ALA  82  -6.390 -14.996 -11.676
  662   2HB   ALA  82          2HB       ALA  82  -5.660 -16.578 -11.403
  663   3HB   ALA  82          3HB       ALA  82  -4.966 -15.483 -12.597
  664    H    SER  83           H        SER  83  -4.405 -12.381 -10.820
  665    HA   SER  83           HA       SER  83  -2.121 -12.498 -12.692
  666   1HB   SER  83          2HB       SER  83  -4.077 -10.414 -11.871
  667   2HB   SER  83          1HB       SER  83  -2.470  -9.837 -12.301
  668    HG   SER  83           HG       SER  83  -2.706 -11.090 -14.251
  669    H    GLU  84           H        GLU  84  -2.487 -12.478  -9.370
  670    HA   GLU  84           HA       GLU  84  -0.584 -10.575  -8.502
  671   1HB   GLU  84          2HB       GLU  84  -1.447 -13.246  -7.395
  672   2HB   GLU  84          1HB       GLU  84  -0.217 -12.275  -6.585
  673   1HG   GLU  84          2HG       GLU  84  -1.710 -10.630  -5.983
  674   2HG   GLU  84          1HG       GLU  84  -2.725 -10.890  -7.401
  675    H    ALA  85           H        ALA  85   0.039 -14.078  -9.057
  676    HA   ALA  85           HA       ALA  85   2.805 -14.039  -8.724
  677   1HB   ALA  85          1HB       ALA  85   2.058 -16.173  -9.215
  678   2HB   ALA  85          2HB       ALA  85   2.700 -15.730 -10.797
  679   3HB   ALA  85          3HB       ALA  85   0.969 -15.614 -10.484
  680    H    LYS  86           H        LYS  86   0.942 -12.558 -11.266
  681    HA   LYS  86           HA       LYS  86   3.244 -12.191 -13.042
  682   1HB   LYS  86          2HB       LYS  86   1.028 -12.388 -14.030
  683   2HB   LYS  86          1HB       LYS  86   0.444 -11.027 -13.072
  684   1HG   LYS  86          2HG       LYS  86   2.849 -10.327 -14.551
  685   2HG   LYS  86          1HG       LYS  86   1.572 -10.890 -15.629
  686   1HD   LYS  86          2HD       LYS  86   0.091  -9.196 -14.974
  687   2HD   LYS  86          1HD       LYS  86   0.936  -8.916 -13.450
  688   1HE   LYS  86          2HE       LYS  86   1.992  -8.243 -16.212
  689   2HE   LYS  86          1HE       LYS  86   1.392  -7.085 -15.024
  690   1HZ   LYS  86          1HZ       LYS  86   3.169  -8.297 -13.537
  691   2HZ   LYS  86          2HZ       LYS  86   3.598  -7.009 -14.557
  692   3HZ   LYS  86          3HZ       LYS  86   3.886  -8.612 -15.041
  693    H    LEU  87           H        LEU  87   1.079  -9.802 -11.484
  694    HA   LEU  87           HA       LEU  87   2.701  -7.560 -11.793
  695   1HB   LEU  87          2HB       LEU  87   1.654  -7.024  -9.339
  696   2HB   LEU  87          1HB       LEU  87   0.773  -6.826 -10.840
  697    HG   LEU  87           HG       LEU  87   0.677  -9.568  -9.774
  698   1HD1  LEU  87          1HD1      LEU  87   0.491  -8.747  -7.616
  699   2HD1  LEU  87          2HD1      LEU  87  -1.191  -8.661  -8.139
  700   3HD1  LEU  87          3HD1      LEU  87  -0.188  -7.210  -8.147
  701   1HD2  LEU  87          1HD2      LEU  87  -1.218  -7.499 -10.877
  702   2HD2  LEU  87          2HD2      LEU  87  -1.833  -8.982 -10.155
  703   3HD2  LEU  87          3HD2      LEU  87  -0.784  -9.051 -11.570
  704    H    VAL  88           H        VAL  88   2.556  -9.513  -8.840
  705    HA   VAL  88           HA       VAL  88   4.531  -8.388  -7.328
  706    HB   VAL  88           HB       VAL  88   5.068 -10.692  -6.579
  707   1HG1  VAL  88          1HG1      VAL  88   2.378 -11.184  -6.353
  708   2HG1  VAL  88          2HG1      VAL  88   2.399  -9.460  -6.726
  709   3HG1  VAL  88          3HG1      VAL  88   3.271 -10.069  -5.318
  710   1HG2  VAL  88          1HG2      VAL  88   3.800 -11.241  -9.159
  711   2HG2  VAL  88          2HG2      VAL  88   3.158 -12.231  -7.849
  712   3HG2  VAL  88          3HG2      VAL  88   4.885 -12.259  -8.210
  713    H    GLU  89           H        GLU  89   5.058 -10.334 -10.240
  714    HA   GLU  89           HA       GLU  89   7.818 -10.840  -9.960
  715   1HB   GLU  89          2HB       GLU  89   5.969 -11.193 -11.981
  716   2HB   GLU  89          1HB       GLU  89   7.050  -9.979 -12.669
  717   1HG   GLU  89          2HG       GLU  89   8.405 -11.713 -13.201
  718   2HG   GLU  89          1HG       GLU  89   8.803 -11.765 -11.483
  719    H    GLN  90           H        GLN  90   6.251  -8.003 -11.481
  720    HA   GLN  90           HA       GLN  90   8.782  -6.555 -11.618
  721   1HB   GLN  90          2HB       GLN  90   5.963  -5.466 -11.895
  722   2HB   GLN  90          1HB       GLN  90   7.451  -4.710 -12.465
  723   1HG   GLN  90          2HG       GLN  90   7.321  -7.374 -13.519
  724   2HG   GLN  90          1HG       GLN  90   5.794  -6.558 -13.856
  725   1HE2  GLN  90          1HE2      GLN  90   6.422  -6.426 -16.172
  726   2HE2  GLN  90          2HE2      GLN  90   7.555  -5.271 -16.683
  727    H    ALA  91           H        ALA  91   6.476  -7.189  -9.187
  728    HA   ALA  91           HA       ALA  91   6.486  -4.760  -7.718
  729   1HB   ALA  91          1HB       ALA  91   4.941  -6.500  -7.098
  730   2HB   ALA  91          2HB       ALA  91   6.006  -6.200  -5.725
  731   3HB   ALA  91          3HB       ALA  91   6.265  -7.610  -6.748
  732    H    PHE  92           H        PHE  92   8.624  -7.600  -7.438
  733    HA   PHE  92           HA       PHE  92  10.379  -6.112  -5.591
  734   1HB   PHE  92          2HB       PHE  92  11.267  -8.730  -6.672
  735   2HB   PHE  92          1HB       PHE  92  11.254  -8.148  -5.008
  736    HD1  PHE  92           HD1      PHE  92   9.647 -10.268  -7.380
  737    HD2  PHE  92           HD2      PHE  92   8.900  -7.874  -3.891
  738    HE1  PHE  92           HE1      PHE  92   7.556 -11.531  -6.962
  739    HE2  PHE  92           HE2      PHE  92   6.808  -9.140  -3.473
  740    HZ   PHE  92           HZ       PHE  92   6.136 -10.968  -5.010
  741    H    ARG  93           H        ARG  93  10.188  -4.960  -8.189
  742    HA   ARG  93           HA       ARG  93  12.989  -5.405  -9.133
  743   1HB   ARG  93          2HB       ARG  93  10.934  -6.246 -10.619
  744   2HB   ARG  93          1HB       ARG  93  10.907  -4.548 -11.097
  745   1HG   ARG  93          2HG       ARG  93  12.712  -4.837 -12.410
  746   2HG   ARG  93          1HG       ARG  93  13.628  -5.509 -11.060
  747   1HD   ARG  93          2HD       ARG  93  12.413  -7.700 -11.466
  748   2HD   ARG  93          1HD       ARG  93  11.796  -6.992 -12.959
  749    HE   ARG  93           HE       ARG  93  14.723  -7.321 -12.428
  750   1HH1  ARG  93          1HH1      ARG  93  13.694  -5.690 -14.787
  751   2HH1  ARG  93          2HH1      ARG  93  13.774  -6.858 -16.064
  752   1HH2  ARG  93          1HH2      ARG  93  14.064  -9.570 -13.920
  753   2HH2  ARG  93          2HH2      ARG  93  13.984  -9.057 -15.572
  754    H    LYS  94           H        LYS  94  14.084  -3.556  -8.707
  755    HA   LYS  94           HA       LYS  94  12.704  -1.016  -8.328
  756   1HB   LYS  94          2HB       LYS  94  15.687  -1.327  -8.640
  757   2HB   LYS  94          1HB       LYS  94  14.798  -0.163  -7.657
  758   1HG   LYS  94          2HG       LYS  94  15.115  -3.132  -7.163
  759   2HG   LYS  94          1HG       LYS  94  15.670  -1.805  -6.141
  760   1HD   LYS  94          2HD       LYS  94  13.349  -1.144  -5.699
  761   2HD   LYS  94          1HD       LYS  94  12.767  -2.426  -6.763
  762   1HE   LYS  94          2HE       LYS  94  14.254  -3.951  -5.179
  763   2HE   LYS  94          1HE       LYS  94  13.990  -2.632  -4.038
  764   1HZ   LYS  94          1HZ       LYS  94  12.122  -3.792  -3.615
  765   2HZ   LYS  94          2HZ       LYS  94  12.098  -4.548  -5.138
  766   3HZ   LYS  94          3HZ       LYS  94  11.531  -2.954  -4.967
  767    H    ARG  95           H        ARG  95  12.378   0.543  -9.855
  768    HA   ARG  95           HA       ARG  95  13.786   0.208 -12.474
  769   1HB   ARG  95          2HB       ARG  95  10.985   1.212 -11.887
  770   2HB   ARG  95          1HB       ARG  95  11.758   1.319 -13.471
  771   1HG   ARG  95          2HG       ARG  95  12.182  -1.318 -12.804
  772   2HG   ARG  95          1HG       ARG  95  10.589  -1.015 -12.111
  773   1HD   ARG  95          2HD       ARG  95   9.608  -0.779 -14.151
  774   2HD   ARG  95          1HD       ARG  95  10.986   0.097 -14.819
  775    HE   ARG  95           HE       ARG  95  10.612  -2.827 -14.853
  776   1HH1  ARG  95          1HH2      ARG  95  11.466  -1.062 -17.179
  777   2HH1  ARG  95          2HH2      ARG  95  13.144  -1.469 -17.312
  778   1HH2  ARG  95          1HH1      ARG  95  13.309  -2.945 -14.179
  779   2HH2  ARG  95          2HH1      ARG  95  14.188  -2.534 -15.614
  780    H    ARG  96           H        ARG  96  14.279   2.235 -13.601
  781    HA   ARG  96           HA       ARG  96  14.939   4.379 -11.675
  782   1HB   ARG  96          2HB       ARG  96  15.960   3.465 -14.276
  783   2HB   ARG  96          1HB       ARG  96  15.870   5.221 -14.127
  784   1HG   ARG  96          2HG       ARG  96  16.976   3.719 -11.802
  785   2HG   ARG  96          1HG       ARG  96  17.987   3.828 -13.244
  786   1HD   ARG  96          2HD       ARG  96  18.165   6.140 -13.113
  787   2HD   ARG  96          1HD       ARG  96  16.648   6.310 -12.231
  788    HE   ARG  96           HE       ARG  96  19.115   5.193 -10.954
  789   1HH1  ARG  96          1HH2      ARG  96  18.410   8.183 -10.839
  790   2HH1  ARG  96          2HH2      ARG  96  17.649   8.273  -9.286
  791   1HH2  ARG  96          1HH1      ARG  96  17.208   4.845  -9.008
  792   2HH2  ARG  96          2HH1      ARG  96  16.969   6.383  -8.249
  793    H    GLN  97           H        GLN  97  13.874   4.626 -15.077
  794    HA   GLN  97           HA       GLN  97  11.879   6.658 -14.152
  795   1HB   GLN  97          2HB       GLN  97  12.286   7.930 -16.135
  796   2HB   GLN  97          1HB       GLN  97  13.877   7.511 -15.501
  797   1HG   GLN  97          2HG       GLN  97  13.289   5.345 -17.108
  798   2HG   GLN  97          1HG       GLN  97  12.593   6.689 -18.011
  799   1HE2  GLN  97          1HE2      GLN  97  14.175   7.065 -19.612
  800   2HE2  GLN  97          2HE2      GLN  97  15.808   7.386 -19.275
  801    H    ARG  98           H        ARG  98  10.256   6.982 -16.192
  802    HA   ARG  98           HA       ARG  98   8.879   4.423 -16.424
  803   1HB   ARG  98          2HB       ARG  98   8.271   7.071 -17.777
  804   2HB   ARG  98          1HB       ARG  98   7.170   5.701 -17.621
  805   1HG   ARG  98          2HG       ARG  98   6.626   6.246 -15.496
  806   2HG   ARG  98          1HG       ARG  98   8.310   6.529 -15.056
  807   1HD   ARG  98          2HD       ARG  98   8.041   8.703 -16.502
  808   2HD   ARG  98          1HD       ARG  98   6.317   8.447 -16.230
  809    HE   ARG  98           HE       ARG  98   8.112   9.520 -14.303
  810   1HH1  ARG  98          1HH1      ARG  98   7.807   6.874 -13.023
  811   2HH1  ARG  98          2HH1      ARG  98   6.358   7.060 -12.091
  812   1HH2  ARG  98          1HH2      ARG  98   5.305   9.885 -13.804
  813   2HH2  ARG  98          2HH2      ARG  98   4.943   8.765 -12.534
  814    H    GLY  99           H        GLY  99   7.862   4.871 -19.136
  815   1HA   GLY  99          2HA       GLY  99  10.003   3.516 -20.587
  816   2HA   GLY  99          1HA       GLY  99   8.402   3.898 -21.223
  817    H    VAL 100           H        VAL 100   8.086   5.903 -22.270
  818    HA   VAL 100           HA       VAL 100  10.607   7.408 -22.840
  819    HB   VAL 100           HB       VAL 100   8.112   7.359 -24.551
  820   1HG1  VAL 100          1HG1      VAL 100   9.301   8.634 -26.013
  821   2HG1  VAL 100          2HG1      VAL 100  10.800   7.754 -25.711
  822   3HG1  VAL 100          3HG1      VAL 100  10.285   9.027 -24.603
  823   1HG2  VAL 100          1HG2      VAL 100   9.573   5.767 -25.970
  824   2HG2  VAL 100          2HG2      VAL 100   8.799   5.089 -24.538
  825   3HG2  VAL 100          3HG2      VAL 100  10.509   5.520 -24.496
  826    H    SER 101           HN       SER 101  10.668   9.407 -21.947
  827    HA   SER 101           HA       SER 101   8.601  11.340 -22.146
  828   1HB   SER 101          2HB       SER 101   8.338   9.470 -19.900
  829   2HB   SER 101          1HB       SER 101   8.389  11.156 -19.390
  830    HG   SER 101           HG       SER 101   6.363  11.115 -19.973
  Start of MODEL   15
    1   1H    GLU   1          1HT       GLU   1  19.756  10.176  -5.550
    2   2H    GLU   1          2HT       GLU   1  19.880   8.522  -5.926
    3   3H    GLU   1          3HT       GLU   1  20.630   9.138  -4.532
    4    HA   GLU   1           HA       GLU   1  18.420   7.875  -4.282
    5   1HB   GLU   1          2HB       GLU   1  17.866   9.247  -2.360
    6   2HB   GLU   1          1HB       GLU   1  19.622   9.205  -2.518
    7   1HG   GLU   1          2HG       GLU   1  18.574  11.368  -4.104
    8   2HG   GLU   1          1HG       GLU   1  17.957  11.497  -2.456
    9    H    SER   2           H        SER   2  16.069   8.571  -3.934
   10    HA   SER   2           HA       SER   2  15.123  10.829  -5.540
   11   1HB   SER   2          2HB       SER   2  13.626   8.937  -6.782
   12   2HB   SER   2          1HB       SER   2  15.116   9.589  -7.458
   13    HG   SER   2           HG       SER   2  16.045   7.733  -7.130
   14    H    LYS   3           H        LYS   3  12.701  10.980  -5.417
   15    HA   LYS   3           HA       LYS   3  11.826  10.189  -2.764
   16   1HB   LYS   3          2HB       LYS   3  10.910  12.241  -3.122
   17   2HB   LYS   3          1HB       LYS   3  10.876  12.030  -4.864
   18   1HG   LYS   3          2HG       LYS   3   8.905  10.489  -4.570
   19   2HG   LYS   3          1HG       LYS   3   8.906  10.897  -2.854
   20   1HD   LYS   3          2HD       LYS   3   8.595  13.277  -3.410
   21   2HD   LYS   3          1HD       LYS   3   8.604  12.880  -5.128
   22   1HE   LYS   3          2HE       LYS   3   6.703  11.152  -4.246
   23   2HE   LYS   3          1HE       LYS   3   6.472  12.481  -3.110
   24   1HZ   LYS   3          1HZ       LYS   3   6.532  12.743  -6.067
   25   2HZ   LYS   3          2HZ       LYS   3   6.270  14.003  -4.959
   26   3HZ   LYS   3          3HZ       LYS   3   5.131  12.753  -5.111
   27    HA   PRO   4           HA       PRO   4   8.677   7.578  -5.216
   28   1HB   PRO   4          2HB       PRO   4   8.987   7.480  -7.947
   29   2HB   PRO   4          1HB       PRO   4   7.987   8.684  -7.115
   30   1HG   PRO   4          2HG       PRO   4  10.671   9.019  -8.374
   31   2HG   PRO   4          1HG       PRO   4   9.394  10.220  -8.117
   32   1HD   PRO   4          2HD       PRO   4  11.726   9.929  -6.539
   33   2HD   PRO   4          1HD       PRO   4  10.293  10.875  -6.110
   34    HA   PRO   5           HA       PRO   5  12.000   4.499  -5.395
   35   1HB   PRO   5          2HB       PRO   5  10.601   2.607  -3.975
   36   2HB   PRO   5          1HB       PRO   5  11.513   3.923  -3.216
   37   1HG   PRO   5          2HG       PRO   5   8.564   3.619  -3.522
   38   2HG   PRO   5          1HG       PRO   5   9.477   4.520  -2.301
   39   1HD   PRO   5          2HD       PRO   5   8.171   5.632  -4.558
   40   2HD   PRO   5          1HD       PRO   5   9.336   6.460  -3.506
   41    H    TYR   6           H        TYR   6   8.561   3.516  -5.669
   42    HA   TYR   6           HA       TYR   6   9.326   1.964  -8.102
   43   1HB   TYR   6          2HB       TYR   6   6.992   1.279  -6.323
   44   2HB   TYR   6          1HB       TYR   6   7.783   0.263  -7.526
   45    HD1  TYR   6           HD1      TYR   6  10.033  -0.680  -7.096
   46    HD2  TYR   6           HD2      TYR   6   7.897   1.548  -4.110
   47    HE1  TYR   6           HE1      TYR   6  11.562  -1.554  -5.346
   48    HE2  TYR   6           HE2      TYR   6   9.426   0.674  -2.358
   49    HH   TYR   6           HH       TYR   6  12.282  -0.524  -2.851
   50    H    SER   7           H        SER   7   7.884   2.072  -9.872
   51    HA   SER   7           HA       SER   7   6.571   4.489 -10.385
   52   1HB   SER   7          2HB       SER   7   6.264   1.701 -11.450
   53   2HB   SER   7          1HB       SER   7   5.075   2.916 -11.918
   54    HG   SER   7           HG       SER   7   7.866   2.871 -12.352
   55    H    TYR   8           H        TYR   8   4.047   4.690 -10.625
   56    HA   TYR   8           HA       TYR   8   2.947   3.936  -8.004
   57   1HB   TYR   8          2HB       TYR   8   1.838   5.630 -10.250
   58   2HB   TYR   8          1HB       TYR   8   1.019   5.366  -8.706
   59    HD1  TYR   8           HD1      TYR   8   3.347   5.287  -6.854
   60    HD2  TYR   8           HD2      TYR   8   2.482   7.929 -10.132
   61    HE1  TYR   8           HE1      TYR   8   4.768   7.028  -5.819
   62    HE2  TYR   8           HE2      TYR   8   3.901   9.676  -9.089
   63    HH   TYR   8           HH       TYR   8   6.136   9.215  -6.994
   64    H    ALA   9           H        ALA   9   3.337   2.161 -10.571
   65    HA   ALA   9           HA       ALA   9   0.624   0.902 -10.421
   66   1HB   ALA   9          1HB       ALA   9   0.807   0.230 -12.657
   67   2HB   ALA   9          2HB       ALA   9   2.567   0.358 -12.651
   68   3HB   ALA   9          3HB       ALA   9   1.576   1.817 -12.698
   69    H    GLN  10           H        GLN  10   4.100   0.480 -10.393
   70    HA   GLN  10           HA       GLN  10   3.893  -2.403  -9.739
   71   1HB   GLN  10          2HB       GLN  10   5.705  -1.649 -11.256
   72   2HB   GLN  10          1HB       GLN  10   6.306  -0.569  -9.998
   73   1HG   GLN  10          2HG       GLN  10   6.468  -2.667  -8.517
   74   2HG   GLN  10          1HG       GLN  10   6.276  -3.588 -10.010
   75   1HE2  GLN  10          1HE2      GLN  10   8.507  -1.652  -8.135
   76   2HE2  GLN  10          2HE2      GLN  10   9.823  -1.783  -9.200
   77    H    LEU  11           H        LEU  11   4.333   0.726  -8.329
   78    HA   LEU  11           HA       LEU  11   5.428  -0.039  -5.784
   79   1HB   LEU  11          2HB       LEU  11   5.443   2.288  -6.481
   80   2HB   LEU  11          1HB       LEU  11   3.693   2.288  -6.673
   81    HG   LEU  11           HG       LEU  11   3.797   1.556  -4.105
   82   1HD1  LEU  11          1HD1      LEU  11   6.039   1.537  -3.563
   83   2HD1  LEU  11          2HD1      LEU  11   5.708   3.245  -3.274
   84   3HD1  LEU  11          3HD1      LEU  11   6.450   2.735  -4.791
   85   1HD2  LEU  11          1HD2      LEU  11   2.566   3.477  -4.723
   86   2HD2  LEU  11          2HD2      LEU  11   3.991   4.281  -5.384
   87   3HD2  LEU  11          3HD2      LEU  11   3.803   4.115  -3.639
   88    H    ILE  12           H        ILE  12   2.245   0.086  -7.204
   89    HA   ILE  12           HA       ILE  12   0.764  -0.458  -4.757
   90    HB   ILE  12           HB       ILE  12  -0.251  -1.279  -7.438
   91   1HG1  ILE  12          2HG1      ILE  12   0.750   0.819  -8.055
   92   2HG1  ILE  12          1HG1      ILE  12  -0.964   1.139  -7.797
   93   1HG2  ILE  12          1HG2      ILE  12  -1.808   0.445  -5.642
   94   2HG2  ILE  12          2HG2      ILE  12  -1.336  -1.109  -4.956
   95   3HG2  ILE  12          3HG2      ILE  12  -2.268  -1.053  -6.454
   96   1HD1  ILE  12          1HD1      ILE  12   1.087   1.495  -5.616
   97   2HD1  ILE  12          2HD1      ILE  12  -0.567   2.103  -5.668
   98   3HD1  ILE  12          3HD1      ILE  12   0.658   2.793  -6.729
   99    H    VAL  13           H        VAL  13   1.676  -2.397  -7.597
  100    HA   VAL  13           HA       VAL  13   0.656  -4.869  -6.811
  101    HB   VAL  13           HB       VAL  13   3.223  -4.263  -8.288
  102   1HG1  VAL  13          1HG1      VAL  13   2.874  -6.616  -9.157
  103   2HG1  VAL  13          2HG1      VAL  13   1.662  -6.827  -7.894
  104   3HG1  VAL  13          3HG1      VAL  13   3.339  -6.520  -7.461
  105   1HG2  VAL  13          1HG2      VAL  13   1.768  -4.775 -10.263
  106   2HG2  VAL  13          2HG2      VAL  13   1.221  -3.362  -9.362
  107   3HG2  VAL  13          3HG2      VAL  13   0.390  -4.905  -9.171
  108    H    GLN  14           H        GLN  14   3.587  -3.248  -5.728
  109    HA   GLN  14           HA       GLN  14   4.531  -5.576  -4.236
  110   1HB   GLN  14          2HB       GLN  14   6.179  -3.946  -4.947
  111   2HB   GLN  14          1HB       GLN  14   5.293  -2.642  -4.153
  112   1HG   GLN  14          2HG       GLN  14   5.644  -3.792  -1.964
  113   2HG   GLN  14          1HG       GLN  14   6.637  -4.994  -2.791
  114   1HE2  GLN  14          1HE2      GLN  14   7.581  -2.717  -4.669
  115   2HE2  GLN  14          2HE2      GLN  14   8.760  -1.917  -3.757
  116    H    ALA  15           H        ALA  15   2.586  -2.715  -3.672
  117    HA   ALA  15           HA       ALA  15   2.468  -2.773  -0.843
  118   1HB   ALA  15          1HB       ALA  15   0.080  -2.017  -2.497
  119   2HB   ALA  15          2HB       ALA  15   1.536  -1.023  -2.539
  120   3HB   ALA  15          3HB       ALA  15   0.683  -1.275  -1.016
  121    H    ILE  16           H        ILE  16  -0.085  -4.034  -3.081
  122    HA   ILE  16           HA       ILE  16  -1.354  -5.461  -0.921
  123    HB   ILE  16           HB       ILE  16  -2.301  -6.853  -2.952
  124   1HG1  ILE  16          2HG1      ILE  16  -2.253  -5.732  -5.018
  125   2HG1  ILE  16          1HG1      ILE  16  -1.490  -4.300  -4.352
  126   1HG2  ILE  16          1HG2      ILE  16  -3.658  -4.530  -3.388
  127   2HG2  ILE  16          2HG2      ILE  16  -2.878  -4.193  -1.843
  128   3HG2  ILE  16          3HG2      ILE  16  -3.936  -5.593  -2.007
  129   1HD1  ILE  16          1HD1      ILE  16  -0.076  -6.079  -5.679
  130   2HD1  ILE  16          2HD1      ILE  16  -0.117  -6.956  -4.158
  131   3HD1  ILE  16          3HD1      ILE  16   0.583  -5.337  -4.224
  132    H    SER  17           H        SER  17   1.382  -6.218  -2.856
  133    HA   SER  17           HA       SER  17   1.303  -9.060  -2.782
  134   1HB   SER  17          2HB       SER  17   3.451  -7.015  -3.054
  135   2HB   SER  17          1HB       SER  17   3.960  -8.607  -2.502
  136    HG   SER  17           HG       SER  17   3.873  -9.063  -4.556
  137    H    SER  18           H        SER  18   1.610  -6.733  -0.303
  138    HA   SER  18           HA       SER  18   2.610  -8.811   1.598
  139   1HB   SER  18          2HB       SER  18   3.950  -6.738   1.522
  140   2HB   SER  18          1HB       SER  18   2.514  -5.796   1.911
  141    HG   SER  18           HG       SER  18   4.050  -7.498   3.502
  142    H    ALA  19           H        ALA  19  -0.191  -7.059   0.642
  143    HA   ALA  19           HA       ALA  19  -1.533  -6.805   3.148
  144   1HB   ALA  19          1HB       ALA  19  -2.185  -6.318   0.499
  145   2HB   ALA  19          2HB       ALA  19  -3.281  -6.139   1.866
  146   3HB   ALA  19          3HB       ALA  19  -3.272  -7.635   0.933
  147    H    GLN  20           H        GLN  20  -3.053  -8.259   4.175
  148    HA   GLN  20           HA       GLN  20  -2.288 -10.888   4.571
  149   1HB   GLN  20          2HB       GLN  20  -5.015  -9.601   4.644
  150   2HB   GLN  20          1HB       GLN  20  -4.818 -11.316   5.006
  151   1HG   GLN  20          2HG       GLN  20  -4.674 -10.196   7.107
  152   2HG   GLN  20          1HG       GLN  20  -3.015 -10.611   6.677
  153   1HE2  GLN  20          1HE2      GLN  20  -1.657  -8.891   7.172
  154   2HE2  GLN  20          2HE2      GLN  20  -2.032  -7.251   6.942
  155    H    ASP  21           H        ASP  21  -5.150 -10.173   2.556
  156    HA   ASP  21           HA       ASP  21  -4.559 -12.597   0.962
  157   1HB   ASP  21          2HB       ASP  21  -6.923 -11.685   1.829
  158   2HB   ASP  21          1HB       ASP  21  -6.846 -10.778   0.320
  159    H    ARG  22           H        ARG  22  -5.692  -9.343   0.042
  160    HA   ARG  22           HA       ARG  22  -3.410  -8.548  -1.435
  161   1HB   ARG  22          2HB       ARG  22  -5.043 -10.545  -2.763
  162   2HB   ARG  22          1HB       ARG  22  -5.048  -9.034  -3.674
  163   1HG   ARG  22          2HG       ARG  22  -2.842  -9.203  -4.212
  164   2HG   ARG  22          1HG       ARG  22  -2.406  -9.833  -2.622
  165   1HD   ARG  22          2HD       ARG  22  -4.047 -11.630  -4.320
  166   2HD   ARG  22          1HD       ARG  22  -2.392 -11.351  -4.865
  167    HE   ARG  22           HE       ARG  22  -1.824 -11.998  -2.376
  168   1HH1  ARG  22          1HH1      ARG  22  -4.778 -12.774  -2.014
  169   2HH1  ARG  22          2HH1      ARG  22  -4.687 -14.490  -2.229
  170   1HH2  ARG  22          1HH2      ARG  22  -1.531 -14.411  -3.658
  171   2HH2  ARG  22          2HH2      ARG  22  -2.849 -15.416  -3.160
  172    H    GLN  23           H        GLN  23  -5.475  -7.420   0.250
  173    HA   GLN  23           HA       GLN  23  -6.424  -5.305  -1.606
  174   1HB   GLN  23          2HB       GLN  23  -8.685  -5.440  -0.918
  175   2HB   GLN  23          1HB       GLN  23  -8.209  -7.116  -1.188
  176   1HG   GLN  23          2HG       GLN  23  -7.745  -7.363   1.236
  177   2HG   GLN  23          1HG       GLN  23  -8.285  -5.703   1.494
  178   1HE2  GLN  23          1HE2      GLN  23  -9.563  -8.134   2.601
  179   2HE2  GLN  23          2HE2      GLN  23 -11.144  -8.167   1.983
  180    H    LEU  24           H        LEU  24  -6.301  -3.302  -0.749
  181    HA   LEU  24           HA       LEU  24  -6.025  -2.991   2.192
  182   1HB   LEU  24          2HB       LEU  24  -4.653  -0.876   0.738
  183   2HB   LEU  24          1HB       LEU  24  -4.037  -1.927   2.003
  184    HG   LEU  24           HG       LEU  24  -2.675  -2.216   0.040
  185   1HD1  LEU  24          1HD1      LEU  24  -2.544  -4.420   0.404
  186   2HD1  LEU  24          2HD1      LEU  24  -4.103  -4.698  -0.373
  187   3HD1  LEU  24          3HD1      LEU  24  -4.032  -4.289   1.340
  188   1HD2  LEU  24          1HD2      LEU  24  -3.490  -2.152  -2.058
  189   2HD2  LEU  24          2HD2      LEU  24  -5.027  -1.679  -1.335
  190   3HD2  LEU  24          3HD2      LEU  24  -4.709  -3.374  -1.702
  191    H    THR  25           H        THR  25  -6.583  -0.630   2.772
  192    HA   THR  25           HA       THR  25  -9.008   0.114   1.298
  193    HB   THR  25           HB       THR  25  -9.078   2.009   2.946
  194    HG1  THR  25           HG1      THR  25  -6.575   1.698   3.056
  195   1HG2  THR  25          1HG2      THR  25  -9.613   0.660   4.837
  196   2HG2  THR  25          2HG2      THR  25  -8.461  -0.589   4.361
  197   3HG2  THR  25          3HG2      THR  25  -9.940  -0.352   3.430
  198    H    LEU  26           H        LEU  26  -9.045   2.672   0.678
  199    HA   LEU  26           HA       LEU  26  -7.099   2.988  -1.375
  200   1HB   LEU  26          2HB       LEU  26  -9.362   4.314  -0.869
  201   2HB   LEU  26          1HB       LEU  26  -8.240   5.448  -0.112
  202    HG   LEU  26           HG       LEU  26  -7.592   4.372  -2.842
  203   1HD1  LEU  26          1HD1      LEU  26  -9.258   5.478  -3.892
  204   2HD1  LEU  26          2HD1      LEU  26  -9.007   6.922  -2.910
  205   3HD1  LEU  26          3HD1      LEU  26 -10.040   5.622  -2.318
  206   1HD2  LEU  26          1HD2      LEU  26  -6.666   6.422  -1.011
  207   2HD2  LEU  26          2HD2      LEU  26  -7.103   7.139  -2.561
  208   3HD2  LEU  26          3HD2      LEU  26  -5.912   5.839  -2.495
  209    H    SER  27           H        SER  27  -7.108   3.888   2.018
  210    HA   SER  27           HA       SER  27  -4.431   5.147   1.722
  211   1HB   SER  27          2HB       SER  27  -6.354   5.033   4.053
  212   2HB   SER  27          1HB       SER  27  -4.771   5.807   4.107
  213    HG   SER  27           HG       SER  27  -6.600   6.455   2.072
  214    H    GLY  28           H        GLY  28  -4.711   2.291   1.402
  215   1HA   GLY  28          2HA       GLY  28  -3.535   1.215   3.928
  216   2HA   GLY  28          1HA       GLY  28  -4.200   0.229   2.621
  217    H    ILE  29           H        ILE  29  -3.061   1.329   0.446
  218    HA   ILE  29           HA       ILE  29  -0.541   0.150   0.211
  219    HB   ILE  29           HB       ILE  29  -2.000   0.869  -1.641
  220   1HG1  ILE  29          2HG1      ILE  29   0.841   1.864  -1.537
  221   2HG1  ILE  29          1HG1      ILE  29   0.224   0.402  -2.305
  222   1HG2  ILE  29          1HG2      ILE  29  -2.666   2.991  -1.924
  223   2HG2  ILE  29          2HG2      ILE  29  -1.031   3.606  -1.705
  224   3HG2  ILE  29          3HG2      ILE  29  -2.049   3.288  -0.306
  225   1HD1  ILE  29          1HD1      ILE  29  -1.015   1.748  -3.924
  226   2HD1  ILE  29          2HD1      ILE  29   0.701   2.156  -3.967
  227   3HD1  ILE  29          3HD1      ILE  29  -0.438   3.224  -3.155
  228    H    TYR  30           H        TYR  30  -1.491   3.286   1.310
  229    HA   TYR  30           HA       TYR  30   1.120   4.494   1.250
  230   1HB   TYR  30          2HB       TYR  30  -1.207   5.203   3.048
  231   2HB   TYR  30          1HB       TYR  30   0.104   6.264   2.524
  232    HD1  TYR  30           HD1      TYR  30   0.233   5.080  -0.344
  233    HD2  TYR  30           HD2      TYR  30  -3.003   6.552   2.059
  234    HE1  TYR  30           HE1      TYR  30  -1.037   5.615  -2.399
  235    HE2  TYR  30           HE2      TYR  30  -4.277   7.087   0.003
  236    HH   TYR  30           HH       TYR  30  -3.839   5.881  -2.806
  237    H    ALA  31           H        ALA  31  -0.800   2.927   3.783
  238    HA   ALA  31           HA       ALA  31   1.246   3.112   5.796
  239   1HB   ALA  31          1HB       ALA  31  -0.303   2.097   7.108
  240   2HB   ALA  31          2HB       ALA  31  -0.485   0.751   5.984
  241   3HB   ALA  31          3HB       ALA  31  -1.391   2.242   5.729
  242    H    HIS  32           H        HIS  32   0.836   1.148   2.979
  243    HA   HIS  32           HA       HIS  32   2.463  -1.077   3.917
  244   1HB   HIS  32          2HB       HIS  32   0.853  -1.496   2.151
  245   2HB   HIS  32          1HB       HIS  32   1.562  -0.243   1.139
  246    HD1  HIS  32           HD1      HIS  32   1.707  -3.798   1.653
  247    HD2  HIS  32           HD2      HIS  32   4.507  -0.880   0.643
  248    HE1  HIS  32           HE1      HIS  32   3.690  -5.019   0.651
  249    H    ILE  33           H        ILE  33   3.130   1.124   1.169
  250    HA   ILE  33           HA       ILE  33   5.948   0.689   1.182
  251    HB   ILE  33           HB       ILE  33   4.403   1.811  -0.588
  252   1HG1  ILE  33          2HG1      ILE  33   7.059   1.536  -0.383
  253   2HG1  ILE  33          1HG1      ILE  33   6.320   2.429  -1.708
  254   1HG2  ILE  33          1HG2      ILE  33   4.470   4.281  -0.537
  255   2HG2  ILE  33          2HG2      ILE  33   5.242   4.222   1.046
  256   3HG2  ILE  33          3HG2      ILE  33   3.592   3.631   0.848
  257   1HD1  ILE  33          1HD1      ILE  33   7.169   3.770   0.868
  258   2HD1  ILE  33          2HD1      ILE  33   6.773   4.532  -0.672
  259   3HD1  ILE  33          3HD1      ILE  33   8.257   3.594  -0.509
  260    H    THR  34           H        THR  34   4.054   3.339   2.688
  261    HA   THR  34           HA       THR  34   6.282   4.761   3.732
  262    HB   THR  34           HB       THR  34   4.750   5.812   5.265
  263    HG1  THR  34           HG1      THR  34   2.787   4.899   5.753
  264   1HG2  THR  34          1HG2      THR  34   4.183   6.715   3.227
  265   2HG2  THR  34          2HG2      THR  34   2.642   5.958   3.629
  266   3HG2  THR  34          3HG2      THR  34   3.761   5.153   2.529
  267    H    LYS  35           H        LYS  35   4.796   1.782   4.767
  268    HA   LYS  35           HA       LYS  35   6.070   1.835   7.407
  269   1HB   LYS  35          2HB       LYS  35   3.972   0.634   7.195
  270   2HB   LYS  35          1HB       LYS  35   4.624  -0.358   5.890
  271   1HG   LYS  35          2HG       LYS  35   4.618  -1.506   8.131
  272   2HG   LYS  35          1HG       LYS  35   6.216  -1.397   7.391
  273   1HD   LYS  35          2HD       LYS  35   6.239  -0.780   9.809
  274   2HD   LYS  35          1HD       LYS  35   6.766   0.541   8.765
  275   1HE   LYS  35          2HE       LYS  35   4.514   1.532   8.862
  276   2HE   LYS  35          1HE       LYS  35   3.967   0.206   9.887
  277   1HZ   LYS  35          1HZ       LYS  35   4.634   2.275  11.087
  278   2HZ   LYS  35          2HZ       LYS  35   6.234   1.979  10.595
  279   3HZ   LYS  35          3HZ       LYS  35   5.431   0.868  11.600
  280    H    HIS  36           H        HIS  36   6.737   0.497   4.218
  281    HA   HIS  36           HA       HIS  36   9.224  -0.741   5.312
  282   1HB   HIS  36          2HB       HIS  36   7.460  -1.337   2.972
  283   2HB   HIS  36          1HB       HIS  36   9.180  -1.698   2.824
  284    HD1  HIS  36           HD1      HIS  36  10.043  -2.869   5.342
  285    HD2  HIS  36           HD2      HIS  36   6.188  -3.585   3.926
  286    HE1  HIS  36           HE1      HIS  36   9.233  -4.972   6.500
  287    H    TYR  37           H        TYR  37   8.434   2.159   4.278
  288    HA   TYR  37           HA       TYR  37  11.041   2.543   2.930
  289   1HB   TYR  37          2HB       TYR  37   8.492   2.691   1.593
  290   2HB   TYR  37          1HB       TYR  37   9.246   4.289   1.606
  291    HD1  TYR  37           HD1      TYR  37   9.816   0.710   0.835
  292    HD2  TYR  37           HD2      TYR  37  11.101   4.752   0.190
  293    HE1  TYR  37           HE1      TYR  37  11.359  -0.073  -0.925
  294    HE2  TYR  37           HE2      TYR  37  12.650   3.973  -1.579
  295    HH   TYR  37           HH       TYR  37  13.848   1.384  -1.970
  296    HA   PRO  38           HA       PRO  38  10.813   5.800   5.962
  297   1HB   PRO  38          2HB       PRO  38  13.394   6.675   5.588
  298   2HB   PRO  38          1HB       PRO  38  12.967   5.250   6.553
  299   1HG   PRO  38          2HG       PRO  38  14.174   5.378   3.827
  300   2HG   PRO  38          1HG       PRO  38  14.309   4.110   5.057
  301   1HD   PRO  38          2HD       PRO  38  12.643   4.026   2.774
  302   2HD   PRO  38          1HD       PRO  38  12.542   2.944   4.180
  303    H    TYR  39           H        TYR  39  12.091   6.330   2.672
  304    HA   TYR  39           HA       TYR  39  12.014   9.173   2.701
  305   1HB   TYR  39          2HB       TYR  39  13.014   7.692   0.887
  306   2HB   TYR  39          1HB       TYR  39  11.369   7.458   0.290
  307    HD1  TYR  39           HD1      TYR  39   9.962   9.713   0.043
  308    HD2  TYR  39           HD2      TYR  39  14.249   9.468   0.017
  309    HE1  TYR  39           HE1      TYR  39  10.076  11.895  -1.128
  310    HE2  TYR  39           HE2      TYR  39  14.366  11.649  -1.154
  311    HH   TYR  39           HH       TYR  39  13.199  13.460  -1.788
  312    H    TYR  40           H        TYR  40   9.474   6.780   2.114
  313    HA   TYR  40           HA       TYR  40   7.514   8.909   1.515
  314   1HB   TYR  40          2HB       TYR  40   7.562   5.929   1.404
  315   2HB   TYR  40          1HB       TYR  40   6.000   6.696   1.685
  316    HD1  TYR  40           HD1      TYR  40   8.695   8.366  -0.203
  317    HD2  TYR  40           HD2      TYR  40   5.076   6.067  -0.477
  318    HE1  TYR  40           HE1      TYR  40   8.518   8.923  -2.616
  319    HE2  TYR  40           HE2      TYR  40   4.899   6.624  -2.888
  320    HH   TYR  40           HH       TYR  40   6.544   7.300  -4.739
  321    H    ARG  41           H        ARG  41   8.740   8.993   4.128
  322    HA   ARG  41           HA       ARG  41   6.535   8.075   5.911
  323   1HB   ARG  41          2HB       ARG  41   8.784   7.375   6.584
  324   2HB   ARG  41          1HB       ARG  41   9.335   9.051   6.554
  325   1HG   ARG  41          2HG       ARG  41   8.028   9.642   8.427
  326   2HG   ARG  41          1HG       ARG  41   6.996   8.222   8.265
  327   1HD   ARG  41          2HD       ARG  41   9.803   7.498   8.596
  328   2HD   ARG  41          1HD       ARG  41   9.202   8.454   9.951
  329    HE   ARG  41           HE       ARG  41   7.703   6.040   9.030
  330   1HH1  ARG  41          1HH2      ARG  41   9.948   7.297  11.254
  331   2HH1  ARG  41          2HH2      ARG  41   9.220   6.561  12.643
  332   1HH2  ARG  41          1HH1      ARG  41   6.485   5.343  10.892
  333   2HH2  ARG  41          2HH1      ARG  41   7.259   5.455  12.438
  334    H    THR  42           H        THR  42   8.567  10.960   5.294
  335    HA   THR  42           HA       THR  42   6.317  12.597   6.396
  336    HB   THR  42           HB       THR  42   8.651  14.176   6.355
  337    HG1  THR  42           HG1      THR  42   9.928  12.738   7.772
  338   1HG2  THR  42          1HG2      THR  42   8.438  13.842   8.888
  339   2HG2  THR  42          2HG2      THR  42   7.104  12.749   8.522
  340   3HG2  THR  42          3HG2      THR  42   7.007  14.447   8.053
  341    H    ALA  43           H        ALA  43   6.326  11.758   3.708
  342    HA   ALA  43           HA       ALA  43   6.161  14.318   2.361
  343   1HB   ALA  43          1HB       ALA  43   8.075  14.364   1.143
  344   2HB   ALA  43          2HB       ALA  43   8.016  12.631   0.828
  345   3HB   ALA  43          3HB       ALA  43   8.700  13.230   2.340
  346    H    ASP  44           H        ASP  44   4.047  13.612   1.852
  347    HA   ASP  44           HA       ASP  44   3.941  11.490  -0.236
  348   1HB   ASP  44          2HB       ASP  44   1.871  10.600   0.775
  349   2HB   ASP  44          1HB       ASP  44   3.222  10.479   1.902
  350    H    LYS  45           H        LYS  45   3.822  14.501  -0.200
  351    HA   LYS  45           HA       LYS  45   1.021  15.037  -0.956
  352   1HB   LYS  45          2HB       LYS  45   2.819  16.600   0.288
  353   2HB   LYS  45          1HB       LYS  45   3.162  17.068  -1.377
  354   1HG   LYS  45          2HG       LYS  45   1.202  18.188  -1.583
  355   2HG   LYS  45          1HG       LYS  45   0.290  16.913  -0.773
  356   1HD   LYS  45          2HD       LYS  45   2.123  18.742   0.776
  357   2HD   LYS  45          1HD       LYS  45   0.457  19.204   0.420
  358   1HE   LYS  45          2HE       LYS  45  -0.435  17.589   1.800
  359   2HE   LYS  45          1HE       LYS  45   0.908  16.475   1.538
  360   1HZ   LYS  45          1HZ       LYS  45   0.698  17.655   3.794
  361   2HZ   LYS  45          2HZ       LYS  45   1.331  19.008   2.984
  362   3HZ   LYS  45          3HZ       LYS  45   2.227  17.568   3.066
  363    H    GLY  46           H        GLY  46   1.499  13.302  -2.762
  364   1HA   GLY  46          2HA       GLY  46   1.535  14.635  -5.274
  365   2HA   GLY  46          1HA       GLY  46   3.143  13.961  -4.994
  366    H    TRP  47           H        TRP  47   3.007  11.558  -4.167
  367    HA   TRP  47           HA       TRP  47   1.603  10.058  -6.215
  368   1HB   TRP  47          2HB       TRP  47   2.678   8.125  -5.330
  369   2HB   TRP  47          1HB       TRP  47   3.850   9.435  -5.231
  370    HD1  TRP  47           HD1      TRP  47   3.707  10.788  -2.698
  371    HE1  TRP  47           HE1      TRP  47   3.701   9.655  -0.390
  372    HE3  TRP  47           HE3      TRP  47   2.102   6.106  -4.009
  373    HZ2  TRP  47           HZ2      TRP  47   3.123   7.102   0.750
  374    HZ3  TRP  47           HZ3      TRP  47   1.857   4.350  -2.290
  375    HH2  TRP  47           HH2      TRP  47   2.365   4.841   0.080
  376    H    GLN  48           H        GLN  48   0.434  11.426  -3.479
  377    HA   GLN  48           HA       GLN  48  -1.048   9.323  -2.241
  378   1HB   GLN  48          2HB       GLN  48  -0.665  11.824  -1.527
  379   2HB   GLN  48          1HB       GLN  48  -2.141  12.112  -2.449
  380   1HG   GLN  48          2HG       GLN  48  -2.639  11.675  -0.064
  381   2HG   GLN  48          1HG       GLN  48  -3.329  10.432  -1.108
  382   1HE2  GLN  48          1HE2      GLN  48   0.149  10.448  -0.576
  383   2HE2  GLN  48          2HE2      GLN  48   0.191   9.087   0.438
  384    H    ASN  49           H        ASN  49  -2.450  11.882  -4.315
  385    HA   ASN  49           HA       ASN  49  -4.785  10.298  -4.910
  386   1HB   ASN  49          2HB       ASN  49  -5.228  12.088  -6.617
  387   2HB   ASN  49          1HB       ASN  49  -4.924  12.714  -4.996
  388   1HD2  ASN  49          1HD2      ASN  49  -4.092  14.767  -5.806
  389   2HD2  ASN  49          2HD2      ASN  49  -2.586  14.867  -6.585
  390    H    SER  50           H        SER  50  -1.612  10.252  -6.187
  391    HA   SER  50           HA       SER  50  -2.273   9.471  -8.896
  392   1HB   SER  50          2HB       SER  50   0.053  10.159  -7.587
  393   2HB   SER  50          1HB       SER  50   0.251   8.424  -7.807
  394    HG   SER  50           HG       SER  50   0.967   9.789  -9.592
  395    H    ILE  51           H        ILE  51  -1.846   7.742  -5.860
  396    HA   ILE  51           HA       ILE  51  -1.736   5.102  -7.034
  397    HB   ILE  51           HB       ILE  51  -1.994   6.280  -4.310
  398   1HG1  ILE  51          2HG1      ILE  51  -0.021   5.129  -3.923
  399   2HG1  ILE  51          1HG1      ILE  51  -0.460   3.811  -5.001
  400   1HG2  ILE  51          1HG2      ILE  51  -2.638   4.245  -3.231
  401   2HG2  ILE  51          2HG2      ILE  51  -2.597   3.343  -4.743
  402   3HG2  ILE  51          3HG2      ILE  51  -3.858   4.545  -4.464
  403   1HD1  ILE  51          1HD1      ILE  51   1.407   5.426  -5.777
  404   2HD1  ILE  51          2HD1      ILE  51   0.095   6.564  -6.085
  405   3HD1  ILE  51          3HD1      ILE  51   0.137   5.018  -6.931
  406    H    ARG  52           H        ARG  52  -4.399   6.780  -5.287
  407    HA   ARG  52           HA       ARG  52  -6.410   4.883  -5.714
  408   1HB   ARG  52          2HB       ARG  52  -6.819   6.868  -4.371
  409   2HB   ARG  52          1HB       ARG  52  -6.623   7.908  -5.782
  410   1HG   ARG  52          2HG       ARG  52  -8.632   5.744  -6.049
  411   2HG   ARG  52          1HG       ARG  52  -9.038   7.030  -4.911
  412   1HD   ARG  52          2HD       ARG  52  -8.302   7.362  -7.833
  413   2HD   ARG  52          1HD       ARG  52  -9.879   7.658  -7.099
  414    HE   ARG  52           HE       ARG  52  -7.461   9.353  -6.710
  415   1HH1  ARG  52          1HH1      ARG  52 -10.107   8.725  -4.870
  416   2HH1  ARG  52          2HH1      ARG  52 -10.819  10.300  -4.979
  417   1HH2  ARG  52          1HH2      ARG  52  -8.675  11.385  -7.479
  418   2HH2  ARG  52          2HH2      ARG  52 -10.009  11.807  -6.457
  419    H    HIS  53           H        HIS  53  -5.381   7.489  -7.924
  420    HA   HIS  53           HA       HIS  53  -7.272   6.727  -9.994
  421   1HB   HIS  53          2HB       HIS  53  -6.066   9.012  -9.593
  422   2HB   HIS  53          1HB       HIS  53  -4.750   8.283 -10.510
  423    HD1  HIS  53           HD1      HIS  53  -5.036   9.618 -12.664
  424    HD2  HIS  53           HD2      HIS  53  -8.551   7.726 -11.464
  425    HE1  HIS  53           HE1      HIS  53  -6.673   9.866 -14.581
  426    H    ASN  54           H        ASN  54  -4.012   5.783  -9.146
  427    HA   ASN  54           HA       ASN  54  -3.314   4.676 -11.716
  428   1HB   ASN  54          2HB       ASN  54  -2.145   4.773  -9.034
  429   2HB   ASN  54          1HB       ASN  54  -1.827   3.250  -9.869
  430   1HD2  ASN  54          1HD2      ASN  54  -0.484   6.246  -9.449
  431   2HD2  ASN  54          2HD2      ASN  54   0.321   6.416 -10.932
  432    H    LEU  55           H        LEU  55  -3.893   2.850  -8.687
  433    HA   LEU  55           HA       LEU  55  -4.294   0.375  -9.981
  434   1HB   LEU  55          2HB       LEU  55  -5.938   0.072  -7.825
  435   2HB   LEU  55          1HB       LEU  55  -4.189  -0.109  -7.763
  436    HG   LEU  55           HG       LEU  55  -5.168   2.670  -7.476
  437   1HD1  LEU  55          1HD1      LEU  55  -5.354   1.606  -4.891
  438   2HD1  LEU  55          2HD1      LEU  55  -6.301   0.522  -5.910
  439   3HD1  LEU  55          3HD1      LEU  55  -6.675   2.245  -5.869
  440   1HD2  LEU  55          1HD2      LEU  55  -3.469   1.507  -5.409
  441   2HD2  LEU  55          2HD2      LEU  55  -3.144   2.865  -6.489
  442   3HD2  LEU  55          3HD2      LEU  55  -2.833   1.215  -7.029
  443    H    SER  56           H        SER  56  -6.364   3.111  -9.991
  444    HA   SER  56           HA       SER  56  -8.816   1.569 -10.460
  445   1HB   SER  56          2HB       SER  56  -9.531   3.593  -9.676
  446   2HB   SER  56          1HB       SER  56  -8.071   4.421 -10.209
  447    HG   SER  56           HG       SER  56  -9.923   5.061 -11.399
  448    H    LEU  57           H        LEU  57  -6.555   3.528 -12.383
  449    HA   LEU  57           HA       LEU  57  -7.864   2.649 -14.876
  450   1HB   LEU  57          2HB       LEU  57  -6.254   4.162 -15.961
  451   2HB   LEU  57          1HB       LEU  57  -7.107   4.991 -14.665
  452    HG   LEU  57           HG       LEU  57  -5.011   4.042 -13.262
  453   1HD1  LEU  57          1HD1      LEU  57  -3.169   4.817 -15.200
  454   2HD1  LEU  57          2HD1      LEU  57  -4.291   3.780 -16.081
  455   3HD1  LEU  57          3HD1      LEU  57  -3.460   3.166 -14.652
  456   1HD2  LEU  57          1HD2      LEU  57  -4.945   6.532 -14.999
  457   2HD2  LEU  57          2HD2      LEU  57  -4.011   6.273 -13.525
  458   3HD2  LEU  57          3HD2      LEU  57  -5.768   6.405 -13.444
  459    H    ASN  58           H        ASN  58  -5.980   1.059 -12.858
  460    HA   ASN  58           HA       ASN  58  -3.851   0.207 -14.700
  461   1HB   ASN  58          2HB       ASN  58  -4.542  -0.305 -11.854
  462   2HB   ASN  58          1HB       ASN  58  -3.724  -1.616 -12.703
  463   1HD2  ASN  58          1HD2      ASN  58  -3.299   1.899 -13.277
  464   2HD2  ASN  58          2HD2      ASN  58  -1.655   1.926 -12.854
  465    H    ARG  59           H        ARG  59  -3.596  -2.235 -15.066
  466    HA   ARG  59           HA       ARG  59  -6.165  -3.232 -16.125
  467   1HB   ARG  59          2HB       ARG  59  -4.101  -3.277 -17.525
  468   2HB   ARG  59          1HB       ARG  59  -3.387  -4.416 -16.383
  469   1HG   ARG  59          2HG       ARG  59  -4.331  -5.719 -18.176
  470   2HG   ARG  59          1HG       ARG  59  -5.387  -5.918 -16.778
  471   1HD   ARG  59          2HD       ARG  59  -7.125  -4.868 -17.793
  472   2HD   ARG  59          1HD       ARG  59  -6.087  -3.612 -18.468
  473    HE   ARG  59           HE       ARG  59  -5.418  -5.525 -20.141
  474   1HH1  ARG  59          1HH1      ARG  59  -7.953  -3.851 -20.629
  475   2HH1  ARG  59          2HH1      ARG  59  -9.085  -5.095 -21.037
  476   1HH2  ARG  59          1HH2      ARG  59  -7.102  -7.666 -19.814
  477   2HH2  ARG  59          2HH2      ARG  59  -8.603  -7.258 -20.577
  478    H    TYR  60           H        TYR  60  -3.577  -4.416 -13.937
  479    HA   TYR  60           HA       TYR  60  -5.224  -6.742 -13.240
  480   1HB   TYR  60          2HB       TYR  60  -3.300  -6.849 -11.370
  481   2HB   TYR  60          1HB       TYR  60  -3.065  -7.444 -13.006
  482    HD1  TYR  60           HD1      TYR  60  -3.024  -4.010 -11.418
  483    HD2  TYR  60           HD2      TYR  60  -0.980  -6.932 -13.809
  484    HE1  TYR  60           HE1      TYR  60  -1.157  -2.425 -11.778
  485    HE2  TYR  60           HE2      TYR  60   0.885  -5.353 -14.163
  486    HH   TYR  60           HH       TYR  60   1.639  -2.995 -12.452
  487    H    PHE  61           H        PHE  61  -4.719  -3.539 -11.946
  488    HA   PHE  61           HA       PHE  61  -5.730  -4.292  -9.316
  489   1HB   PHE  61          2HB       PHE  61  -5.189  -1.612 -10.605
  490   2HB   PHE  61          1HB       PHE  61  -5.780  -1.796  -8.947
  491    HD1  PHE  61           HD1      PHE  61  -2.866  -1.323 -10.750
  492    HD2  PHE  61           HD2      PHE  61  -4.462  -3.860  -7.680
  493    HE1  PHE  61           HE1      PHE  61  -0.573  -1.841  -9.991
  494    HE2  PHE  61           HE2      PHE  61  -2.170  -4.371  -6.915
  495    HZ   PHE  61           HZ       PHE  61  -0.228  -3.357  -8.057
  496    H    ILE  62           H        ILE  62  -7.765  -4.119  -8.574
  497    HA   ILE  62           HA       ILE  62  -9.888  -3.149 -10.434
  498    HB   ILE  62           HB       ILE  62 -11.251  -5.049  -9.948
  499   1HG1  ILE  62          2HG1      ILE  62  -9.244  -6.172  -8.002
  500   2HG1  ILE  62          1HG1      ILE  62 -10.440  -5.007  -7.439
  501   1HG2  ILE  62          1HG2      ILE  62  -8.702  -5.369 -11.070
  502   2HG2  ILE  62          2HG2      ILE  62 -10.063  -6.478 -11.229
  503   3HG2  ILE  62          3HG2      ILE  62  -8.872  -6.724  -9.955
  504   1HD1  ILE  62          1HD1      ILE  62 -10.992  -7.658  -8.792
  505   2HD1  ILE  62          2HD1      ILE  62 -12.232  -6.455  -8.439
  506   3HD1  ILE  62          3HD1      ILE  62 -11.350  -7.226  -7.120
  507    H    LYS  63           H        LYS  63 -12.035  -2.926  -9.046
  508    HA   LYS  63           HA       LYS  63 -11.295  -1.836  -6.357
  509   1HB   LYS  63          2HB       LYS  63 -13.252  -0.682  -8.371
  510   2HB   LYS  63          1HB       LYS  63 -13.051  -0.093  -6.721
  511   1HG   LYS  63          2HG       LYS  63 -10.535  -0.343  -8.248
  512   2HG   LYS  63          1HG       LYS  63 -11.656   0.868  -8.871
  513   1HD   LYS  63          2HD       LYS  63 -11.623   1.083  -6.021
  514   2HD   LYS  63          1HD       LYS  63  -9.953   1.062  -6.587
  515   1HE   LYS  63          2HE       LYS  63 -10.253   2.965  -7.935
  516   2HE   LYS  63          1HE       LYS  63 -12.007   2.789  -7.954
  517   1HZ   LYS  63          1HZ       LYS  63 -10.593   4.415  -6.301
  518   2HZ   LYS  63          2HZ       LYS  63 -10.939   3.079  -5.310
  519   3HZ   LYS  63          3HZ       LYS  63 -12.201   3.928  -6.068
  520    H    VAL  64           H        VAL  64 -12.786  -2.285  -4.686
  521    HA   VAL  64           HA       VAL  64 -15.007  -4.134  -5.470
  522    HB   VAL  64           HB       VAL  64 -13.704  -3.986  -2.745
  523   1HG1  VAL  64          1HG1      VAL  64 -14.718  -6.548  -3.636
  524   2HG1  VAL  64          2HG1      VAL  64 -15.968  -5.310  -3.774
  525   3HG1  VAL  64          3HG1      VAL  64 -15.182  -5.602  -2.221
  526   1HG2  VAL  64          1HG2      VAL  64 -12.021  -4.513  -4.537
  527   2HG2  VAL  64          2HG2      VAL  64 -13.021  -5.886  -5.011
  528   3HG2  VAL  64          3HG2      VAL  64 -12.281  -5.845  -3.411
  529    HA   PRO  65           HA       PRO  65 -16.998  -0.403  -3.677
  530   1HB   PRO  65          2HB       PRO  65 -18.920  -0.227  -5.636
  531   2HB   PRO  65          1HB       PRO  65 -17.331   0.549  -5.752
  532   1HG   PRO  65          2HG       PRO  65 -18.337  -1.887  -7.150
  533   2HG   PRO  65          1HG       PRO  65 -17.084  -0.740  -7.655
  534   1HD   PRO  65          2HD       PRO  65 -16.626  -3.298  -6.536
  535   2HD   PRO  65          1HD       PRO  65 -15.419  -2.008  -6.726
  536    H    ARG  66           H        ARG  66 -19.536  -0.208  -3.294
  537    HA   ARG  66           HA       ARG  66 -20.892  -2.822  -3.146
  538   1HB   ARG  66          2HB       ARG  66 -19.706  -1.425  -0.806
  539   2HB   ARG  66          1HB       ARG  66 -21.344  -2.043  -0.593
  540   1HG   ARG  66          2HG       ARG  66 -19.204  -3.782  -1.803
  541   2HG   ARG  66          1HG       ARG  66 -19.350  -3.627  -0.052
  542   1HD   ARG  66          2HD       ARG  66 -21.495  -4.581  -0.017
  543   2HD   ARG  66          1HD       ARG  66 -21.768  -4.259  -1.729
  544    HE   ARG  66           HE       ARG  66 -20.327  -6.147  -2.265
  545   1HH1  ARG  66          1HH2      ARG  66 -22.247  -7.340  -0.289
  546   2HH1  ARG  66          2HH2      ARG  66 -21.180  -8.155   0.805
  547   1HH2  ARG  66          1HH1      ARG  66 -18.356  -6.447  -0.260
  548   2HH2  ARG  66          2HH1      ARG  66 -18.975  -7.649   0.821
  549    H    SER  67           H        SER  67 -21.217   0.367  -1.542
  550    HA   SER  67           HA       SER  67 -23.657   0.884  -3.137
  551   1HB   SER  67          2HB       SER  67 -24.516   1.597  -0.618
  552   2HB   SER  67          1HB       SER  67 -24.975   0.119  -1.457
  553    HG   SER  67           HG       SER  67 -23.953   0.029   0.765
  554    H    GLN  68           H        GLN  68 -24.098   3.116  -3.315
  555    HA   GLN  68           HA       GLN  68 -22.119   4.910  -1.963
  556   1HB   GLN  68          2HB       GLN  68 -22.685   6.382  -4.085
  557   2HB   GLN  68          1HB       GLN  68 -21.496   5.086  -4.200
  558   1HG   GLN  68          2HG       GLN  68 -23.033   3.613  -5.242
  559   2HG   GLN  68          1HG       GLN  68 -24.418   4.602  -4.780
  560   1HE2  GLN  68          1HE2      GLN  68 -24.029   7.072  -5.662
  561   2HE2  GLN  68          2HE2      GLN  68 -23.605   7.140  -7.304
  562    H    GLU  69           H        GLU  69 -24.118   4.723  -0.374
  563    HA   GLU  69           HA       GLU  69 -26.068   6.866  -1.125
  564   1HB   GLU  69          2HB       GLU  69 -26.439   4.541   0.791
  565   2HB   GLU  69          1HB       GLU  69 -27.636   5.796   0.466
  566   1HG   GLU  69          2HG       GLU  69 -26.801   4.822  -2.058
  567   2HG   GLU  69          1HG       GLU  69 -27.084   3.405  -1.045
  568    H    GLU  70           H        GLU  70 -25.156   5.375   1.991
  569    HA   GLU  70           HA       GLU  70 -24.690   8.137   3.029
  570   1HB   GLU  70          2HB       GLU  70 -25.146   7.238   5.233
  571   2HB   GLU  70          1HB       GLU  70 -26.433   6.702   4.151
  572   1HG   GLU  70          2HG       GLU  70 -24.741   4.654   3.794
  573   2HG   GLU  70          1HG       GLU  70 -24.246   5.123   5.421
  574    HA   PRO  71           HA       PRO  71 -20.438   7.194   3.650
  575   1HB   PRO  71          2HB       PRO  71 -19.916   8.839   5.789
  576   2HB   PRO  71          1HB       PRO  71 -20.160   9.434   4.137
  577   1HG   PRO  71          2HG       PRO  71 -22.002   9.582   6.475
  578   2HG   PRO  71          1HG       PRO  71 -21.912  10.630   5.049
  579   1HD   PRO  71          2HD       PRO  71 -23.810   8.562   5.493
  580   2HD   PRO  71          1HD       PRO  71 -23.532   9.426   3.965
  581    H    GLY  72           H        GLY  72 -21.537   4.989   4.566
  582   1HA   GLY  72          2HA       GLY  72 -20.727   4.721   7.432
  583   2HA   GLY  72          1HA       GLY  72 -21.978   3.732   6.671
  584    H    LYS  73           H        LYS  73 -19.332   4.368   4.621
  585    HA   LYS  73           HA       LYS  73 -17.657   2.144   5.493
  586   1HB   LYS  73          2HB       LYS  73 -19.545   0.938   4.421
  587   2HB   LYS  73          1HB       LYS  73 -19.265   1.850   2.937
  588   1HG   LYS  73          2HG       LYS  73 -17.228   0.789   2.509
  589   2HG   LYS  73          1HG       LYS  73 -17.000   0.330   4.196
  590   1HD   LYS  73          2HD       LYS  73 -17.602  -1.631   2.828
  591   2HD   LYS  73          1HD       LYS  73 -18.861  -1.280   4.013
  592   1HE   LYS  73          2HE       LYS  73 -19.651   0.258   1.875
  593   2HE   LYS  73          1HE       LYS  73 -18.967  -1.155   1.075
  594   1HZ   LYS  73          1HZ       LYS  73 -21.351  -0.920   2.677
  595   2HZ   LYS  73          2HZ       LYS  73 -20.383  -2.259   3.075
  596   3HZ   LYS  73          3HZ       LYS  73 -20.953  -2.060   1.486
  597    H    GLY  74           H        GLY  74 -15.608   2.422   4.665
  598   1HA   GLY  74          2HA       GLY  74 -15.139   4.775   2.980
  599   2HA   GLY  74          1HA       GLY  74 -13.897   3.745   3.690
  600    H    SER  75           H        SER  75 -12.690   3.069   1.961
  601    HA   SER  75           HA       SER  75 -14.169   1.788  -0.304
  602   1HB   SER  75          2HB       SER  75 -11.846   3.680  -0.307
  603   2HB   SER  75          1HB       SER  75 -11.932   2.447  -1.561
  604    HG   SER  75           HG       SER  75 -13.002   4.411  -2.133
  605    H    PHE  76           H        PHE  76 -12.673   0.188  -1.490
  606    HA   PHE  76           HA       PHE  76 -10.429  -0.940  -0.052
  607   1HB   PHE  76          2HB       PHE  76 -12.942  -1.716   0.908
  608   2HB   PHE  76          1HB       PHE  76 -12.426  -3.051  -0.123
  609    HD1  PHE  76           HD1      PHE  76  -9.555  -3.109   0.120
  610    HD2  PHE  76           HD2      PHE  76 -12.509  -2.290   3.128
  611    HE1  PHE  76           HE1      PHE  76  -7.970  -3.850   1.878
  612    HE2  PHE  76           HE2      PHE  76 -10.925  -3.033   4.888
  613    HZ   PHE  76           HZ       PHE  76  -8.654  -3.814   4.262
  614    H    TRP  77           H        TRP  77  -9.251  -1.354  -1.863
  615    HA   TRP  77           HA       TRP  77 -10.612  -2.865  -4.059
  616   1HB   TRP  77          2HB       TRP  77  -9.222  -1.679  -5.641
  617   2HB   TRP  77          1HB       TRP  77  -9.997  -0.487  -4.605
  618    HD1  TRP  77           HD1      TRP  77  -8.486   0.991  -3.110
  619    HE1  TRP  77           HE1      TRP  77  -5.934   1.218  -2.821
  620    HE3  TRP  77           HE3      TRP  77  -6.937  -3.128  -5.693
  621    HZ2  TRP  77           HZ2      TRP  77  -3.554  -0.165  -3.593
  622    HZ3  TRP  77           HZ3      TRP  77  -4.530  -3.658  -5.887
  623    HH2  TRP  77           HH2      TRP  77  -2.839  -2.186  -4.851
  624    H    ARG  78           H        ARG  78  -8.989  -4.158  -5.400
  625    HA   ARG  78           HA       ARG  78  -6.522  -4.959  -3.986
  626   1HB   ARG  78          2HB       ARG  78  -7.358  -7.433  -4.279
  627   2HB   ARG  78          1HB       ARG  78  -7.862  -6.511  -2.869
  628   1HG   ARG  78          2HG       ARG  78  -9.956  -5.888  -4.010
  629   2HG   ARG  78          1HG       ARG  78  -9.457  -6.818  -5.423
  630   1HD   ARG  78          2HD       ARG  78  -9.261  -8.386  -2.976
  631   2HD   ARG  78          1HD       ARG  78 -10.896  -7.791  -3.247
  632    HE   ARG  78           HE       ARG  78 -10.920  -8.985  -5.380
  633   1HH1  ARG  78          1HH1      ARG  78  -9.233 -10.391  -2.916
  634   2HH1  ARG  78          2HH1      ARG  78  -8.248 -11.418  -3.904
  635   1HH2  ARG  78          1HH2      ARG  78  -9.180  -9.895  -6.878
  636   2HH2  ARG  78          2HH2      ARG  78  -8.217 -11.137  -6.149
  637    H    ILE  79           H        ILE  79  -5.330  -6.657  -5.351
  638    HA   ILE  79           HA       ILE  79  -5.759  -5.970  -8.221
  639    HB   ILE  79           HB       ILE  79  -3.481  -5.673  -7.231
  640   1HG1  ILE  79          2HG1      ILE  79  -3.177  -7.856  -9.235
  641   2HG1  ILE  79          1HG1      ILE  79  -4.177  -6.482  -9.701
  642   1HG2  ILE  79          1HG2      ILE  79  -3.711  -8.673  -6.943
  643   2HG2  ILE  79          2HG2      ILE  79  -3.325  -7.491  -5.691
  644   3HG2  ILE  79          3HG2      ILE  79  -2.159  -7.834  -6.971
  645   1HD1  ILE  79          1HD1      ILE  79  -1.543  -6.463 -10.084
  646   2HD1  ILE  79          2HD1      ILE  79  -1.551  -5.897  -8.417
  647   3HD1  ILE  79          3HD1      ILE  79  -2.422  -5.000  -9.661
  648    H    ASP  80           H        ASP  80  -5.425  -7.798  -9.810
  649    HA   ASP  80           HA       ASP  80  -7.335  -9.832  -9.383
  650   1HB   ASP  80          2HB       ASP  80  -5.964  -8.903 -11.554
  651   2HB   ASP  80          1HB       ASP  80  -5.191 -10.468 -11.308
  652    HA   PRO  81           HA       PRO  81  -5.022 -12.787  -7.093
  653   1HB   PRO  81          2HB       PRO  81  -6.713 -14.915  -7.482
  654   2HB   PRO  81          1HB       PRO  81  -7.067 -13.573  -6.380
  655   1HG   PRO  81          2HG       PRO  81  -8.250 -14.168  -9.048
  656   2HG   PRO  81          1HG       PRO  81  -8.935 -13.248  -7.698
  657   1HD   PRO  81          2HD       PRO  81  -7.752 -12.168 -10.050
  658   2HD   PRO  81          1HD       PRO  81  -8.212 -11.260  -8.592
  659    H    ALA  82           H        ALA  82  -6.134 -13.681 -10.370
  660    HA   ALA  82           HA       ALA  82  -4.084 -15.794 -10.544
  661   1HB   ALA  82          1HB       ALA  82  -6.140 -14.796 -12.535
  662   2HB   ALA  82          2HB       ALA  82  -6.240 -16.263 -11.562
  663   3HB   ALA  82          3HB       ALA  82  -5.032 -16.133 -12.840
  664    H    SER  83           H        SER  83  -4.090 -12.474 -10.985
  665    HA   SER  83           HA       SER  83  -1.906 -12.698 -13.017
  666   1HB   SER  83          2HB       SER  83  -4.160 -10.861 -12.788
  667   2HB   SER  83          1HB       SER  83  -2.625  -9.995 -12.849
  668    HG   SER  83           HG       SER  83  -2.137 -11.340 -14.706
  669    H    GLU  84           H        GLU  84  -2.693 -12.012  -9.790
  670    HA   GLU  84           HA       GLU  84  -0.836  -9.981  -9.148
  671   1HB   GLU  84          2HB       GLU  84  -0.904 -10.951  -6.838
  672   2HB   GLU  84          1HB       GLU  84  -2.503 -10.693  -7.534
  673   1HG   GLU  84          2HG       GLU  84  -2.810 -12.857  -6.835
  674   2HG   GLU  84          1HG       GLU  84  -2.067 -13.207  -8.397
  675    H    ALA  85           H        ALA  85  -0.390 -13.529  -9.138
  676    HA   ALA  85           HA       ALA  85   2.301 -13.506  -8.235
  677   1HB   ALA  85          1HB       ALA  85   1.429 -15.478 -10.321
  678   2HB   ALA  85          2HB       ALA  85   0.622 -15.487  -8.753
  679   3HB   ALA  85          3HB       ALA  85   2.364 -15.747  -8.850
  680    H    LYS  86           H        LYS  86   0.987 -12.434 -11.232
  681    HA   LYS  86           HA       LYS  86   3.579 -12.689 -12.640
  682   1HB   LYS  86          2HB       LYS  86   1.395 -13.124 -13.815
  683   2HB   LYS  86          1HB       LYS  86   1.005 -11.415 -13.613
  684   1HG   LYS  86          2HG       LYS  86   3.382 -11.063 -14.715
  685   2HG   LYS  86          1HG       LYS  86   3.101 -12.691 -15.337
  686   1HD   LYS  86          2HD       LYS  86   2.154 -11.366 -17.015
  687   2HD   LYS  86          1HD       LYS  86   0.753 -11.741 -16.011
  688   1HE   LYS  86          2HE       LYS  86   0.503  -9.450 -16.155
  689   2HE   LYS  86          1HE       LYS  86   1.543  -9.533 -14.733
  690   1HZ   LYS  86          1HZ       LYS  86   3.385  -8.904 -15.932
  691   2HZ   LYS  86          2HZ       LYS  86   2.171  -7.984 -16.685
  692   3HZ   LYS  86          3HZ       LYS  86   2.740  -9.407 -17.418
  693    H    LEU  87           H        LEU  87   1.284 -10.036 -11.920
  694    HA   LEU  87           HA       LEU  87   2.946  -7.895 -12.611
  695   1HB   LEU  87          2HB       LEU  87   1.664  -6.757 -10.549
  696   2HB   LEU  87          1HB       LEU  87   0.872  -7.084 -12.074
  697    HG   LEU  87           HG       LEU  87   0.736  -9.432 -10.394
  698   1HD1  LEU  87          1HD1      LEU  87   0.638  -8.351  -8.388
  699   2HD1  LEU  87          2HD1      LEU  87  -1.023  -8.044  -8.896
  700   3HD1  LEU  87          3HD1      LEU  87   0.214  -6.806  -9.125
  701   1HD2  LEU  87          1HD2      LEU  87  -0.795  -9.038 -12.238
  702   2HD2  LEU  87          2HD2      LEU  87  -1.283  -7.492 -11.561
  703   3HD2  LEU  87          3HD2      LEU  87  -1.734  -8.988 -10.747
  704    H    VAL  88           H        VAL  88   2.609  -9.401  -9.446
  705    HA   VAL  88           HA       VAL  88   4.429  -7.883  -7.978
  706    HB   VAL  88           HB       VAL  88   4.750  -9.968  -6.687
  707   1HG1  VAL  88          1HG1      VAL  88   2.463 -10.115  -5.933
  708   2HG1  VAL  88          2HG1      VAL  88   1.870  -9.557  -7.497
  709   3HG1  VAL  88          3HG1      VAL  88   2.740  -8.448  -6.437
  710   1HG2  VAL  88          1HG2      VAL  88   3.529 -11.045  -9.171
  711   2HG2  VAL  88          2HG2      VAL  88   3.051 -11.802  -7.652
  712   3HG2  VAL  88          3HG2      VAL  88   4.751 -11.767  -8.124
  713    H    GLU  89           H        GLU  89   5.101 -10.373 -10.364
  714    HA   GLU  89           HA       GLU  89   7.746 -11.037  -9.692
  715   1HB   GLU  89          2HB       GLU  89   6.060 -11.413 -11.926
  716   2HB   GLU  89          1HB       GLU  89   7.526 -10.660 -12.555
  717   1HG   GLU  89          2HG       GLU  89   8.816 -12.477 -12.085
  718   2HG   GLU  89          1HG       GLU  89   7.984 -12.794 -10.562
  719    H    GLN  90           H        GLN  90   6.520  -8.211 -11.445
  720    HA   GLN  90           HA       GLN  90   9.240  -7.128 -11.754
  721   1HB   GLN  90          2HB       GLN  90   6.596  -6.576 -12.851
  722   2HB   GLN  90          1HB       GLN  90   7.394  -5.098 -12.314
  723   1HG   GLN  90          2HG       GLN  90   7.979  -5.580 -14.651
  724   2HG   GLN  90          1HG       GLN  90   9.404  -5.719 -13.621
  725   1HE2  GLN  90          1HE2      GLN  90   9.844  -7.101 -15.817
  726   2HE2  GLN  90          2HE2      GLN  90   9.534  -8.763 -15.652
  727    H    ALA  91           H        ALA  91   6.652  -7.050  -9.476
  728    HA   ALA  91           HA       ALA  91   7.142  -4.497  -8.287
  729   1HB   ALA  91          1HB       ALA  91   5.927  -5.360  -6.343
  730   2HB   ALA  91          2HB       ALA  91   6.040  -6.994  -6.998
  731   3HB   ALA  91          3HB       ALA  91   5.093  -5.768  -7.842
  732    H    PHE  92           H        PHE  92   8.693  -7.617  -7.904
  733    HA   PHE  92           HA       PHE  92  10.191  -6.731  -5.534
  734   1HB   PHE  92          2HB       PHE  92  10.534  -9.211  -7.250
  735   2HB   PHE  92          1HB       PHE  92  11.272  -8.931  -5.673
  736    HD1  PHE  92           HD1      PHE  92   8.732 -10.681  -7.170
  737    HD2  PHE  92           HD2      PHE  92   9.347  -7.949  -3.914
  738    HE1  PHE  92           HE1      PHE  92   6.692 -11.549  -6.055
  739    HE2  PHE  92           HE2      PHE  92   7.309  -8.817  -2.800
  740    HZ   PHE  92           HZ       PHE  92   5.981 -10.617  -3.870
  741    H    ARG  93           H        ARG  93  10.505  -6.508  -8.936
  742    HA   ARG  93           HA       ARG  93  13.434  -5.985  -8.678
  743   1HB   ARG  93          2HB       ARG  93  12.235  -7.606 -10.472
  744   2HB   ARG  93          1HB       ARG  93  12.152  -6.084 -11.362
  745   1HG   ARG  93          2HG       ARG  93  14.579  -5.767 -11.057
  746   2HG   ARG  93          1HG       ARG  93  14.667  -7.283 -10.162
  747   1HD   ARG  93          2HD       ARG  93  15.112  -8.213 -12.187
  748   2HD   ARG  93          1HD       ARG  93  13.374  -8.073 -12.449
  749    HE   ARG  93           HE       ARG  93  15.408  -6.144 -13.474
  750   1HH1  ARG  93          1HH1      ARG  93  13.665  -8.087 -15.121
  751   2HH1  ARG  93          2HH1      ARG  93  12.482  -6.992 -15.751
  752   1HH2  ARG  93          1HH2      ARG  93  13.265  -4.449 -13.527
  753   2HH2  ARG  93          2HH2      ARG  93  12.256  -4.931 -14.850
  754    H    LYS  94           H        LYS  94  14.176  -3.917  -9.016
  755    HA   LYS  94           HA       LYS  94  12.220  -1.766  -9.226
  756   1HB   LYS  94          2HB       LYS  94  15.252  -1.778  -9.184
  757   2HB   LYS  94          1HB       LYS  94  14.281  -0.306  -9.225
  758   1HG   LYS  94          2HG       LYS  94  13.246  -0.845  -7.111
  759   2HG   LYS  94          1HG       LYS  94  13.989  -2.444  -7.098
  760   1HD   LYS  94          2HD       LYS  94  15.592   0.124  -7.136
  761   2HD   LYS  94          1HD       LYS  94  15.154  -0.716  -5.648
  762   1HE   LYS  94          2HE       LYS  94  16.992  -1.989  -5.929
  763   2HE   LYS  94          1HE       LYS  94  16.193  -2.713  -7.325
  764   1HZ   LYS  94          1HZ       LYS  94  18.494  -1.473  -7.524
  765   2HZ   LYS  94          2HZ       LYS  94  17.482  -0.121  -7.701
  766   3HZ   LYS  94          3HZ       LYS  94  17.347  -1.433  -8.772
  767    H    ARG  95           H        ARG  95  12.136  -0.207 -10.967
  768    HA   ARG  95           HA       ARG  95  13.321  -1.184 -13.533
  769   1HB   ARG  95          2HB       ARG  95  11.281  -0.596 -14.695
  770   2HB   ARG  95          1HB       ARG  95  10.850  -1.644 -13.343
  771   1HG   ARG  95          2HG       ARG  95  10.526   0.557 -12.011
  772   2HG   ARG  95          1HG       ARG  95  10.495   1.339 -13.591
  773   1HD   ARG  95          2HD       ARG  95   8.588  -0.706 -12.468
  774   2HD   ARG  95          1HD       ARG  95   8.224   0.868 -13.179
  775    HE   ARG  95           HE       ARG  95   9.370  -1.261 -14.916
  776   1HH1  ARG  95          1HH2      ARG  95   8.322   1.376 -15.954
  777   2HH1  ARG  95          2HH2      ARG  95   6.750   0.926 -16.528
  778   1HH2  ARG  95          1HH1      ARG  95   6.690  -2.082 -14.801
  779   2HH2  ARG  95          2HH1      ARG  95   5.828  -1.032 -15.876
  780    H    ARG  96           H        ARG  96  14.465   0.370 -14.599
  781    HA   ARG  96           HA       ARG  96  13.758   3.210 -14.309
  782   1HB   ARG  96          2HB       ARG  96  15.881   1.982 -12.753
  783   2HB   ARG  96          1HB       ARG  96  16.521   3.231 -13.822
  784   1HG   ARG  96          2HG       ARG  96  15.078   4.895 -12.911
  785   2HG   ARG  96          1HG       ARG  96  14.087   3.687 -12.088
  786   1HD   ARG  96          2HD       ARG  96  16.903   4.554 -11.422
  787   2HD   ARG  96          1HD       ARG  96  15.476   4.604 -10.387
  788    HE   ARG  96           HE       ARG  96  15.582   2.029 -10.526
  789   1HH1  ARG  96          1HH2      ARG  96  18.265   3.146 -12.085
  790   2HH1  ARG  96          2HH2      ARG  96  19.432   2.402 -11.043
  791   1HH2  ARG  96          1HH1      ARG  96  17.098   1.469  -8.654
  792   2HH2  ARG  96          2HH1      ARG  96  18.771   1.452  -9.102
  793    H    GLN  97           H        GLN  97  13.860   1.319 -16.517
  794    HA   GLN  97           HA       GLN  97  16.261   2.138 -18.047
  795   1HB   GLN  97          2HB       GLN  97  13.999   0.209 -18.634
  796   2HB   GLN  97          1HB       GLN  97  15.266   0.595 -19.798
  797   1HG   GLN  97          2HG       GLN  97  16.117  -0.201 -17.048
  798   2HG   GLN  97          1HG       GLN  97  15.500  -1.467 -18.111
  799   1HE2  GLN  97          1HE2      GLN  97  18.072   0.973 -17.769
  800   2HE2  GLN  97          2HE2      GLN  97  19.093   0.303 -18.950
  801    H    ARG  98           H        ARG  98  15.693   4.397 -18.276
  802    HA   ARG  98           HA       ARG  98  13.815   4.851 -20.516
  803   1HB   ARG  98          2HB       ARG  98  13.409   5.795 -17.722
  804   2HB   ARG  98          1HB       ARG  98  13.118   6.977 -18.998
  805   1HG   ARG  98          2HG       ARG  98  11.881   4.211 -18.866
  806   2HG   ARG  98          1HG       ARG  98  11.060   5.717 -18.452
  807   1HD   ARG  98          2HD       ARG  98  12.009   4.775 -21.152
  808   2HD   ARG  98          1HD       ARG  98  10.410   5.353 -20.687
  809    HE   ARG  98           HE       ARG  98  12.801   7.100 -21.071
  810   1HH1  ARG  98          1HH2      ARG  98   9.841   6.641 -22.365
  811   2HH1  ARG  98          2HH2      ARG  98   9.214   8.226 -22.051
  812   1HH2  ARG  98          1HH1      ARG  98  11.818   9.132 -19.951
  813   2HH2  ARG  98          2HH1      ARG  98  10.332   9.635 -20.687
  814    H    GLY  99           H        GLY  99  15.309   7.092 -18.187
  815   1HA   GLY  99          2HA       GLY  99  17.473   7.779 -20.019
  816   2HA   GLY  99          1HA       GLY  99  16.216   9.014 -19.940
  817    H    VAL 100           H        VAL 100  17.996  10.364 -19.000
  818    HA   VAL 100           HA       VAL 100  19.005   9.656 -16.350
  819    HB   VAL 100           HB       VAL 100  20.331  11.044 -17.916
  820   1HG1  VAL 100          1HG1      VAL 100  18.458  13.331 -17.368
  821   2HG1  VAL 100          2HG1      VAL 100  18.121  12.225 -18.701
  822   3HG1  VAL 100          3HG1      VAL 100  19.627  13.142 -18.674
  823   1HG2  VAL 100          1HG2      VAL 100  21.253  12.292 -16.221
  824   2HG2  VAL 100          2HG2      VAL 100  20.156  11.324 -15.235
  825   3HG2  VAL 100          3HG2      VAL 100  19.696  12.956 -15.724
  826    H    SER 101           HN       SER 101  16.050  10.763 -17.439
  827    HA   SER 101           HA       SER 101  15.543  12.450 -15.048
  828   1HB   SER 101          2HB       SER 101  13.300  11.928 -16.879
  829   2HB   SER 101          1HB       SER 101  13.921  13.460 -16.271
  830    HG   SER 101           HG       SER 101  14.271  12.407 -18.656
  Start of MODEL   16
    1   1H    GLU   1          1HT       GLU   1  16.343   9.212  -8.605
    2   2H    GLU   1          2HT       GLU   1  16.398   9.495 -10.279
    3   3H    GLU   1          3HT       GLU   1  15.033   9.960  -9.380
    4    HA   GLU   1           HA       GLU   1  17.762  11.109  -9.136
    5   1HB   GLU   1          2HB       GLU   1  15.240  11.924 -10.532
    6   2HB   GLU   1          1HB       GLU   1  16.253  13.182  -9.822
    7   1HG   GLU   1          2HG       GLU   1  18.214  12.187 -11.057
    8   2HG   GLU   1          1HG       GLU   1  17.077  11.124 -11.887
    9    H    SER   2           H        SER   2  15.107  10.134  -7.413
   10    HA   SER   2           HA       SER   2  15.779  11.479  -5.036
   11   1HB   SER   2          2HB       SER   2  14.328  13.149  -6.893
   12   2HB   SER   2          1HB       SER   2  13.355  12.873  -5.451
   13    HG   SER   2           HG       SER   2  15.049  14.656  -5.528
   14    H    LYS   3           H        LYS   3  13.279  10.040  -7.033
   15    HA   LYS   3           HA       LYS   3  11.671   9.283  -4.679
   16   1HB   LYS   3          2HB       LYS   3  11.271   9.444  -7.556
   17   2HB   LYS   3          1HB       LYS   3  10.694   7.910  -6.911
   18   1HG   LYS   3          2HG       LYS   3   8.824   9.259  -6.586
   19   2HG   LYS   3          1HG       LYS   3   9.646   9.447  -5.036
   20   1HD   LYS   3          2HD       LYS   3  10.739  11.506  -5.879
   21   2HD   LYS   3          1HD       LYS   3   9.863  11.332  -7.402
   22   1HE   LYS   3          2HE       LYS   3   8.694  11.820  -4.652
   23   2HE   LYS   3          1HE       LYS   3   8.609  12.881  -6.059
   24   1HZ   LYS   3          1HZ       LYS   3   7.353  11.118  -7.207
   25   2HZ   LYS   3          2HZ       LYS   3   6.549  11.710  -5.832
   26   3HZ   LYS   3          3HZ       LYS   3   7.344  10.210  -5.775
   27    HA   PRO   4           HA       PRO   4  13.191   5.188  -4.276
   28   1HB   PRO   4          2HB       PRO   4  10.876   3.719  -4.016
   29   2HB   PRO   4          1HB       PRO   4  11.516   4.782  -2.753
   30   1HG   PRO   4          2HG       PRO   4   9.186   5.194  -4.557
   31   2HG   PRO   4          1HG       PRO   4   9.506   5.884  -2.957
   32   1HD   PRO   4          2HD       PRO   4   9.842   7.202  -5.442
   33   2HD   PRO   4          1HD       PRO   4  10.425   7.770  -3.863
   34    HA   PRO   5           HA       PRO   5  13.109   2.782  -7.976
   35   1HB   PRO   5          2HB       PRO   5  13.085   0.200  -7.041
   36   2HB   PRO   5          1HB       PRO   5  14.495   1.252  -6.973
   37   1HG   PRO   5          2HG       PRO   5  12.681   0.423  -4.772
   38   2HG   PRO   5          1HG       PRO   5  14.385   0.901  -4.699
   39   1HD   PRO   5          2HD       PRO   5  12.192   2.524  -4.000
   40   2HD   PRO   5          1HD       PRO   5  13.850   3.092  -4.280
   41    H    TYR   6           H        TYR   6  10.408   2.878  -6.050
   42    HA   TYR   6           HA       TYR   6   8.927   0.927  -7.729
   43   1HB   TYR   6          2HB       TYR   6   7.975   2.323  -5.231
   44   2HB   TYR   6          1HB       TYR   6   7.251   0.922  -6.023
   45    HD1  TYR   6           HD1      TYR   6  10.251  -0.134  -6.707
   46    HD2  TYR   6           HD2      TYR   6   8.098   0.966  -3.162
   47    HE1  TYR   6           HE1      TYR   6  11.681  -1.651  -5.355
   48    HE2  TYR   6           HE2      TYR   6   9.516  -0.552  -1.812
   49    HH   TYR   6           HH       TYR   6  11.754  -2.776  -3.312
   50    H    SER   7           H        SER   7   7.283   1.530  -8.985
   51    HA   SER   7           HA       SER   7   6.885   4.445  -9.409
   52   1HB   SER   7          2HB       SER   7   7.297   2.241 -11.122
   53   2HB   SER   7          1HB       SER   7   5.620   2.735 -11.363
   54    HG   SER   7           HG       SER   7   7.653   4.673 -11.236
   55    H    TYR   8           H        TYR   8   4.465   4.782 -10.303
   56    HA   TYR   8           HA       TYR   8   2.751   3.838  -8.109
   57   1HB   TYR   8          2HB       TYR   8   2.033   5.655 -10.425
   58   2HB   TYR   8          1HB       TYR   8   1.162   5.472  -8.899
   59    HD1  TYR   8           HD1      TYR   8   3.733   5.169  -7.192
   60    HD2  TYR   8           HD2      TYR   8   2.494   8.047 -10.128
   61    HE1  TYR   8           HE1      TYR   8   5.202   6.864  -6.143
   62    HE2  TYR   8           HE2      TYR   8   3.963   9.745  -9.077
   63    HH   TYR   8           HH       TYR   8   6.069   9.719  -7.643
   64    H    ALA   9           H        ALA   9   3.058   1.590  -9.011
   65    HA   ALA   9           HA       ALA   9   0.643   0.667 -10.224
   66   1HB   ALA   9          1HB       ALA   9   1.134   0.425 -12.435
   67   2HB   ALA   9          2HB       ALA   9   2.812  -0.009 -12.109
   68   3HB   ALA   9          3HB       ALA   9   2.329   1.686 -12.138
   69    H    GLN  10           H        GLN  10   4.125  -0.019  -9.988
   70    HA   GLN  10           HA       GLN  10   3.576  -2.835  -9.227
   71   1HB   GLN  10          2HB       GLN  10   6.071  -3.019  -9.204
   72   2HB   GLN  10          1HB       GLN  10   5.468  -2.438 -10.756
   73   1HG   GLN  10          2HG       GLN  10   6.468  -0.418 -10.515
   74   2HG   GLN  10          1HG       GLN  10   5.992  -0.293  -8.823
   75   1HE2  GLN  10          1HE2      GLN  10   8.311  -2.133 -10.884
   76   2HE2  GLN  10          2HE2      GLN  10   9.542  -2.172  -9.714
   77    H    LEU  11           H        LEU  11   4.455   0.274  -7.979
   78    HA   LEU  11           HA       LEU  11   5.423  -0.443  -5.392
   79   1HB   LEU  11          2HB       LEU  11   5.617   1.841  -6.184
   80   2HB   LEU  11          1HB       LEU  11   3.875   1.953  -6.429
   81    HG   LEU  11           HG       LEU  11   4.108   1.224  -3.759
   82   1HD1  LEU  11          1HD1      LEU  11   6.422   1.660  -3.569
   83   2HD1  LEU  11          2HD1      LEU  11   5.663   3.146  -2.998
   84   3HD1  LEU  11          3HD1      LEU  11   6.331   3.067  -4.630
   85   1HD2  LEU  11          1HD2      LEU  11   3.857   3.962  -3.720
   86   2HD2  LEU  11          2HD2      LEU  11   2.530   2.842  -4.028
   87   3HD2  LEU  11          3HD2      LEU  11   3.393   3.581  -5.377
   88    H    ILE  12           H        ILE  12   2.230   0.038  -6.783
   89    HA   ILE  12           HA       ILE  12   0.643  -0.321  -4.398
   90    HB   ILE  12           HB       ILE  12  -0.219  -1.336  -7.070
   91   1HG1  ILE  12          2HG1      ILE  12   0.787   0.696  -7.787
   92   2HG1  ILE  12          1HG1      ILE  12  -0.923   1.077  -7.587
   93   1HG2  ILE  12          1HG2      ILE  12  -1.422  -0.647  -4.575
   94   2HG2  ILE  12          2HG2      ILE  12  -2.173  -1.360  -6.002
   95   3HG2  ILE  12          3HG2      ILE  12  -2.086   0.393  -5.835
   96   1HD1  ILE  12          1HD1      ILE  12  -0.551   2.397  -5.743
   97   2HD1  ILE  12          2HD1      ILE  12   1.000   2.620  -6.548
   98   3HD1  ILE  12          3HD1      ILE  12   0.855   1.474  -5.219
   99    H    VAL  13           H        VAL  13   1.624  -2.573  -6.961
  100    HA   VAL  13           HA       VAL  13   0.467  -4.931  -6.082
  101    HB   VAL  13           HB       VAL  13   3.280  -4.614  -7.162
  102   1HG1  VAL  13          1HG1      VAL  13   1.483  -6.912  -6.656
  103   2HG1  VAL  13          2HG1      VAL  13   3.243  -6.854  -6.740
  104   3HG1  VAL  13          3HG1      VAL  13   2.290  -6.907  -8.223
  105   1HG2  VAL  13          1HG2      VAL  13   1.598  -3.443  -8.533
  106   2HG2  VAL  13          2HG2      VAL  13   0.618  -4.904  -8.591
  107   3HG2  VAL  13          3HG2      VAL  13   2.200  -4.868  -9.369
  108    H    GLN  14           H        GLN  14   3.848  -4.020  -5.255
  109    HA   GLN  14           HA       GLN  14   4.216  -6.020  -3.293
  110   1HB   GLN  14          2HB       GLN  14   5.716  -3.916  -4.288
  111   2HB   GLN  14          1HB       GLN  14   5.447  -3.440  -2.611
  112   1HG   GLN  14          2HG       GLN  14   6.335  -5.569  -1.821
  113   2HG   GLN  14          1HG       GLN  14   6.509  -6.145  -3.481
  114   1HE2  GLN  14          1HE2      GLN  14   7.194  -2.772  -2.804
  115   2HE2  GLN  14          2HE2      GLN  14   8.879  -2.886  -2.943
  116    H    ALA  15           H        ALA  15   2.463  -3.029  -3.210
  117    HA   ALA  15           HA       ALA  15   2.266  -2.753  -0.352
  118   1HB   ALA  15          1HB       ALA  15   1.763  -1.061  -2.306
  119   2HB   ALA  15          2HB       ALA  15   0.837  -0.971  -0.808
  120   3HB   ALA  15          3HB       ALA  15   0.146  -1.761  -2.226
  121    H    ILE  16           H        ILE  16  -0.033  -4.005  -2.765
  122    HA   ILE  16           HA       ILE  16  -1.779  -4.988  -0.625
  123    HB   ILE  16           HB       ILE  16  -2.738  -5.913  -3.132
  124   1HG1  ILE  16          2HG1      ILE  16  -1.523  -3.142  -3.225
  125   2HG1  ILE  16          1HG1      ILE  16  -1.446  -4.414  -4.444
  126   1HG2  ILE  16          1HG2      ILE  16  -4.576  -4.464  -2.597
  127   2HG2  ILE  16          2HG2      ILE  16  -3.543  -3.440  -1.604
  128   3HG2  ILE  16          3HG2      ILE  16  -3.938  -5.071  -1.067
  129   1HD1  ILE  16          1HD1      ILE  16  -3.626  -2.465  -3.859
  130   2HD1  ILE  16          2HD1      ILE  16  -4.099  -4.074  -4.402
  131   3HD1  ILE  16          3HD1      ILE  16  -3.050  -3.078  -5.409
  132    H    SER  17           H        SER  17  -0.266  -6.516  -3.496
  133    HA   SER  17           HA       SER  17  -0.819  -9.177  -2.767
  134   1HB   SER  17          2HB       SER  17   1.141  -9.776  -4.187
  135   2HB   SER  17          1HB       SER  17   0.069  -8.613  -4.963
  136    HG   SER  17           HG       SER  17   2.609  -8.248  -3.811
  137    H    SER  18           H        SER  18   1.979  -7.163  -1.835
  138    HA   SER  18           HA       SER  18   3.174  -9.334  -0.290
  139   1HB   SER  18          2HB       SER  18   4.214  -7.079  -1.358
  140   2HB   SER  18          1HB       SER  18   3.940  -6.523   0.292
  141    HG   SER  18           HG       SER  18   6.007  -7.564  -0.093
  142    H    ALA  19           H        ALA  19   0.704  -7.015   0.286
  143    HA   ALA  19           HA       ALA  19   1.029  -6.620   3.100
  144   1HB   ALA  19          1HB       ALA  19  -0.792  -5.788   1.179
  145   2HB   ALA  19          2HB       ALA  19  -0.900  -5.448   2.906
  146   3HB   ALA  19          3HB       ALA  19  -1.760  -6.828   2.224
  147    H    GLN  20           H        GLN  20  -1.443  -7.587   4.176
  148    HA   GLN  20           HA       GLN  20  -0.673 -10.174   5.028
  149   1HB   GLN  20          2HB       GLN  20  -2.219  -9.080   6.423
  150   2HB   GLN  20          1HB       GLN  20  -3.300  -8.690   5.090
  151   1HG   GLN  20          2HG       GLN  20  -4.444 -10.605   5.420
  152   2HG   GLN  20          1HG       GLN  20  -2.966 -11.552   5.245
  153   1HE2  GLN  20          1HE2      GLN  20  -3.197 -12.975   7.033
  154   2HE2  GLN  20          2HE2      GLN  20  -3.294 -12.443   8.642
  155    H    ASP  21           H        ASP  21  -3.769  -9.843   3.282
  156    HA   ASP  21           HA       ASP  21  -3.132 -12.367   1.887
  157   1HB   ASP  21          2HB       ASP  21  -5.639 -10.708   2.193
  158   2HB   ASP  21          1HB       ASP  21  -5.545 -12.032   1.030
  159    H    ARG  22           H        ARG  22  -4.800  -9.447   0.701
  160    HA   ARG  22           HA       ARG  22  -2.841  -8.664  -1.206
  161   1HB   ARG  22          2HB       ARG  22  -4.000  -9.565  -3.276
  162   2HB   ARG  22          1HB       ARG  22  -3.167 -10.780  -2.305
  163   1HG   ARG  22          2HG       ARG  22  -5.508 -10.985  -1.103
  164   2HG   ARG  22          1HG       ARG  22  -6.112 -10.295  -2.610
  165   1HD   ARG  22          2HD       ARG  22  -5.556 -12.154  -3.845
  166   2HD   ARG  22          1HD       ARG  22  -4.159 -12.534  -2.839
  167    HE   ARG  22           HE       ARG  22  -5.948 -13.258  -1.100
  168   1HH1  ARG  22          1HH2      ARG  22  -5.764 -13.936  -4.430
  169   2HH1  ARG  22          2HH2      ARG  22  -7.161 -14.961  -4.455
  170   1HH2  ARG  22          1HH1      ARG  22  -8.015 -14.322  -1.155
  171   2HH2  ARG  22          2HH1      ARG  22  -8.436 -15.179  -2.600
  172    H    GLN  23           H        GLN  23  -5.029  -7.668   0.584
  173    HA   GLN  23           HA       GLN  23  -6.431  -5.975  -1.427
  174   1HB   GLN  23          2HB       GLN  23  -7.502  -7.322   1.057
  175   2HB   GLN  23          1HB       GLN  23  -8.302  -5.930   0.338
  176   1HG   GLN  23          2HG       GLN  23  -9.311  -7.300  -1.131
  177   2HG   GLN  23          1HG       GLN  23  -7.728  -7.727  -1.774
  178   1HE2  GLN  23          1HE2      GLN  23  -6.756  -9.001   0.696
  179   2HE2  GLN  23          2HE2      GLN  23  -7.614 -10.456   0.864
  180    H    LEU  24           H        LEU  24  -6.587  -3.784  -0.872
  181    HA   LEU  24           HA       LEU  24  -5.597  -2.949   1.794
  182   1HB   LEU  24          2HB       LEU  24  -4.486  -2.118  -0.889
  183   2HB   LEU  24          1HB       LEU  24  -4.327  -1.110   0.536
  184    HG   LEU  24           HG       LEU  24  -3.379  -3.978   0.333
  185   1HD1  LEU  24          1HD1      LEU  24  -1.184  -2.415   0.824
  186   2HD1  LEU  24          2HD1      LEU  24  -2.128  -1.364  -0.232
  187   3HD1  LEU  24          3HD1      LEU  24  -1.662  -2.976  -0.777
  188   1HD2  LEU  24          1HD2      LEU  24  -3.552  -3.849   2.591
  189   2HD2  LEU  24          2HD2      LEU  24  -3.794  -2.102   2.555
  190   3HD2  LEU  24          3HD2      LEU  24  -2.162  -2.768   2.499
  191    H    THR  25           H        THR  25  -6.421  -0.871   2.409
  192    HA   THR  25           HA       THR  25  -8.895  -0.123   1.027
  193    HB   THR  25           HB       THR  25  -7.806   1.744   3.040
  194    HG1  THR  25           HG1      THR  25  -7.744   0.360   4.679
  195   1HG2  THR  25          1HG2      THR  25 -10.024   1.868   3.699
  196   2HG2  THR  25          2HG2      THR  25 -10.343   0.180   3.304
  197   3HG2  THR  25          3HG2      THR  25 -10.218   1.378   2.015
  198    H    LEU  26           H        LEU  26  -9.074   2.405   0.553
  199    HA   LEU  26           HA       LEU  26  -7.201   2.988  -1.503
  200   1HB   LEU  26          2HB       LEU  26  -9.553   4.143  -0.734
  201   2HB   LEU  26          1HB       LEU  26  -8.395   5.348  -0.173
  202    HG   LEU  26           HG       LEU  26  -8.672   4.243  -2.981
  203   1HD1  LEU  26          1HD1      LEU  26  -9.392   6.400  -3.576
  204   2HD1  LEU  26          2HD1      LEU  26  -8.697   7.134  -2.131
  205   3HD1  LEU  26          3HD1      LEU  26 -10.162   6.161  -2.008
  206   1HD2  LEU  26          1HD2      LEU  26  -6.807   6.033  -3.361
  207   2HD2  LEU  26          2HD2      LEU  26  -6.346   4.451  -2.738
  208   3HD2  LEU  26          3HD2      LEU  26  -6.486   5.824  -1.640
  209    H    SER  27           H        SER  27  -7.246   3.899   1.924
  210    HA   SER  27           HA       SER  27  -4.622   5.252   1.574
  211   1HB   SER  27          2HB       SER  27  -6.732   5.291   3.705
  212   2HB   SER  27          1HB       SER  27  -5.084   5.774   4.094
  213    HG   SER  27           HG       SER  27  -6.010   7.611   3.394
  214    H    GLY  28           H        GLY  28  -4.853   2.299   1.480
  215   1HA   GLY  28          2HA       GLY  28  -3.540   1.523   4.049
  216   2HA   GLY  28          1HA       GLY  28  -4.196   0.391   2.863
  217    H    ILE  29           H        ILE  29  -3.115   1.557   0.583
  218    HA   ILE  29           HA       ILE  29  -0.626   0.320   0.270
  219    HB   ILE  29           HB       ILE  29  -2.217   1.160  -1.477
  220   1HG1  ILE  29          2HG1      ILE  29   0.659   2.070  -1.731
  221   2HG1  ILE  29          1HG1      ILE  29   0.049   0.452  -2.094
  222   1HG2  ILE  29          1HG2      ILE  29  -0.849   3.812  -1.009
  223   2HG2  ILE  29          2HG2      ILE  29  -2.445   3.422  -0.367
  224   3HG2  ILE  29          3HG2      ILE  29  -2.182   3.467  -2.106
  225   1HD1  ILE  29          1HD1      ILE  29   0.133   2.631  -3.849
  226   2HD1  ILE  29          2HD1      ILE  29  -1.560   2.462  -3.387
  227   3HD1  ILE  29          3HD1      ILE  29  -0.702   1.098  -4.104
  228    H    TYR  30           H        TYR  30  -1.427   3.608   1.207
  229    HA   TYR  30           HA       TYR  30   1.243   4.648   1.118
  230   1HB   TYR  30          2HB       TYR  30  -0.997   5.586   2.919
  231   2HB   TYR  30          1HB       TYR  30   0.332   6.544   2.257
  232    HD1  TYR  30           HD1      TYR  30  -3.028   6.073   1.877
  233    HD2  TYR  30           HD2      TYR  30   0.546   5.987  -0.482
  234    HE1  TYR  30           HE1      TYR  30  -4.366   6.473  -0.172
  235    HE2  TYR  30           HE2      TYR  30  -0.777   6.390  -2.529
  236    HH   TYR  30           HH       TYR  30  -3.947   5.911  -2.784
  237    H    ALA  31           H        ALA  31  -0.713   3.410   3.838
  238    HA   ALA  31           HA       ALA  31   1.417   3.632   5.754
  239   1HB   ALA  31          1HB       ALA  31  -0.748   3.366   6.673
  240   2HB   ALA  31          2HB       ALA  31   0.026   1.807   6.958
  241   3HB   ALA  31          3HB       ALA  31  -1.116   1.993   5.626
  242    H    HIS  32           H        HIS  32   0.910   1.491   3.112
  243    HA   HIS  32           HA       HIS  32   2.333  -0.780   4.249
  244   1HB   HIS  32          2HB       HIS  32   0.693  -1.137   2.482
  245   2HB   HIS  32          1HB       HIS  32   1.611  -0.105   1.384
  246    HD1  HIS  32           HD1      HIS  32   1.261  -3.567   2.385
  247    HD2  HIS  32           HD2      HIS  32   4.399  -1.208   0.983
  248    HE1  HIS  32           HE1      HIS  32   3.059  -5.165   1.592
  249    H    ILE  33           H        ILE  33   3.268   0.868   1.237
  250    HA   ILE  33           HA       ILE  33   6.018   0.233   1.427
  251    HB   ILE  33           HB       ILE  33   6.355   2.075  -0.214
  252   1HG1  ILE  33          2HG1      ILE  33   3.823   2.899  -0.884
  253   2HG1  ILE  33          1HG1      ILE  33   3.727   2.857   0.876
  254   1HG2  ILE  33          1HG2      ILE  33   5.506  -0.208  -0.853
  255   2HG2  ILE  33          2HG2      ILE  33   4.999   1.072  -1.957
  256   3HG2  ILE  33          3HG2      ILE  33   3.865   0.434  -0.766
  257   1HD1  ILE  33          1HD1      ILE  33   5.334   4.618  -0.889
  258   2HD1  ILE  33          2HD1      ILE  33   6.154   4.037   0.559
  259   3HD1  ILE  33          3HD1      ILE  33   4.650   4.945   0.701
  260    H    THR  34           H        THR  34   4.320   3.150   2.601
  261    HA   THR  34           HA       THR  34   6.621   4.630   3.337
  262    HB   THR  34           HB       THR  34   5.176   5.849   4.866
  263    HG1  THR  34           HG1      THR  34   3.728   4.778   5.900
  264   1HG2  THR  34          1HG2      THR  34   4.778   6.379   2.566
  265   2HG2  THR  34          2HG2      THR  34   3.197   6.240   3.331
  266   3HG2  THR  34          3HG2      THR  34   3.812   4.924   2.334
  267    H    LYS  35           H        LYS  35   5.116   1.863   4.865
  268    HA   LYS  35           HA       LYS  35   6.561   2.201   7.384
  269   1HB   LYS  35          2HB       LYS  35   4.497   0.448   6.328
  270   2HB   LYS  35          1HB       LYS  35   5.730  -0.467   7.196
  271   1HG   LYS  35          2HG       LYS  35   4.450   2.031   8.327
  272   2HG   LYS  35          1HG       LYS  35   3.817   0.411   8.628
  273   1HD   LYS  35          2HD       LYS  35   6.685   0.498   9.066
  274   2HD   LYS  35          1HD       LYS  35   5.859   1.700  10.058
  275   1HE   LYS  35          2HE       LYS  35   4.721  -1.070   9.890
  276   2HE   LYS  35          1HE       LYS  35   6.121  -0.783  10.926
  277   1HZ   LYS  35          1HZ       LYS  35   3.742   0.960  11.055
  278   2HZ   LYS  35          2HZ       LYS  35   4.954   0.727  12.222
  279   3HZ   LYS  35          3HZ       LYS  35   3.808  -0.490  11.929
  280    H    HIS  36           H        HIS  36   7.078   0.498   4.346
  281    HA   HIS  36           HA       HIS  36   9.525  -0.751   5.514
  282   1HB   HIS  36          2HB       HIS  36   7.900  -1.379   3.042
  283   2HB   HIS  36          1HB       HIS  36   9.495  -2.075   3.328
  284    HD1  HIS  36           HD1      HIS  36   9.489  -4.205   4.612
  285    HD2  HIS  36           HD2      HIS  36   6.089  -1.931   5.416
  286    HE1  HIS  36           HE1      HIS  36   8.049  -5.593   6.168
  287    H    TYR  37           H        TYR  37   8.782   2.060   4.106
  288    HA   TYR  37           HA       TYR  37  11.386   2.139   2.662
  289   1HB   TYR  37          2HB       TYR  37   8.751   2.551   1.549
  290   2HB   TYR  37          1HB       TYR  37   9.710   4.027   1.409
  291    HD1  TYR  37           HD1      TYR  37  11.081   4.221  -0.454
  292    HD2  TYR  37           HD2      TYR  37  10.122   0.326   1.062
  293    HE1  TYR  37           HE1      TYR  37  12.370   3.186  -2.296
  294    HE2  TYR  37           HE2      TYR  37  11.403  -0.717  -0.778
  295    HH   TYR  37           HH       TYR  37  13.553   0.331  -2.337
  296    HA   PRO  38           HA       PRO  38  11.763   5.535   5.529
  297   1HB   PRO  38          2HB       PRO  38  14.389   6.080   4.925
  298   2HB   PRO  38          1HB       PRO  38  13.883   4.759   5.993
  299   1HG   PRO  38          2HG       PRO  38  14.882   4.625   3.186
  300   2HG   PRO  38          1HG       PRO  38  14.965   3.403   4.467
  301   1HD   PRO  38          2HD       PRO  38  13.129   3.425   2.313
  302   2HD   PRO  38          1HD       PRO  38  13.019   2.415   3.770
  303    H    TYR  39           H        TYR  39  11.965   5.622   2.103
  304    HA   TYR  39           HA       TYR  39  12.586   8.486   1.935
  305   1HB   TYR  39          2HB       TYR  39  13.271   7.016   0.097
  306   2HB   TYR  39          1HB       TYR  39  11.594   6.537  -0.168
  307    HD1  TYR  39           HD1      TYR  39  10.223   7.786  -1.617
  308    HD2  TYR  39           HD2      TYR  39  13.804   9.555  -0.030
  309    HE1  TYR  39           HE1      TYR  39   9.881   9.776  -3.059
  310    HE2  TYR  39           HE2      TYR  39  13.461  11.541  -1.473
  311    HH   TYR  39           HH       TYR  39  11.000  12.560  -2.643
  312    H    TYR  40           H        TYR  40   9.713   6.411   1.596
  313    HA   TYR  40           HA       TYR  40   7.989   8.753   1.166
  314   1HB   TYR  40          2HB       TYR  40   7.575   5.782   1.284
  315   2HB   TYR  40          1HB       TYR  40   6.190   6.853   1.486
  316    HD1  TYR  40           HD1      TYR  40   7.405   4.899  -0.885
  317    HD2  TYR  40           HD2      TYR  40   6.840   9.111  -0.262
  318    HE1  TYR  40           HE1      TYR  40   7.318   5.247  -3.338
  319    HE2  TYR  40           HE2      TYR  40   6.752   9.460  -2.717
  320    HH   TYR  40           HH       TYR  40   6.627   8.454  -4.707
  321    H    ARG  41           H        ARG  41   8.316   9.920   3.118
  322    HA   ARG  41           HA       ARG  41   6.771   8.837   5.409
  323   1HB   ARG  41          2HB       ARG  41   8.766  10.062   6.775
  324   2HB   ARG  41          1HB       ARG  41   8.774   8.337   6.413
  325   1HG   ARG  41          2HG       ARG  41  10.452   8.535   4.884
  326   2HG   ARG  41          1HG       ARG  41   9.837  10.065   4.261
  327   1HD   ARG  41          2HD       ARG  41  10.630  11.057   6.526
  328   2HD   ARG  41          1HD       ARG  41  11.591   9.583   6.662
  329    HE   ARG  41           HE       ARG  41  12.356  10.377   4.220
  330   1HH1  ARG  41          1HH1      ARG  41  14.116  11.110   6.499
  331   2HH1  ARG  41          2HH1      ARG  41  14.212  12.835   6.361
  332   1HH2  ARG  41          1HH2      ARG  41  11.456  13.088   4.274
  333   2HH2  ARG  41          2HH2      ARG  41  12.707  13.954   5.103
  334    H    THR  42           H        THR  42   8.910  11.661   5.250
  335    HA   THR  42           HA       THR  42   6.581  13.385   5.852
  336    HB   THR  42           HB       THR  42   8.157  15.040   6.492
  337    HG1  THR  42           HG1      THR  42   9.733  15.286   5.141
  338   1HG2  THR  42          1HG2      THR  42  10.069  13.158   7.398
  339   2HG2  THR  42          2HG2      THR  42   8.516  12.322   7.368
  340   3HG2  THR  42          3HG2      THR  42   8.696  13.812   8.293
  341    H    ALA  43           H        ALA  43   7.480  12.111   3.117
  342    HA   ALA  43           HA       ALA  43   6.906  14.577   1.560
  343   1HB   ALA  43          1HB       ALA  43   9.188  14.580   1.151
  344   2HB   ALA  43          2HB       ALA  43   8.649  13.502  -0.136
  345   3HB   ALA  43          3HB       ALA  43   9.331  12.834   1.345
  346    H    ASP  44           H        ASP  44   4.838  13.076   1.815
  347    HA   ASP  44           HA       ASP  44   4.867  11.015  -0.345
  348   1HB   ASP  44          2HB       ASP  44   2.759  11.476   1.786
  349   2HB   ASP  44          1HB       ASP  44   2.874  10.098   0.691
  350    H    LYS  45           H        LYS  45   4.392  14.171  -0.218
  351    HA   LYS  45           HA       LYS  45   1.722  14.371  -1.393
  352   1HB   LYS  45          2HB       LYS  45   2.296  16.759  -1.715
  353   2HB   LYS  45          1HB       LYS  45   2.616  16.235  -0.063
  354   1HG   LYS  45          2HG       LYS  45   5.028  15.774  -0.883
  355   2HG   LYS  45          1HG       LYS  45   4.598  16.763  -2.277
  356   1HD   LYS  45          2HD       LYS  45   3.681  18.342  -0.263
  357   2HD   LYS  45          1HD       LYS  45   5.052  17.568   0.535
  358   1HE   LYS  45          2HE       LYS  45   5.844  19.593  -0.543
  359   2HE   LYS  45          1HE       LYS  45   6.477  18.207  -1.431
  360   1HZ   LYS  45          1HZ       LYS  45   4.840  20.285  -2.371
  361   2HZ   LYS  45          2HZ       LYS  45   3.982  18.824  -2.501
  362   3HZ   LYS  45          3HZ       LYS  45   5.503  18.988  -3.239
  363    H    GLY  46           H        GLY  46   2.174  12.788  -3.152
  364   1HA   GLY  46          2HA       GLY  46   2.622  14.070  -5.651
  365   2HA   GLY  46          1HA       GLY  46   4.110  13.231  -5.196
  366    H    TRP  47           H        TRP  47   3.232  10.957  -4.022
  367    HA   TRP  47           HA       TRP  47   1.887   9.564  -6.270
  368   1HB   TRP  47          2HB       TRP  47   2.880   7.559  -5.465
  369   2HB   TRP  47          1HB       TRP  47   4.130   8.791  -5.312
  370    HD1  TRP  47           HD1      TRP  47   4.045  10.058  -2.726
  371    HE1  TRP  47           HE1      TRP  47   3.971   8.844  -0.463
  372    HE3  TRP  47           HE3      TRP  47   2.178   5.543  -4.209
  373    HZ2  TRP  47           HZ2      TRP  47   3.235   6.286   0.584
  374    HZ3  TRP  47           HZ3      TRP  47   1.815   3.733  -2.561
  375    HH2  TRP  47           HH2      TRP  47   2.337   4.099  -0.168
  376    H    GLN  48           H        GLN  48   0.582  11.190  -4.032
  377    HA   GLN  48           HA       GLN  48  -0.892   9.154  -2.526
  378   1HB   GLN  48          2HB       GLN  48  -0.266  11.564  -1.764
  379   2HB   GLN  48          1HB       GLN  48  -1.663  12.061  -2.717
  380   1HG   GLN  48          2HG       GLN  48  -2.278  11.661  -0.351
  381   2HG   GLN  48          1HG       GLN  48  -3.100  10.534  -1.430
  382   1HE2  GLN  48          1HE2      GLN  48   0.310   9.979  -0.953
  383   2HE2  GLN  48          2HE2      GLN  48   0.153   8.654   0.094
  384    H    ASN  49           H        ASN  49  -1.980  11.790  -4.704
  385    HA   ASN  49           HA       ASN  49  -4.490  10.440  -5.268
  386   1HB   ASN  49          2HB       ASN  49  -3.090  12.872  -6.362
  387   2HB   ASN  49          1HB       ASN  49  -4.518  12.230  -7.172
  388   1HD2  ASN  49          1HD2      ASN  49  -6.545  12.738  -6.268
  389   2HD2  ASN  49          2HD2      ASN  49  -6.753  13.522  -4.776
  390    H    SER  50           H        SER  50  -1.302  10.153  -6.463
  391    HA   SER  50           HA       SER  50  -1.921   9.337  -9.161
  392   1HB   SER  50          2HB       SER  50   0.435   9.545  -7.476
  393   2HB   SER  50          1HB       SER  50   0.451   8.040  -8.391
  394    HG   SER  50           HG       SER  50   0.299   9.188 -10.266
  395    H    ILE  51           H        ILE  51  -1.718   7.657  -6.065
  396    HA   ILE  51           HA       ILE  51  -1.766   4.989  -7.161
  397    HB   ILE  51           HB       ILE  51  -2.568   6.085  -4.452
  398   1HG1  ILE  51          2HG1      ILE  51  -0.292   6.188  -4.307
  399   2HG1  ILE  51          1HG1      ILE  51  -0.422   4.456  -4.041
  400   1HG2  ILE  51          1HG2      ILE  51  -2.072   3.173  -4.999
  401   2HG2  ILE  51          2HG2      ILE  51  -3.675   3.852  -5.257
  402   3HG2  ILE  51          3HG2      ILE  51  -2.940   3.921  -3.663
  403   1HD1  ILE  51          1HD1      ILE  51  -0.168   4.139  -6.535
  404   2HD1  ILE  51          2HD1      ILE  51   1.256   4.813  -5.742
  405   3HD1  ILE  51          3HD1      ILE  51   0.176   5.865  -6.657
  406    H    ARG  52           H        ARG  52  -4.406   6.853  -5.576
  407    HA   ARG  52           HA       ARG  52  -6.503   5.095  -6.083
  408   1HB   ARG  52          2HB       ARG  52  -6.857   7.154  -4.831
  409   2HB   ARG  52          1HB       ARG  52  -6.523   8.122  -6.265
  410   1HG   ARG  52          2HG       ARG  52  -8.503   7.322  -7.369
  411   2HG   ARG  52          1HG       ARG  52  -8.775   6.105  -6.120
  412   1HD   ARG  52          2HD       ARG  52 -10.085   7.618  -5.079
  413   2HD   ARG  52          1HD       ARG  52  -8.611   8.513  -4.710
  414    HE   ARG  52           HE       ARG  52  -9.260   9.334  -7.277
  415   1HH1  ARG  52          1HH1      ARG  52 -10.018  10.046  -4.093
  416   2HH1  ARG  52          2HH1      ARG  52 -11.408  11.014  -4.450
  417   1HH2  ARG  52          1HH2      ARG  52 -11.433  10.206  -7.821
  418   2HH2  ARG  52          2HH2      ARG  52 -12.211  11.103  -6.561
  419    H    HIS  53           H        HIS  53  -4.940   7.311  -8.328
  420    HA   HIS  53           HA       HIS  53  -6.835   6.848 -10.483
  421   1HB   HIS  53          2HB       HIS  53  -5.512   8.908 -10.391
  422   2HB   HIS  53          1HB       HIS  53  -4.018   7.976 -10.478
  423    HD1  HIS  53           HD1      HIS  53  -3.220   7.250 -12.768
  424    HD2  HIS  53           HD2      HIS  53  -7.090   8.797 -12.855
  425    HE1  HIS  53           HE1      HIS  53  -3.840   7.488 -15.212
  426    H    ASN  54           H        ASN  54  -3.707   5.494  -9.532
  427    HA   ASN  54           HA       ASN  54  -3.340   3.925 -11.919
  428   1HB   ASN  54          2HB       ASN  54  -2.069   4.055  -9.221
  429   2HB   ASN  54          1HB       ASN  54  -1.755   2.642 -10.231
  430   1HD2  ASN  54          1HD2      ASN  54  -0.541   5.664  -9.549
  431   2HD2  ASN  54          2HD2      ASN  54   0.249   5.984 -11.015
  432    H    LEU  55           H        LEU  55  -5.068   3.274  -8.907
  433    HA   LEU  55           HA       LEU  55  -5.141   0.406  -9.355
  434   1HB   LEU  55          2HB       LEU  55  -7.303   1.660  -7.743
  435   2HB   LEU  55          1HB       LEU  55  -6.308   0.257  -7.387
  436    HG   LEU  55           HG       LEU  55  -5.492   3.158  -7.169
  437   1HD1  LEU  55          1HD1      LEU  55  -5.001   1.489  -4.881
  438   2HD1  LEU  55          2HD1      LEU  55  -6.697   1.392  -5.357
  439   3HD1  LEU  55          3HD1      LEU  55  -5.969   2.957  -5.000
  440   1HD2  LEU  55          1HD2      LEU  55  -3.423   2.383  -7.708
  441   2HD2  LEU  55          2HD2      LEU  55  -3.917   0.701  -7.523
  442   3HD2  LEU  55          3HD2      LEU  55  -3.450   1.643  -6.108
  443    H    SER  56           H        SER  56  -6.777   3.052 -10.752
  444    HA   SER  56           HA       SER  56  -9.153   1.455 -11.489
  445   1HB   SER  56          2HB       SER  56  -9.718   3.701 -11.036
  446   2HB   SER  56          1HB       SER  56  -8.322   4.322 -11.913
  447    HG   SER  56           HG       SER  56 -10.611   4.237 -12.902
  448    H    LEU  57           H        LEU  57  -6.486   3.144 -13.188
  449    HA   LEU  57           HA       LEU  57  -7.223   1.941 -15.743
  450   1HB   LEU  57          2HB       LEU  57  -4.801   3.517 -14.836
  451   2HB   LEU  57          1HB       LEU  57  -5.031   2.955 -16.492
  452    HG   LEU  57           HG       LEU  57  -7.211   4.178 -16.554
  453   1HD1  LEU  57          1HD1      LEU  57  -7.386   5.983 -14.706
  454   2HD1  LEU  57          2HD1      LEU  57  -6.278   4.959 -13.795
  455   3HD1  LEU  57          3HD1      LEU  57  -7.854   4.336 -14.282
  456   1HD2  LEU  57          1HD2      LEU  57  -5.929   6.534 -16.172
  457   2HD2  LEU  57          2HD2      LEU  57  -5.650   5.513 -17.583
  458   3HD2  LEU  57          3HD2      LEU  57  -4.541   5.447 -16.212
  459    H    ASN  58           H        ASN  58  -4.806   1.311 -13.239
  460    HA   ASN  58           HA       ASN  58  -3.089  -0.452 -14.524
  461   1HB   ASN  58          2HB       ASN  58  -4.214  -0.447 -11.733
  462   2HB   ASN  58          1HB       ASN  58  -3.131  -1.738 -12.253
  463   1HD2  ASN  58          1HD2      ASN  58  -3.018   1.722 -13.210
  464   2HD2  ASN  58          2HD2      ASN  58  -1.478   2.014 -12.572
  465    H    ARG  59           H        ARG  59  -3.502  -2.183 -15.760
  466    HA   ARG  59           HA       ARG  59  -6.078  -3.395 -15.974
  467   1HB   ARG  59          2HB       ARG  59  -3.539  -4.803 -16.770
  468   2HB   ARG  59          1HB       ARG  59  -5.107  -4.805 -17.581
  469   1HG   ARG  59          2HG       ARG  59  -4.289  -2.102 -17.460
  470   2HG   ARG  59          1HG       ARG  59  -2.874  -3.020 -17.977
  471   1HD   ARG  59          2HD       ARG  59  -4.386  -4.173 -19.668
  472   2HD   ARG  59          1HD       ARG  59  -5.614  -2.974 -19.262
  473    HE   ARG  59           HE       ARG  59  -3.183  -1.617 -19.901
  474   1HH1  ARG  59          1HH1      ARG  59  -4.362  -4.086 -21.750
  475   2HH1  ARG  59          2HH1      ARG  59  -4.812  -3.121 -23.115
  476   1HH2  ARG  59          1HH2      ARG  59  -4.334  -0.101 -21.475
  477   2HH2  ARG  59          2HH2      ARG  59  -4.797  -0.864 -22.960
  478    H    TYR  60           H        TYR  60  -3.297  -4.155 -13.944
  479    HA   TYR  60           HA       TYR  60  -4.625  -6.681 -13.130
  480   1HB   TYR  60          2HB       TYR  60  -2.493  -6.904 -11.721
  481   2HB   TYR  60          1HB       TYR  60  -2.339  -7.077 -13.461
  482    HD1  TYR  60           HD1      TYR  60  -2.244  -4.385 -10.818
  483    HD2  TYR  60           HD2      TYR  60  -0.669  -5.885 -14.522
  484    HE1  TYR  60           HE1      TYR  60  -0.576  -2.556 -10.865
  485    HE2  TYR  60           HE2      TYR  60   0.991  -4.055 -14.566
  486    HH   TYR  60           HH       TYR  60   2.102  -2.543 -12.920
  487    H    PHE  61           H        PHE  61  -5.543  -3.894 -12.354
  488    HA   PHE  61           HA       PHE  61  -5.642  -4.445  -9.425
  489   1HB   PHE  61          2HB       PHE  61  -5.036  -1.834 -10.812
  490   2HB   PHE  61          1HB       PHE  61  -5.705  -1.864  -9.186
  491    HD1  PHE  61           HD1      PHE  61  -3.038  -0.668  -9.819
  492    HD2  PHE  61           HD2      PHE  61  -4.078  -4.696  -8.722
  493    HE1  PHE  61           HE1      PHE  61  -0.768  -1.023  -8.922
  494    HE2  PHE  61           HE2      PHE  61  -1.801  -5.039  -7.841
  495    HZ   PHE  61           HZ       PHE  61  -0.153  -3.198  -7.931
  496    H    ILE  62           H        ILE  62  -7.692  -4.162  -8.537
  497    HA   ILE  62           HA       ILE  62  -9.767  -2.779 -10.100
  498    HB   ILE  62           HB       ILE  62 -11.025  -4.596 -10.745
  499   1HG1  ILE  62          2HG1      ILE  62  -9.782  -6.265  -8.531
  500   2HG1  ILE  62          1HG1      ILE  62 -11.325  -5.420  -8.398
  501   1HG2  ILE  62          1HG2      ILE  62  -8.927  -4.937 -11.887
  502   2HG2  ILE  62          2HG2      ILE  62  -9.517  -6.520 -11.381
  503   3HG2  ILE  62          3HG2      ILE  62  -8.228  -5.729 -10.475
  504   1HD1  ILE  62          1HD1      ILE  62 -11.944  -7.606  -9.038
  505   2HD1  ILE  62          2HD1      ILE  62 -10.607  -7.745 -10.180
  506   3HD1  ILE  62          3HD1      ILE  62 -11.980  -6.702 -10.552
  507    H    LYS  63           H        LYS  63 -11.855  -2.703  -8.863
  508    HA   LYS  63           HA       LYS  63 -11.271  -2.628  -5.945
  509   1HB   LYS  63          2HB       LYS  63 -13.297  -1.257  -7.710
  510   2HB   LYS  63          1HB       LYS  63 -13.501  -1.310  -5.959
  511   1HG   LYS  63          2HG       LYS  63 -11.436  -0.150  -5.595
  512   2HG   LYS  63          1HG       LYS  63 -10.968  -0.326  -7.287
  513   1HD   LYS  63          2HD       LYS  63 -11.825   1.956  -6.789
  514   2HD   LYS  63          1HD       LYS  63 -12.819   1.118  -7.981
  515   1HE   LYS  63          2HE       LYS  63 -13.816   0.440  -5.395
  516   2HE   LYS  63          1HE       LYS  63 -13.621   2.192  -5.451
  517   1HZ   LYS  63          1HZ       LYS  63 -15.690   0.775  -6.511
  518   2HZ   LYS  63          2HZ       LYS  63 -14.729   1.133  -7.866
  519   3HZ   LYS  63          3HZ       LYS  63 -15.301   2.386  -6.870
  520    H    VAL  64           H        VAL  64 -13.145  -3.255  -4.502
  521    HA   VAL  64           HA       VAL  64 -14.745  -5.478  -5.703
  522    HB   VAL  64           HB       VAL  64 -14.427  -6.791  -3.686
  523   1HG1  VAL  64          1HG1      VAL  64 -12.558  -6.521  -5.541
  524   2HG1  VAL  64          2HG1      VAL  64 -12.231  -7.447  -4.075
  525   3HG1  VAL  64          3HG1      VAL  64 -11.651  -5.787  -4.218
  526   1HG2  VAL  64          1HG2      VAL  64 -14.322  -4.687  -2.215
  527   2HG2  VAL  64          2HG2      VAL  64 -12.612  -4.607  -2.641
  528   3HG2  VAL  64          3HG2      VAL  64 -13.240  -6.007  -1.771
  529    HA   PRO  65           HA       PRO  65 -18.163  -3.457  -3.823
  530   1HB   PRO  65          2HB       PRO  65 -19.875  -5.602  -3.650
  531   2HB   PRO  65          1HB       PRO  65 -19.506  -4.762  -5.166
  532   1HG   PRO  65          2HG       PRO  65 -18.555  -7.424  -4.215
  533   2HG   PRO  65          1HG       PRO  65 -18.757  -6.831  -5.872
  534   1HD   PRO  65          2HD       PRO  65 -16.304  -7.035  -4.476
  535   2HD   PRO  65          1HD       PRO  65 -16.574  -6.137  -5.986
  536    H    ARG  66           H        ARG  66 -19.977  -4.413  -1.983
  537    HA   ARG  66           HA       ARG  66 -18.375  -5.505   0.275
  538   1HB   ARG  66          2HB       ARG  66 -18.308  -3.084   0.559
  539   2HB   ARG  66          1HB       ARG  66 -20.058  -2.983   0.370
  540   1HG   ARG  66          2HG       ARG  66 -20.434  -3.605   2.515
  541   2HG   ARG  66          1HG       ARG  66 -19.234  -4.896   2.437
  542   1HD   ARG  66          2HD       ARG  66 -17.528  -3.546   3.185
  543   2HD   ARG  66          1HD       ARG  66 -18.215  -2.095   2.454
  544    HE   ARG  66           HE       ARG  66 -19.957  -2.264   4.360
  545   1HH1  ARG  66          1HH1      ARG  66 -16.792  -1.698   4.779
  546   2HH1  ARG  66          2HH1      ARG  66 -16.652  -2.333   6.384
  547   1HH2  ARG  66          1HH2      ARG  66 -19.768  -3.859   6.338
  548   2HH2  ARG  66          2HH2      ARG  66 -18.336  -3.558   7.266
  549    H    SER  67           H        SER  67 -21.470  -4.108   0.964
  550    HA   SER  67           HA       SER  67 -22.995  -6.524   0.356
  551   1HB   SER  67          2HB       SER  67 -23.469  -6.324   3.097
  552   2HB   SER  67          1HB       SER  67 -22.543  -7.589   2.295
  553    HG   SER  67           HG       SER  67 -21.629  -5.963   4.048
  554    H    GLN  68           H        GLN  68 -22.812  -3.463   2.151
  555    HA   GLN  68           HA       GLN  68 -25.731  -3.087   1.613
  556   1HB   GLN  68          2HB       GLN  68 -24.359  -2.902   4.021
  557   2HB   GLN  68          1HB       GLN  68 -24.514  -1.221   3.510
  558   1HG   GLN  68          2HG       GLN  68 -26.689  -1.216   4.073
  559   2HG   GLN  68          1HG       GLN  68 -26.992  -2.587   3.004
  560   1HE2  GLN  68          1HE2      GLN  68 -27.578  -1.781   6.077
  561   2HE2  GLN  68          2HE2      GLN  68 -27.336  -3.268   6.859
  562    H    GLU  69           H        GLU  69 -26.380  -0.869   1.031
  563    HA   GLU  69           HA       GLU  69 -24.169   0.729  -0.189
  564   1HB   GLU  69          2HB       GLU  69 -25.974  -0.728  -1.665
  565   2HB   GLU  69          1HB       GLU  69 -26.762   0.848  -1.585
  566   1HG   GLU  69          2HG       GLU  69 -25.276   1.747  -3.021
  567   2HG   GLU  69          1HG       GLU  69 -23.914   1.125  -2.089
  568    H    GLU  70           H        GLU  70 -25.693   0.978   2.355
  569    HA   GLU  70           HA       GLU  70 -27.526   3.221   1.973
  570   1HB   GLU  70          2HB       GLU  70 -27.002   1.347   4.017
  571   2HB   GLU  70          1HB       GLU  70 -26.601   2.926   4.695
  572   1HG   GLU  70          2HG       GLU  70 -29.135   2.647   3.122
  573   2HG   GLU  70          1HG       GLU  70 -29.092   2.026   4.772
  574    HA   PRO  71           HA       PRO  71 -23.896   5.624   3.942
  575   1HB   PRO  71          2HB       PRO  71 -21.501   4.301   4.220
  576   2HB   PRO  71          1HB       PRO  71 -22.756   4.340   5.471
  577   1HG   PRO  71          2HG       PRO  71 -21.986   2.107   3.655
  578   2HG   PRO  71          1HG       PRO  71 -22.757   2.043   5.249
  579   1HD   PRO  71          2HD       PRO  71 -24.052   1.733   2.745
  580   2HD   PRO  71          1HD       PRO  71 -24.850   1.955   4.318
  581    H    GLY  72           H        GLY  72 -22.822   3.248   1.502
  582   1HA   GLY  72          2HA       GLY  72 -22.305   5.326  -0.437
  583   2HA   GLY  72          1HA       GLY  72 -20.793   4.723   0.250
  584    H    LYS  73           H        LYS  73 -20.134   3.742  -1.717
  585    HA   LYS  73           HA       LYS  73 -21.806   1.417  -2.582
  586   1HB   LYS  73          2HB       LYS  73 -19.849   3.132  -4.136
  587   2HB   LYS  73          1HB       LYS  73 -20.529   1.627  -4.755
  588   1HG   LYS  73          2HG       LYS  73 -22.185   2.963  -5.557
  589   2HG   LYS  73          1HG       LYS  73 -22.786   2.915  -3.899
  590   1HD   LYS  73          2HD       LYS  73 -21.549   4.964  -3.365
  591   2HD   LYS  73          1HD       LYS  73 -20.881   5.005  -4.997
  592   1HE   LYS  73          2HE       LYS  73 -22.808   5.817  -5.897
  593   2HE   LYS  73          1HE       LYS  73 -23.824   4.796  -4.880
  594   1HZ   LYS  73          1HZ       LYS  73 -24.252   6.645  -3.746
  595   2HZ   LYS  73          2HZ       LYS  73 -22.986   7.505  -4.485
  596   3HZ   LYS  73          3HZ       LYS  73 -22.676   6.531  -3.129
  597    H    GLY  74           H        GLY  74 -18.407   2.124  -3.313
  598   1HA   GLY  74          2HA       GLY  74 -17.624  -0.230  -1.656
  599   2HA   GLY  74          1HA       GLY  74 -17.110  -0.134  -3.340
  600    H    SER  75           H        SER  75 -15.475  -0.126  -0.848
  601    HA   SER  75           HA       SER  75 -13.952   2.360  -1.454
  602   1HB   SER  75          2HB       SER  75 -13.550   1.942   1.276
  603   2HB   SER  75          1HB       SER  75 -14.538   3.213   0.560
  604    HG   SER  75           HG       SER  75 -15.278   0.753   1.676
  605    H    PHE  76           H        PHE  76 -13.987  -0.877   0.001
  606    HA   PHE  76           HA       PHE  76 -11.089  -1.025   0.229
  607   1HB   PHE  76          2HB       PHE  76 -13.157  -2.470   1.295
  608   2HB   PHE  76          1HB       PHE  76 -12.595  -3.558   0.027
  609    HD1  PHE  76           HD1      PHE  76 -12.337  -3.372   3.303
  610    HD2  PHE  76           HD2      PHE  76  -9.705  -2.976  -0.070
  611    HE1  PHE  76           HE1      PHE  76 -10.414  -4.025   4.727
  612    HE2  PHE  76           HE2      PHE  76  -7.787  -3.629   1.359
  613    HZ   PHE  76           HZ       PHE  76  -8.140  -4.153   3.754
  614    H    TRP  77           H        TRP  77  -9.704  -1.436  -1.423
  615    HA   TRP  77           HA       TRP  77 -10.798  -2.837  -3.824
  616   1HB   TRP  77          2HB       TRP  77  -9.874  -1.290  -5.269
  617   2HB   TRP  77          1HB       TRP  77 -10.194  -0.231  -3.900
  618    HD1  TRP  77           HD1      TRP  77  -8.107   0.518  -2.406
  619    HE1  TRP  77           HE1      TRP  77  -5.586   0.599  -2.929
  620    HE3  TRP  77           HE3      TRP  77  -7.976  -2.461  -6.539
  621    HZ2  TRP  77           HZ2      TRP  77  -3.765  -0.450  -4.856
  622    HZ3  TRP  77           HZ3      TRP  77  -5.840  -2.906  -7.701
  623    HH2  TRP  77           HH2      TRP  77  -3.738  -1.896  -6.873
  624    H    ARG  78           H        ARG  78  -9.086  -4.023  -5.062
  625    HA   ARG  78           HA       ARG  78  -6.596  -4.577  -3.564
  626   1HB   ARG  78          2HB       ARG  78  -7.002  -6.969  -3.439
  627   2HB   ARG  78          1HB       ARG  78  -8.334  -6.129  -2.648
  628   1HG   ARG  78          2HG       ARG  78  -9.623  -6.281  -4.801
  629   2HG   ARG  78          1HG       ARG  78  -8.327  -7.291  -5.443
  630   1HD   ARG  78          2HD       ARG  78  -8.785  -8.571  -3.102
  631   2HD   ARG  78          1HD       ARG  78 -10.401  -7.938  -3.418
  632    HE   ARG  78           HE       ARG  78  -9.878  -9.044  -5.809
  633   1HH1  ARG  78          1HH2      ARG  78 -11.465 -10.603  -3.796
  634   2HH1  ARG  78          2HH2      ARG  78 -10.564 -12.079  -3.690
  635   1HH2  ARG  78          1HH1      ARG  78  -7.717 -10.764  -5.170
  636   2HH2  ARG  78          2HH1      ARG  78  -8.444 -12.170  -4.467
  637    H    ILE  79           H        ILE  79  -5.522  -6.601  -4.903
  638    HA   ILE  79           HA       ILE  79  -5.486  -5.612  -7.717
  639    HB   ILE  79           HB       ILE  79  -3.338  -6.586  -7.934
  640   1HG1  ILE  79          2HG1      ILE  79  -4.137  -8.211  -5.504
  641   2HG1  ILE  79          1HG1      ILE  79  -3.672  -8.800  -7.100
  642   1HG2  ILE  79          1HG2      ILE  79  -3.480  -4.611  -6.397
  643   2HG2  ILE  79          2HG2      ILE  79  -2.094  -5.657  -6.085
  644   3HG2  ILE  79          3HG2      ILE  79  -3.511  -5.733  -5.036
  645   1HD1  ILE  79          1HD1      ILE  79  -1.471  -7.305  -6.359
  646   2HD1  ILE  79          2HD1      ILE  79  -1.601  -9.057  -6.210
  647   3HD1  ILE  79          3HD1      ILE  79  -1.974  -8.024  -4.830
  648    H    ASP  80           H        ASP  80  -5.567  -7.218  -9.482
  649    HA   ASP  80           HA       ASP  80  -7.675  -9.100  -9.159
  650   1HB   ASP  80          2HB       ASP  80  -6.175  -8.118 -11.302
  651   2HB   ASP  80          1HB       ASP  80  -5.831  -9.848 -11.286
  652    HA   PRO  81           HA       PRO  81  -5.623 -12.486  -7.301
  653   1HB   PRO  81          2HB       PRO  81  -7.363 -14.474  -8.059
  654   2HB   PRO  81          1HB       PRO  81  -7.718 -13.283  -6.796
  655   1HG   PRO  81          2HG       PRO  81  -8.788 -13.446  -9.571
  656   2HG   PRO  81          1HG       PRO  81  -9.509 -12.705  -8.133
  657   1HD   PRO  81          2HD       PRO  81  -8.195 -11.334 -10.243
  658   2HD   PRO  81          1HD       PRO  81  -8.663 -10.642  -8.675
  659    H    ALA  82           H        ALA  82  -6.604 -13.004 -10.710
  660    HA   ALA  82           HA       ALA  82  -4.513 -15.074 -11.000
  661   1HB   ALA  82          1HB       ALA  82  -5.862 -14.169 -13.446
  662   2HB   ALA  82          2HB       ALA  82  -6.981 -14.704 -12.192
  663   3HB   ALA  82          3HB       ALA  82  -5.724 -15.794 -12.776
  664    H    SER  83           H        SER  83  -4.216 -11.916 -10.772
  665    HA   SER  83           HA       SER  83  -2.228 -11.786 -13.002
  666   1HB   SER  83          2HB       SER  83  -3.933  -9.584 -11.817
  667   2HB   SER  83          1HB       SER  83  -2.548  -9.270 -12.855
  668    HG   SER  83           HG       SER  83  -3.596 -10.601 -14.437
  669    H    GLU  84           H        GLU  84  -2.724 -11.878  -9.666
  670    HA   GLU  84           HA       GLU  84  -0.787 -10.062  -8.688
  671   1HB   GLU  84          2HB       GLU  84  -2.358 -11.275  -7.223
  672   2HB   GLU  84          1HB       GLU  84  -1.522 -12.787  -7.582
  673   1HG   GLU  84          2HG       GLU  84   0.340 -10.717  -6.733
  674   2HG   GLU  84          1HG       GLU  84  -0.903 -11.010  -5.515
  675    H    ALA  85           H        ALA  85  -0.363 -13.449  -9.769
  676    HA   ALA  85           HA       ALA  85   2.429 -13.559  -9.101
  677   1HB   ALA  85          1HB       ALA  85   2.528 -15.448 -10.687
  678   2HB   ALA  85          2HB       ALA  85   0.951 -14.996 -11.334
  679   3HB   ALA  85          3HB       ALA  85   1.091 -15.567  -9.670
  680    H    LYS  86           H        LYS  86   0.738 -11.939 -11.638
  681    HA   LYS  86           HA       LYS  86   3.146 -11.675 -13.324
  682   1HB   LYS  86          2HB       LYS  86   0.679 -11.881 -14.140
  683   2HB   LYS  86          1HB       LYS  86   0.573 -10.166 -13.737
  684   1HG   LYS  86          2HG       LYS  86   2.647  -9.814 -15.154
  685   2HG   LYS  86          1HG       LYS  86   2.462 -11.480 -15.703
  686   1HD   LYS  86          2HD       LYS  86   1.401  -9.852 -17.260
  687   2HD   LYS  86          1HD       LYS  86   0.233 -10.982 -16.575
  688   1HE   LYS  86          2HE       LYS  86   0.566  -8.635 -14.882
  689   2HE   LYS  86          1HE       LYS  86   0.062  -8.191 -16.514
  690   1HZ   LYS  86          1HZ       LYS  86  -1.948  -9.043 -16.183
  691   2HZ   LYS  86          2HZ       LYS  86  -1.559  -9.118 -14.530
  692   3HZ   LYS  86          3HZ       LYS  86  -1.335 -10.480 -15.521
  693    H    LEU  87           H        LEU  87   0.907  -9.396 -11.696
  694    HA   LEU  87           HA       LEU  87   2.410  -7.068 -12.062
  695   1HB   LEU  87          2HB       LEU  87   1.334  -6.441  -9.742
  696   2HB   LEU  87          1HB       LEU  87   0.325  -6.632 -11.153
  697    HG   LEU  87           HG       LEU  87   0.636  -9.202  -9.931
  698   1HD1  LEU  87          1HD1      LEU  87   1.008  -8.413  -7.788
  699   2HD1  LEU  87          2HD1      LEU  87  -0.754  -8.371  -7.835
  700   3HD1  LEU  87          3HD1      LEU  87   0.170  -6.891  -8.094
  701   1HD2  LEU  87          1HD2      LEU  87  -1.815  -9.033  -9.758
  702   2HD2  LEU  87          2HD2      LEU  87  -1.271  -8.425 -11.321
  703   3HD2  LEU  87          3HD2      LEU  87  -1.721  -7.297 -10.043
  704    H    VAL  88           H        VAL  88   2.430  -9.196  -9.234
  705    HA   VAL  88           HA       VAL  88   4.370  -8.025  -7.676
  706    HB   VAL  88           HB       VAL  88   5.038 -10.339  -7.082
  707   1HG1  VAL  88          1HG1      VAL  88   2.058  -9.911  -7.350
  708   2HG1  VAL  88          2HG1      VAL  88   3.058  -9.232  -6.066
  709   3HG1  VAL  88          3HG1      VAL  88   2.847 -10.979  -6.189
  710   1HG2  VAL  88          1HG2      VAL  88   4.935 -11.678  -8.950
  711   2HG2  VAL  88          2HG2      VAL  88   3.523 -10.835  -9.586
  712   3HG2  VAL  88          3HG2      VAL  88   3.335 -12.017  -8.293
  713    H    GLU  89           H        GLU  89   4.857  -9.729 -10.720
  714    HA   GLU  89           HA       GLU  89   7.630 -10.195 -10.601
  715   1HB   GLU  89          2HB       GLU  89   5.975  -9.293 -12.983
  716   2HB   GLU  89          1HB       GLU  89   7.607  -9.956 -13.085
  717   1HG   GLU  89          2HG       GLU  89   5.837 -11.636 -11.482
  718   2HG   GLU  89          1HG       GLU  89   5.250 -11.433 -13.133
  719    H    GLN  90           H        GLN  90   5.954  -7.262 -11.784
  720    HA   GLN  90           HA       GLN  90   8.430  -5.760 -11.992
  721   1HB   GLN  90          2HB       GLN  90   5.632  -4.623 -11.737
  722   2HB   GLN  90          1HB       GLN  90   7.035  -3.869 -12.494
  723   1HG   GLN  90          2HG       GLN  90   6.944  -6.121 -13.954
  724   2HG   GLN  90          1HG       GLN  90   5.235  -5.998 -13.541
  725   1HE2  GLN  90          1HE2      GLN  90   7.745  -4.689 -15.548
  726   2HE2  GLN  90          2HE2      GLN  90   6.824  -3.456 -16.261
  727    H    ALA  91           H        ALA  91   6.295  -6.621  -9.431
  728    HA   ALA  91           HA       ALA  91   6.698  -4.401  -7.684
  729   1HB   ALA  91          1HB       ALA  91   4.941  -6.000  -7.233
  730   2HB   ALA  91          2HB       ALA  91   6.062  -5.973  -5.871
  731   3HB   ALA  91          3HB       ALA  91   6.126  -7.291  -7.040
  732    H    PHE  92           H        PHE  92   8.348  -7.578  -7.743
  733    HA   PHE  92           HA       PHE  92  10.334  -6.772  -5.806
  734   1HB   PHE  92          2HB       PHE  92  10.595  -8.995  -7.847
  735   2HB   PHE  92          1HB       PHE  92  11.403  -8.871  -6.284
  736    HD1  PHE  92           HD1      PHE  92   8.956 -10.643  -7.864
  737    HD2  PHE  92           HD2      PHE  92   9.472  -8.243  -4.340
  738    HE1  PHE  92           HE1      PHE  92   7.055 -11.817  -6.788
  739    HE2  PHE  92           HE2      PHE  92   7.571  -9.416  -3.264
  740    HZ   PHE  92           HZ       PHE  92   6.362 -11.203  -4.487
  741    H    ARG  93           H        ARG  93  10.011  -6.415  -9.252
  742    HA   ARG  93           HA       ARG  93  12.806  -6.031  -9.849
  743   1HB   ARG  93          2HB       ARG  93  11.044  -6.490 -11.573
  744   2HB   ARG  93          1HB       ARG  93  10.405  -4.870 -11.296
  745   1HG   ARG  93          2HG       ARG  93  13.296  -4.872 -11.744
  746   2HG   ARG  93          1HG       ARG  93  12.398  -5.532 -13.112
  747   1HD   ARG  93          2HD       ARG  93  11.926  -2.846 -11.783
  748   2HD   ARG  93          1HD       ARG  93  12.615  -3.114 -13.383
  749    HE   ARG  93           HE       ARG  93  10.156  -4.375 -13.515
  750   1HH1  ARG  93          1HH1      ARG  93  10.326  -1.732 -11.543
  751   2HH1  ARG  93          2HH1      ARG  93   9.316  -0.699 -12.499
  752   1HH2  ARG  93          1HH2      ARG  93   9.257  -2.836 -15.226
  753   2HH2  ARG  93          2HH2      ARG  93   8.712  -1.324 -14.581
  754    H    LYS  94           H        LYS  94  13.886  -3.980 -10.211
  755    HA   LYS  94           HA       LYS  94  12.615  -1.696  -8.753
  756   1HB   LYS  94          2HB       LYS  94  15.573  -2.356  -8.800
  757   2HB   LYS  94          1HB       LYS  94  14.778  -1.107  -7.842
  758   1HG   LYS  94          2HG       LYS  94  14.771  -2.707  -6.218
  759   2HG   LYS  94          1HG       LYS  94  13.354  -3.302  -7.083
  760   1HD   LYS  94          2HD       LYS  94  14.432  -5.211  -7.581
  761   2HD   LYS  94          1HD       LYS  94  15.706  -4.296  -8.389
  762   1HE   LYS  94          2HE       LYS  94  17.126  -4.743  -6.707
  763   2HE   LYS  94          1HE       LYS  94  16.019  -3.999  -5.551
  764   1HZ   LYS  94          1HZ       LYS  94  14.932  -6.022  -5.191
  765   2HZ   LYS  94          2HZ       LYS  94  16.582  -6.424  -5.198
  766   3HZ   LYS  94          3HZ       LYS  94  15.619  -6.751  -6.560
  767    H    ARG  95           H        ARG  95  13.776   0.433  -9.378
  768    HA   ARG  95           HA       ARG  95  14.669   0.375 -12.220
  769   1HB   ARG  95          2HB       ARG  95  13.268   2.472 -12.568
  770   2HB   ARG  95          1HB       ARG  95  12.349   0.977 -12.396
  771   1HG   ARG  95          2HG       ARG  95  11.187   2.240 -10.872
  772   2HG   ARG  95          1HG       ARG  95  12.477   1.690  -9.805
  773   1HD   ARG  95          2HD       ARG  95  12.235   4.102  -9.571
  774   2HD   ARG  95          1HD       ARG  95  13.769   3.754 -10.368
  775    HE   ARG  95           HE       ARG  95  11.821   4.128 -12.396
  776   1HH1  ARG  95          1HH2      ARG  95  10.981   6.270 -10.430
  777   2HH1  ARG  95          2HH2      ARG  95  11.929   7.619 -10.962
  778   1HH2  ARG  95          1HH1      ARG  95  14.101   5.684 -12.851
  779   2HH2  ARG  95          2HH1      ARG  95  13.698   7.286 -12.332
  780    H    ARG  96           H        ARG  96  15.600   2.623 -12.801
  781    HA   ARG  96           HA       ARG  96  16.437   4.403 -10.711
  782   1HB   ARG  96          2HB       ARG  96  17.870   2.651  -9.931
  783   2HB   ARG  96          1HB       ARG  96  18.385   2.250 -11.569
  784   1HG   ARG  96          2HG       ARG  96  19.508   4.415 -11.779
  785   2HG   ARG  96          1HG       ARG  96  18.938   4.888 -10.178
  786   1HD   ARG  96          2HD       ARG  96  20.811   3.969  -9.331
  787   2HD   ARG  96          1HD       ARG  96  20.171   2.395  -9.801
  788    HE   ARG  96           HE       ARG  96  22.307   3.843 -11.153
  789   1HH1  ARG  96          1HH2      ARG  96  21.259   0.812 -10.768
  790   2HH1  ARG  96          2HH2      ARG  96  21.260   0.346 -12.437
  791   1HH2  ARG  96          1HH1      ARG  96  21.653   3.581 -13.619
  792   2HH2  ARG  96          2HH1      ARG  96  21.482   1.912 -14.049
  793    H    GLN  97           H        GLN  97  16.992   6.286 -11.707
  794    HA   GLN  97           HA       GLN  97  17.267   6.277 -14.637
  795   1HB   GLN  97          2HB       GLN  97  16.830   8.358 -12.535
  796   2HB   GLN  97          1HB       GLN  97  17.583   8.864 -14.046
  797   1HG   GLN  97          2HG       GLN  97  15.700   7.770 -15.286
  798   2HG   GLN  97          1HG       GLN  97  14.920   7.456 -13.735
  799   1HE2  GLN  97          1HE2      GLN  97  14.973   9.665 -12.288
  800   2HE2  GLN  97          2HE2      GLN  97  14.410  11.034 -13.119
  801    H    ARG  98           H        ARG  98  19.060   8.579 -12.709
  802    HA   ARG  98           HA       ARG  98  21.611   7.216 -13.392
  803   1HB   ARG  98          2HB       ARG  98  22.530   9.387 -14.223
  804   2HB   ARG  98          1HB       ARG  98  21.225   8.770 -15.237
  805   1HG   ARG  98          2HG       ARG  98  19.867  10.518 -14.745
  806   2HG   ARG  98          1HG       ARG  98  20.280  10.464 -13.030
  807   1HD   ARG  98          2HD       ARG  98  21.042  12.576 -14.052
  808   2HD   ARG  98          1HD       ARG  98  22.412  11.612 -13.505
  809    HE   ARG  98           HE       ARG  98  21.607  11.991 -16.346
  810   1HH1  ARG  98          1HH2      ARG  98  24.236  12.648 -14.698
  811   2HH1  ARG  98          2HH2      ARG  98  25.313  11.515 -15.447
  812   1HH2  ARG  98          1HH1      ARG  98  22.777   9.721 -16.990
  813   2HH2  ARG  98          2HH1      ARG  98  24.487   9.858 -16.743
  814    H    GLY  99           H        GLY  99  20.313   7.465 -10.862
  815   1HA   GLY  99          2HA       GLY  99  22.275   9.240  -9.474
  816   2HA   GLY  99          1HA       GLY  99  20.584   9.206  -8.974
  817    H    VAL 100           H        VAL 100  23.221   8.318  -7.653
  818    HA   VAL 100           HA       VAL 100  22.690   5.431  -7.261
  819    HB   VAL 100           HB       VAL 100  24.769   5.454  -5.949
  820   1HG1  VAL 100          1HG1      VAL 100  25.033   5.213  -8.345
  821   2HG1  VAL 100          2HG1      VAL 100  26.305   6.289  -7.766
  822   3HG1  VAL 100          3HG1      VAL 100  24.891   6.955  -8.581
  823   1HG2  VAL 100          1HG2      VAL 100  25.382   8.274  -6.602
  824   2HG2  VAL 100          2HG2      VAL 100  25.722   7.359  -5.131
  825   3HG2  VAL 100          3HG2      VAL 100  24.121   8.052  -5.388
  826    H    SER 101           HN       SER 101  22.804   4.697  -4.866
  827    HA   SER 101           HA       SER 101  20.676   6.060  -3.429
  828   1HB   SER 101          2HB       SER 101  20.868   4.281  -1.826
  829   2HB   SER 101          1HB       SER 101  21.111   3.556  -3.413
  830    HG   SER 101           HG       SER 101  22.688   3.250  -1.471
  Start of MODEL   17
    1   1H    GLU   1          1HT       GLU   1   9.066  19.338  -6.327
    2   2H    GLU   1          2HT       GLU   1   8.656  18.445  -4.941
    3   3H    GLU   1          3HT       GLU   1   7.724  18.301  -6.354
    4    HA   GLU   1           HA       GLU   1   9.229  16.985  -7.416
    5   1HB   GLU   1          2HB       GLU   1  11.665  16.950  -6.627
    6   2HB   GLU   1          1HB       GLU   1  11.120  18.446  -7.388
    7   1HG   GLU   1          2HG       GLU   1  10.582  18.446  -4.526
    8   2HG   GLU   1          1HG       GLU   1  12.297  18.213  -4.865
    9    H    SER   2           H        SER   2   9.650  14.803  -6.888
   10    HA   SER   2           HA       SER   2   9.692  14.096  -3.998
   11   1HB   SER   2          2HB       SER   2   7.892  12.664  -5.960
   12   2HB   SER   2          1HB       SER   2   7.910  12.525  -4.204
   13    HG   SER   2           HG       SER   2   6.557  14.239  -5.748
   14    H    LYS   3           H        LYS   3   9.910  11.486  -3.980
   15    HA   LYS   3           HA       LYS   3  11.895  10.749  -6.092
   16   1HB   LYS   3          2HB       LYS   3  12.219   9.753  -3.278
   17   2HB   LYS   3          1HB       LYS   3  13.440   9.966  -4.530
   18   1HG   LYS   3          2HG       LYS   3  12.225  12.512  -3.897
   19   2HG   LYS   3          1HG       LYS   3  12.822  11.742  -2.431
   20   1HD   LYS   3          2HD       LYS   3  14.756  11.364  -4.514
   21   2HD   LYS   3          1HD       LYS   3  14.338  13.075  -4.432
   22   1HE   LYS   3          2HE       LYS   3  15.575  13.298  -2.569
   23   2HE   LYS   3          1HE       LYS   3  14.576  12.092  -1.757
   24   1HZ   LYS   3          1HZ       LYS   3  17.214  11.829  -2.508
   25   2HZ   LYS   3          2HZ       LYS   3  16.344  10.863  -3.603
   26   3HZ   LYS   3          3HZ       LYS   3  16.192  10.605  -1.930
   27    HA   PRO   4           HA       PRO   4   8.722   7.500  -5.867
   28   1HB   PRO   4          2HB       PRO   4   8.698   7.075  -8.582
   29   2HB   PRO   4          1HB       PRO   4   7.720   8.312  -7.774
   30   1HG   PRO   4          2HG       PRO   4  10.181   8.649  -9.422
   31   2HG   PRO   4          1HG       PRO   4   8.866   9.797  -9.122
   32   1HD   PRO   4          2HD       PRO   4  11.413   9.813  -7.874
   33   2HD   PRO   4          1HD       PRO   4   9.994  10.758  -7.374
   34    HA   PRO   5           HA       PRO   5  12.205   4.610  -6.154
   35   1HB   PRO   5          2HB       PRO   5  11.157   2.851  -4.324
   36   2HB   PRO   5          1HB       PRO   5  12.066   4.301  -3.866
   37   1HG   PRO   5          2HG       PRO   5   9.132   3.799  -3.704
   38   2HG   PRO   5          1HG       PRO   5  10.136   4.899  -2.744
   39   1HD   PRO   5          2HD       PRO   5   8.456   5.631  -4.910
   40   2HD   PRO   5          1HD       PRO   5   9.682   6.655  -4.138
   41    H    TYR   6           H        TYR   6   8.913   3.316  -5.624
   42    HA   TYR   6           HA       TYR   6   9.340   1.462  -7.915
   43   1HB   TYR   6          2HB       TYR   6   7.189   1.342  -5.799
   44   2HB   TYR   6          1HB       TYR   6   7.586   0.093  -6.976
   45    HD1  TYR   6           HD1      TYR   6  10.248  -0.509  -6.961
   46    HD2  TYR   6           HD2      TYR   6   7.973   1.015  -3.657
   47    HE1  TYR   6           HE1      TYR   6  11.910  -1.452  -5.376
   48    HE2  TYR   6           HE2      TYR   6   9.627   0.073  -2.073
   49    HH   TYR   6           HH       TYR   6  11.640  -2.219  -2.671
   50    H    SER   7           H        SER   7   7.866   1.483  -9.647
   51    HA   SER   7           HA       SER   7   6.648   3.890 -10.391
   52   1HB   SER   7          2HB       SER   7   6.173   1.021 -11.113
   53   2HB   SER   7          1HB       SER   7   4.986   2.213 -11.638
   54    HG   SER   7           HG       SER   7   6.570   2.054 -13.205
   55    H    TYR   8           H        TYR   8   4.152   4.269 -10.485
   56    HA   TYR   8           HA       TYR   8   3.162   3.765  -7.759
   57   1HB   TYR   8          2HB       TYR   8   2.045   5.440 -10.021
   58   2HB   TYR   8          1HB       TYR   8   1.320   5.315  -8.412
   59    HD1  TYR   8           HD1      TYR   8   2.882   7.678 -10.067
   60    HD2  TYR   8           HD2      TYR   8   3.749   5.137  -6.713
   61    HE1  TYR   8           HE1      TYR   8   4.494   9.354  -9.203
   62    HE2  TYR   8           HE2      TYR   8   5.355   6.809  -5.853
   63    HH   TYR   8           HH       TYR   8   5.441   9.740  -6.434
   64    H    ALA   9           H        ALA   9   3.188   1.942 -10.398
   65    HA   ALA   9           HA       ALA   9   0.446   0.853  -9.900
   66   1HB   ALA   9          1HB       ALA   9   0.270   0.248 -12.123
   67   2HB   ALA   9          2HB       ALA   9   2.013   0.058 -12.317
   68   3HB   ALA   9          3HB       ALA   9   1.297   1.669 -12.301
   69    H    GLN  10           H        GLN  10   3.876   0.252 -10.107
   70    HA   GLN  10           HA       GLN  10   3.589  -2.637  -9.509
   71   1HB   GLN  10          2HB       GLN  10   5.391  -1.840 -11.049
   72   2HB   GLN  10          1HB       GLN  10   6.062  -0.878  -9.733
   73   1HG   GLN  10          2HG       GLN  10   5.680  -3.513  -8.742
   74   2HG   GLN  10          1HG       GLN  10   6.487  -3.653 -10.304
   75   1HE2  GLN  10          1HE2      GLN  10   6.855  -2.489  -6.998
   76   2HE2  GLN  10          2HE2      GLN  10   8.492  -2.061  -7.135
   77    H    LEU  11           H        LEU  11   4.437   0.427  -8.074
   78    HA   LEU  11           HA       LEU  11   5.433  -0.402  -5.545
   79   1HB   LEU  11          2HB       LEU  11   5.526   1.927  -6.228
   80   2HB   LEU  11          1HB       LEU  11   3.779   1.988  -6.414
   81    HG   LEU  11           HG       LEU  11   3.925   1.228  -3.825
   82   1HD1  LEU  11          1HD1      LEU  11   6.186   1.314  -3.343
   83   2HD1  LEU  11          2HD1      LEU  11   5.762   2.997  -3.031
   84   3HD1  LEU  11          3HD1      LEU  11   6.505   2.545  -4.564
   85   1HD2  LEU  11          1HD2      LEU  11   2.900   3.284  -5.101
   86   2HD2  LEU  11          2HD2      LEU  11   4.337   4.121  -4.514
   87   3HD2  LEU  11          3HD2      LEU  11   3.203   3.405  -3.368
   88    H    ILE  12           H        ILE  12   2.210  -0.057  -6.868
   89    HA   ILE  12           HA       ILE  12   0.722  -0.558  -4.429
   90    HB   ILE  12           HB       ILE  12  -0.299  -1.387  -7.097
   91   1HG1  ILE  12          2HG1      ILE  12   0.365   0.621  -7.999
   92   2HG1  ILE  12          1HG1      ILE  12  -1.065   1.200  -7.162
   93   1HG2  ILE  12          1HG2      ILE  12  -1.844   0.359  -5.328
   94   2HG2  ILE  12          2HG2      ILE  12  -1.401  -1.202  -4.643
   95   3HG2  ILE  12          3HG2      ILE  12  -2.317  -1.126  -6.150
   96   1HD1  ILE  12          1HD1      ILE  12   0.890   1.329  -5.199
   97   2HD1  ILE  12          2HD1      ILE  12   0.337   2.683  -6.178
   98   3HD1  ILE  12          3HD1      ILE  12   1.766   1.777  -6.657
   99    H    VAL  13           H        VAL  13   1.684  -2.559  -7.197
  100    HA   VAL  13           HA       VAL  13   0.541  -4.981  -6.446
  101    HB   VAL  13           HB       VAL  13   3.250  -4.509  -7.711
  102   1HG1  VAL  13          1HG1      VAL  13   3.179  -6.783  -6.951
  103   2HG1  VAL  13          2HG1      VAL  13   2.781  -6.822  -8.668
  104   3HG1  VAL  13          3HG1      VAL  13   1.503  -6.967  -7.464
  105   1HG2  VAL  13          1HG2      VAL  13   1.993  -4.812  -9.809
  106   2HG2  VAL  13          2HG2      VAL  13   1.332  -3.472  -8.878
  107   3HG2  VAL  13          3HG2      VAL  13   0.502  -5.026  -8.891
  108    H    GLN  14           H        GLN  14   3.341  -3.365  -5.063
  109    HA   GLN  14           HA       GLN  14   4.212  -5.708  -3.559
  110   1HB   GLN  14          2HB       GLN  14   5.065  -2.937  -3.896
  111   2HB   GLN  14          1HB       GLN  14   5.136  -3.444  -2.208
  112   1HG   GLN  14          2HG       GLN  14   6.671  -5.149  -2.644
  113   2HG   GLN  14          1HG       GLN  14   6.211  -5.263  -4.342
  114   1HE2  GLN  14          1HE2      GLN  14   6.646  -2.042  -3.080
  115   2HE2  GLN  14          2HE2      GLN  14   8.151  -1.749  -3.801
  116    H    ALA  15           H        ALA  15   2.139  -2.916  -3.009
  117    HA   ALA  15           HA       ALA  15   1.711  -3.190  -0.224
  118   1HB   ALA  15          1HB       ALA  15   0.634  -1.639  -2.329
  119   2HB   ALA  15          2HB       ALA  15   0.339  -1.440  -0.602
  120   3HB   ALA  15          3HB       ALA  15  -0.738  -2.446  -1.569
  121    H    ILE  16           H        ILE  16  -0.403  -4.447  -2.875
  122    HA   ILE  16           HA       ILE  16  -1.727  -6.207  -0.891
  123    HB   ILE  16           HB       ILE  16  -2.909  -7.033  -3.001
  124   1HG1  ILE  16          2HG1      ILE  16  -2.809  -5.720  -4.933
  125   2HG1  ILE  16          1HG1      ILE  16  -1.867  -4.470  -4.149
  126   1HG2  ILE  16          1HG2      ILE  16  -4.485  -5.292  -2.770
  127   2HG2  ILE  16          2HG2      ILE  16  -3.229  -4.076  -2.532
  128   3HG2  ILE  16          3HG2      ILE  16  -3.600  -5.223  -1.247
  129   1HD1  ILE  16          1HD1      ILE  16  -0.694  -6.141  -5.772
  130   2HD1  ILE  16          2HD1      ILE  16  -0.780  -7.257  -4.418
  131   3HD1  ILE  16          3HD1      ILE  16   0.090  -5.732  -4.254
  132    H    SER  17           H        SER  17   0.972  -6.481  -2.926
  133    HA   SER  17           HA       SER  17   0.840  -9.241  -3.647
  134   1HB   SER  17          2HB       SER  17   3.058  -7.272  -3.281
  135   2HB   SER  17          1HB       SER  17   3.487  -8.978  -3.231
  136    HG   SER  17           HG       SER  17   1.757  -8.166  -5.250
  137    H    SER  18           H        SER  18   1.148  -7.646  -0.647
  138    HA   SER  18           HA       SER  18   2.482  -9.836   0.749
  139   1HB   SER  18          2HB       SER  18   2.721  -7.539   1.572
  140   2HB   SER  18          1HB       SER  18   0.977  -7.411   1.781
  141    HG   SER  18           HG       SER  18   2.360  -9.529   2.992
  142    H    ALA  19           H        ALA  19  -0.831  -8.857   0.042
  143    HA   ALA  19           HA       ALA  19  -1.740 -11.182   1.710
  144   1HB   ALA  19          1HB       ALA  19  -2.661  -8.441   1.464
  145   2HB   ALA  19          2HB       ALA  19  -3.110  -9.659   2.657
  146   3HB   ALA  19          3HB       ALA  19  -3.962  -9.580   1.113
  147    H    GLN  20           H        GLN  20  -2.988 -12.770   0.686
  148    HA   GLN  20           HA       GLN  20  -2.799 -13.333  -2.011
  149   1HB   GLN  20          2HB       GLN  20  -5.227 -14.390  -1.612
  150   2HB   GLN  20          1HB       GLN  20  -3.783 -15.089  -0.882
  151   1HG   GLN  20          2HG       GLN  20  -4.382 -14.452   1.221
  152   2HG   GLN  20          1HG       GLN  20  -5.016 -12.900   0.673
  153   1HE2  GLN  20          1HE2      GLN  20  -6.365 -14.783   2.521
  154   2HE2  GLN  20          2HE2      GLN  20  -7.821 -15.226   1.772
  155    H    ASP  21           H        ASP  21  -6.147 -12.689  -1.230
  156    HA   ASP  21           HA       ASP  21  -6.315 -10.913  -3.593
  157   1HB   ASP  21          2HB       ASP  21  -8.551 -11.746  -1.720
  158   2HB   ASP  21          1HB       ASP  21  -8.710 -11.088  -3.350
  159    H    ARG  22           H        ARG  22  -4.780  -9.734  -1.771
  160    HA   ARG  22           HA       ARG  22  -5.989  -8.294   0.315
  161   1HB   ARG  22          2HB       ARG  22  -3.492  -8.532  -0.325
  162   2HB   ARG  22          1HB       ARG  22  -3.785  -7.173  -1.374
  163   1HG   ARG  22          2HG       ARG  22  -2.918  -6.634   0.989
  164   2HG   ARG  22          1HG       ARG  22  -4.303  -5.724   0.408
  165   1HD   ARG  22          2HD       ARG  22  -5.721  -6.643   1.932
  166   2HD   ARG  22          1HD       ARG  22  -4.968  -8.230   1.828
  167    HE   ARG  22           HE       ARG  22  -3.063  -7.067   3.204
  168   1HH1  ARG  22          1HH1      ARG  22  -5.935  -7.957   4.322
  169   2HH1  ARG  22          2HH1      ARG  22  -6.124  -6.728   5.529
  170   1HH2  ARG  22          1HH2      ARG  22  -3.512  -4.786   4.342
  171   2HH2  ARG  22          2HH2      ARG  22  -4.753  -4.934   5.540
  172    H    GLN  23           H        GLN  23  -7.249  -6.572   0.388
  173    HA   GLN  23           HA       GLN  23  -7.579  -4.917  -2.053
  174   1HB   GLN  23          2HB       GLN  23  -9.940  -4.749  -0.457
  175   2HB   GLN  23          1HB       GLN  23  -9.785  -5.430  -2.071
  176   1HG   GLN  23          2HG       GLN  23  -9.227  -7.613  -1.162
  177   2HG   GLN  23          1HG       GLN  23  -9.203  -6.962   0.476
  178   1HE2  GLN  23          1HE2      GLN  23 -11.095  -7.416   1.590
  179   2HE2  GLN  23          2HE2      GLN  23 -12.633  -7.560   0.888
  180    H    LEU  24           H        LEU  24  -5.919  -3.609  -1.050
  181    HA   LEU  24           HA       LEU  24  -6.386  -2.456   1.584
  182   1HB   LEU  24          2HB       LEU  24  -4.461  -1.437  -0.518
  183   2HB   LEU  24          1HB       LEU  24  -4.348  -1.265   1.233
  184    HG   LEU  24           HG       LEU  24  -4.393  -4.007  -0.012
  185   1HD1  LEU  24          1HD1      LEU  24  -2.525  -2.188  -0.810
  186   2HD1  LEU  24          2HD1      LEU  24  -2.209  -3.918  -0.671
  187   3HD1  LEU  24          3HD1      LEU  24  -1.755  -2.830   0.641
  188   1HD2  LEU  24          1HD2      LEU  24  -3.349  -2.766   2.546
  189   2HD2  LEU  24          2HD2      LEU  24  -2.948  -4.410   2.052
  190   3HD2  LEU  24          3HD2      LEU  24  -4.626  -3.970   2.376
  191    H    THR  25           H        THR  25  -6.995  -0.306   2.018
  192    HA   THR  25           HA       THR  25  -8.739   0.894   0.002
  193    HB   THR  25           HB       THR  25  -8.100   2.591   2.294
  194    HG1  THR  25           HG1      THR  25  -7.948   1.044   3.693
  195   1HG2  THR  25          1HG2      THR  25 -10.391   2.894   2.319
  196   2HG2  THR  25          2HG2      THR  25 -10.723   1.216   1.890
  197   3HG2  THR  25          3HG2      THR  25 -10.180   2.351   0.654
  198    H    LEU  26           H        LEU  26  -8.338   3.501  -0.102
  199    HA   LEU  26           HA       LEU  26  -5.906   3.789  -1.587
  200   1HB   LEU  26          2HB       LEU  26  -7.839   5.811  -0.433
  201   2HB   LEU  26          1HB       LEU  26  -6.431   6.282  -1.385
  202    HG   LEU  26           HG       LEU  26  -7.239   4.802  -3.235
  203   1HD1  LEU  26          1HD1      LEU  26  -9.517   4.432  -1.291
  204   2HD1  LEU  26          2HD1      LEU  26  -8.568   3.193  -2.113
  205   3HD1  LEU  26          3HD1      LEU  26  -9.722   4.171  -3.022
  206   1HD2  LEU  26          1HD2      LEU  26  -7.780   7.182  -3.308
  207   2HD2  LEU  26          2HD2      LEU  26  -9.154   6.935  -2.230
  208   3HD2  LEU  26          3HD2      LEU  26  -9.183   6.266  -3.860
  209    H    SER  27           H        SER  27  -6.791   4.510   1.759
  210    HA   SER  27           HA       SER  27  -4.146   5.671   2.320
  211   1HB   SER  27          2HB       SER  27  -6.445   5.001   4.176
  212   2HB   SER  27          1HB       SER  27  -5.008   5.922   4.615
  213    HG   SER  27           HG       SER  27  -5.795   7.160   2.561
  214    H    GLY  28           H        GLY  28  -4.639   2.686   1.563
  215   1HA   GLY  28          2HA       GLY  28  -3.455   1.451   4.017
  216   2HA   GLY  28          1HA       GLY  28  -4.165   0.551   2.670
  217    H    ILE  29           H        ILE  29  -3.086   1.516   0.529
  218    HA   ILE  29           HA       ILE  29  -0.521   0.454   0.241
  219    HB   ILE  29           HB       ILE  29  -2.199   1.050  -1.512
  220   1HG1  ILE  29          2HG1      ILE  29   0.632   2.053  -1.820
  221   2HG1  ILE  29          1HG1      ILE  29   0.050   0.421  -2.164
  222   1HG2  ILE  29          1HG2      ILE  29  -2.819   3.165  -1.870
  223   2HG2  ILE  29          2HG2      ILE  29  -1.143   3.717  -1.912
  224   3HG2  ILE  29          3HG2      ILE  29  -1.986   3.562  -0.370
  225   1HD1  ILE  29          1HD1      ILE  29  -0.638   1.034  -4.195
  226   2HD1  ILE  29          2HD1      ILE  29   0.120   2.599  -3.928
  227   3HD1  ILE  29          3HD1      ILE  29  -1.582   2.363  -3.527
  228    H    TYR  30           H        TYR  30  -1.588   3.454   1.456
  229    HA   TYR  30           HA       TYR  30   0.941   4.828   1.095
  230   1HB   TYR  30          2HB       TYR  30  -1.363   5.491   2.941
  231   2HB   TYR  30          1HB       TYR  30  -0.072   6.586   2.443
  232    HD1  TYR  30           HD1      TYR  30  -0.065   5.075  -0.432
  233    HD2  TYR  30           HD2      TYR  30  -2.986   7.154   1.933
  234    HE1  TYR  30           HE1      TYR  30  -1.347   5.588  -2.481
  235    HE2  TYR  30           HE2      TYR  30  -4.272   7.671  -0.121
  236    HH   TYR  30           HH       TYR  30  -4.014   7.826  -2.468
  237    H    ALA  31           H        ALA  31  -0.718   3.183   3.742
  238    HA   ALA  31           HA       ALA  31   1.394   3.555   5.671
  239   1HB   ALA  31          1HB       ALA  31   0.033   1.069   6.114
  240   2HB   ALA  31          2HB       ALA  31  -1.155   2.259   5.580
  241   3HB   ALA  31          3HB       ALA  31  -0.156   2.584   6.997
  242    H    HIS  32           H        HIS  32   0.942   1.539   2.905
  243    HA   HIS  32           HA       HIS  32   2.648  -0.660   3.540
  244   1HB   HIS  32          2HB       HIS  32   1.342  -0.985   1.619
  245   2HB   HIS  32          1HB       HIS  32   1.619   0.642   1.049
  246    HD1  HIS  32           HD1      HIS  32   2.115  -0.795  -1.237
  247    HD2  HIS  32           HD2      HIS  32   5.066  -0.889   1.698
  248    HE1  HIS  32           HE1      HIS  32   4.215  -1.641  -2.357
  249    H    ILE  33           H        ILE  33   3.573   1.580   1.003
  250    HA   ILE  33           HA       ILE  33   6.346   1.266   1.333
  251    HB   ILE  33           HB       ILE  33   4.820   2.399  -0.513
  252   1HG1  ILE  33          2HG1      ILE  33   7.658   2.349   0.119
  253   2HG1  ILE  33          1HG1      ILE  33   6.862   2.124  -1.431
  254   1HG2  ILE  33          1HG2      ILE  33   4.269   4.306   1.026
  255   2HG2  ILE  33          2HG2      ILE  33   4.936   4.795  -0.532
  256   3HG2  ILE  33          3HG2      ILE  33   5.955   4.810   0.908
  257   1HD1  ILE  33          1HD1      ILE  33   6.607   4.685  -1.483
  258   2HD1  ILE  33          2HD1      ILE  33   8.230   4.038  -1.731
  259   3HD1  ILE  33          3HD1      ILE  33   7.776   4.707  -0.162
  260    H    THR  34           H        THR  34   4.187   3.609   2.907
  261    HA   THR  34           HA       THR  34   6.190   5.327   3.963
  262    HB   THR  34           HB       THR  34   4.534   5.809   5.785
  263    HG1  THR  34           HG1      THR  34   3.607   3.827   6.055
  264   1HG2  THR  34          1HG2      THR  34   3.746   5.761   2.884
  265   2HG2  THR  34          2HG2      THR  34   4.199   7.138   3.889
  266   3HG2  THR  34          3HG2      THR  34   2.623   6.375   4.097
  267    H    LYS  35           H        LYS  35   5.133   2.140   4.964
  268    HA   LYS  35           HA       LYS  35   6.557   2.202   7.507
  269   1HB   LYS  35          2HB       LYS  35   4.533   0.693   6.699
  270   2HB   LYS  35          1HB       LYS  35   5.828  -0.357   6.126
  271   1HG   LYS  35          2HG       LYS  35   6.702   0.314   8.653
  272   2HG   LYS  35          1HG       LYS  35   4.955   0.202   8.877
  273   1HD   LYS  35          2HD       LYS  35   5.587  -2.016   9.200
  274   2HD   LYS  35          1HD       LYS  35   5.216  -2.016   7.476
  275   1HE   LYS  35          2HE       LYS  35   7.657  -1.529   7.040
  276   2HE   LYS  35          1HE       LYS  35   7.952  -1.796   8.757
  277   1HZ   LYS  35          1HZ       LYS  35   7.565  -3.701   6.683
  278   2HZ   LYS  35          2HZ       LYS  35   6.442  -3.938   7.935
  279   3HZ   LYS  35          3HZ       LYS  35   8.106  -3.940   8.272
  280    H    HIS  36           H        HIS  36   7.095   0.429   4.430
  281    HA   HIS  36           HA       HIS  36   9.752  -0.428   5.201
  282   1HB   HIS  36          2HB       HIS  36   8.239  -0.374   2.587
  283   2HB   HIS  36          1HB       HIS  36   9.923  -0.892   2.666
  284    HD1  HIS  36           HD1      HIS  36  10.445  -3.048   4.088
  285    HD2  HIS  36           HD2      HIS  36   6.384  -2.220   3.639
  286    HE1  HIS  36           HE1      HIS  36   9.206  -5.141   4.794
  287    H    TYR  37           H        TYR  37   8.763   1.810   2.586
  288    HA   TYR  37           HA       TYR  37  11.416   3.020   2.530
  289   1HB   TYR  37          2HB       TYR  37   8.853   3.394   1.030
  290   2HB   TYR  37          1HB       TYR  37   9.992   4.741   1.052
  291    HD1  TYR  37           HD1      TYR  37  11.558   4.797  -0.661
  292    HD2  TYR  37           HD2      TYR  37  10.058   1.013   0.697
  293    HE1  TYR  37           HE1      TYR  37  12.934   3.639  -2.366
  294    HE2  TYR  37           HE2      TYR  37  11.429  -0.148  -1.007
  295    HH   TYR  37           HH       TYR  37  12.597   1.120  -3.599
  296    HA   PRO  38           HA       PRO  38  10.234   5.747   5.883
  297   1HB   PRO  38          2HB       PRO  38  12.759   6.774   6.244
  298   2HB   PRO  38          1HB       PRO  38  12.225   5.218   6.903
  299   1HG   PRO  38          2HG       PRO  38  14.016   5.757   4.581
  300   2HG   PRO  38          1HG       PRO  38  13.958   4.346   5.649
  301   1HD   PRO  38          2HD       PRO  38  12.880   4.482   3.042
  302   2HD   PRO  38          1HD       PRO  38  12.526   3.228   4.249
  303    H    TYR  39           H        TYR  39  12.001   6.710   2.961
  304    HA   TYR  39           HA       TYR  39  11.894   9.530   3.337
  305   1HB   TYR  39          2HB       TYR  39  13.222   8.634   1.527
  306   2HB   TYR  39          1HB       TYR  39  11.802   7.882   0.794
  307    HD1  TYR  39           HD1      TYR  39  10.755   9.018  -0.952
  308    HD2  TYR  39           HD2      TYR  39  12.921  11.257   2.005
  309    HE1  TYR  39           HE1      TYR  39  10.272  11.116  -2.184
  310    HE2  TYR  39           HE2      TYR  39  12.439  13.355   0.773
  311    HH   TYR  39           HH       TYR  39  10.258  13.399  -1.988
  312    H    TYR  40           H        TYR  40   9.559   7.315   1.796
  313    HA   TYR  40           HA       TYR  40   7.662   9.404   1.182
  314   1HB   TYR  40          2HB       TYR  40   7.688   6.427   1.150
  315   2HB   TYR  40          1HB       TYR  40   6.108   7.208   1.234
  316    HD1  TYR  40           HD1      TYR  40   5.463   6.509  -1.028
  317    HD2  TYR  40           HD2      TYR  40   8.993   8.860  -0.343
  318    HE1  TYR  40           HE1      TYR  40   5.588   7.029  -3.449
  319    HE2  TYR  40           HE2      TYR  40   9.115   9.380  -2.765
  320    HH   TYR  40           HH       TYR  40   8.060   9.238  -4.726
  321    H    ARG  41           H        ARG  41   7.204  10.613   3.054
  322    HA   ARG  41           HA       ARG  41   5.192   9.564   4.819
  323   1HB   ARG  41          2HB       ARG  41   7.013   8.396   5.908
  324   2HB   ARG  41          1HB       ARG  41   7.996   9.860   5.934
  325   1HG   ARG  41          2HG       ARG  41   5.407  10.332   7.160
  326   2HG   ARG  41          1HG       ARG  41   6.241   8.989   7.945
  327   1HD   ARG  41          2HD       ARG  41   8.034  11.224   7.357
  328   2HD   ARG  41          1HD       ARG  41   6.708  11.686   8.425
  329    HE   ARG  41           HE       ARG  41   8.895   9.862   9.091
  330   1HH1  ARG  41          1HH1      ARG  41   6.973  11.926  10.616
  331   2HH1  ARG  41          2HH1      ARG  41   6.361  10.851  11.828
  332   1HH2  ARG  41          1HH2      ARG  41   7.542   7.989  10.267
  333   2HH2  ARG  41          2HH2      ARG  41   6.683   8.623  11.631
  334    H    THR  42           H        THR  42   7.888  11.920   4.802
  335    HA   THR  42           HA       THR  42   6.053  13.992   5.855
  336    HB   THR  42           HB       THR  42   8.295  15.360   5.615
  337    HG1  THR  42           HG1      THR  42   9.721  14.123   4.685
  338   1HG2  THR  42          1HG2      THR  42   7.519  14.957   7.790
  339   2HG2  THR  42          2HG2      THR  42   9.090  14.156   7.786
  340   3HG2  THR  42          3HG2      THR  42   7.616  13.207   7.602
  341    H    ALA  43           H        ALA  43   6.566  12.746   2.898
  342    HA   ALA  43           HA       ALA  43   5.930  15.333   1.586
  343   1HB   ALA  43          1HB       ALA  43   7.751  13.554   0.062
  344   2HB   ALA  43          2HB       ALA  43   8.475  14.394   1.435
  345   3HB   ALA  43          3HB       ALA  43   7.705  15.316   0.142
  346    H    ASP  44           H        ASP  44   4.005  13.522   2.135
  347    HA   ASP  44           HA       ASP  44   3.645  11.419   0.239
  348   1HB   ASP  44          2HB       ASP  44   1.675  13.058   1.848
  349   2HB   ASP  44          1HB       ASP  44   1.177  11.722   0.813
  350    H    LYS  45           H        LYS  45   3.607  14.799  -0.189
  351    HA   LYS  45           HA       LYS  45   1.641  14.942  -2.311
  352   1HB   LYS  45          2HB       LYS  45   3.513  16.744  -0.997
  353   2HB   LYS  45          1HB       LYS  45   3.501  16.995  -2.743
  354   1HG   LYS  45          2HG       LYS  45   0.873  16.845  -2.412
  355   2HG   LYS  45          1HG       LYS  45   1.279  17.331  -0.765
  356   1HD   LYS  45          2HD       LYS  45   2.684  19.196  -1.827
  357   2HD   LYS  45          1HD       LYS  45   1.857  18.810  -3.336
  358   1HE   LYS  45          2HE       LYS  45  -0.305  19.276  -2.336
  359   2HE   LYS  45          1HE       LYS  45   0.433  19.495  -0.749
  360   1HZ   LYS  45          1HZ       LYS  45   1.072  21.555  -1.251
  361   2HZ   LYS  45          2HZ       LYS  45  -0.042  21.467  -2.529
  362   3HZ   LYS  45          3HZ       LYS  45   1.600  21.130  -2.806
  363    H    GLY  46           H        GLY  46   2.256  13.122  -3.616
  364   1HA   GLY  46          2HA       GLY  46   3.848  13.724  -5.883
  365   2HA   GLY  46          1HA       GLY  46   4.848  12.771  -4.784
  366    H    TRP  47           H        TRP  47   2.701  11.122  -3.759
  367    HA   TRP  47           HA       TRP  47   1.826   9.633  -6.182
  368   1HB   TRP  47          2HB       TRP  47   2.422   7.518  -5.007
  369   2HB   TRP  47          1HB       TRP  47   3.839   8.526  -5.304
  370    HD1  TRP  47           HD1      TRP  47   4.096  10.430  -3.092
  371    HE1  TRP  47           HE1      TRP  47   4.270   9.776  -0.612
  372    HE3  TRP  47           HE3      TRP  47   2.022   5.779  -3.282
  373    HZ2  TRP  47           HZ2      TRP  47   3.629   7.560   1.072
  374    HZ3  TRP  47           HZ3      TRP  47   1.820   4.413  -1.221
  375    HH2  TRP  47           HH2      TRP  47   2.618   5.305   0.951
  376    H    GLN  48           H        GLN  48   0.891  11.208  -3.446
  377    HA   GLN  48           HA       GLN  48  -0.824   9.710  -1.954
  378   1HB   GLN  48          2HB       GLN  48  -2.419  11.844  -2.181
  379   2HB   GLN  48          1HB       GLN  48  -0.908  11.902  -1.292
  380   1HG   GLN  48          2HG       GLN  48  -1.459  13.768  -3.075
  381   2HG   GLN  48          1HG       GLN  48   0.179  13.145  -2.927
  382   1HE2  GLN  48          1HE2      GLN  48   1.099  12.354  -4.806
  383   2HE2  GLN  48          2HE2      GLN  48   0.266  11.910  -6.205
  384    H    ASN  49           H        ASN  49  -3.003  11.584  -3.853
  385    HA   ASN  49           HA       ASN  49  -4.732   9.389  -4.359
  386   1HB   ASN  49          2HB       ASN  49  -4.828  12.177  -4.669
  387   2HB   ASN  49          1HB       ASN  49  -5.089  11.522  -6.287
  388   1HD2  ASN  49          1HD2      ASN  49  -6.550  11.980  -3.168
  389   2HD2  ASN  49          2HD2      ASN  49  -7.994  11.150  -3.492
  390    H    SER  50           H        SER  50  -1.942  10.483  -6.112
  391    HA   SER  50           HA       SER  50  -2.551   9.618  -8.727
  392   1HB   SER  50          2HB       SER  50  -0.407  10.732  -8.030
  393   2HB   SER  50          1HB       SER  50   0.094   9.212  -7.294
  394    HG   SER  50           HG       SER  50   0.504   9.891  -9.729
  395    H    ILE  51           H        ILE  51  -1.965   7.830  -5.819
  396    HA   ILE  51           HA       ILE  51  -1.437   5.255  -7.004
  397    HB   ILE  51           HB       ILE  51  -1.647   6.426  -4.385
  398   1HG1  ILE  51          2HG1      ILE  51  -0.172   4.639  -3.805
  399   2HG1  ILE  51          1HG1      ILE  51  -0.770   3.638  -5.125
  400   1HG2  ILE  51          1HG2      ILE  51  -3.273   3.902  -4.810
  401   2HG2  ILE  51          2HG2      ILE  51  -3.775   5.389  -4.005
  402   3HG2  ILE  51          3HG2      ILE  51  -2.585   4.335  -3.247
  403   1HD1  ILE  51          1HD1      ILE  51   0.344   6.290  -5.874
  404   2HD1  ILE  51          2HD1      ILE  51   0.462   4.742  -6.713
  405   3HD1  ILE  51          3HD1      ILE  51   1.499   5.074  -5.325
  406    H    ARG  52           H        ARG  52  -4.399   6.480  -5.376
  407    HA   ARG  52           HA       ARG  52  -6.111   4.368  -6.065
  408   1HB   ARG  52          2HB       ARG  52  -6.892   6.122  -4.603
  409   2HB   ARG  52          1HB       ARG  52  -6.656   7.344  -5.848
  410   1HG   ARG  52          2HG       ARG  52  -8.336   5.657  -7.158
  411   2HG   ARG  52          1HG       ARG  52  -8.875   5.410  -5.497
  412   1HD   ARG  52          2HD       ARG  52  -9.422   7.689  -5.208
  413   2HD   ARG  52          1HD       ARG  52  -8.458   8.186  -6.598
  414    HE   ARG  52           HE       ARG  52 -10.606   6.409  -7.381
  415   1HH1  ARG  52          1HH2      ARG  52 -10.998   9.164  -5.619
  416   2HH1  ARG  52          2HH2      ARG  52 -11.771  10.094  -6.858
  417   1HH2  ARG  52          1HH1      ARG  52 -11.083   7.807  -9.372
  418   2HH2  ARG  52          2HH1      ARG  52 -11.819   9.326  -8.983
  419    H    HIS  53           H        HIS  53  -5.386   7.308  -7.920
  420    HA   HIS  53           HA       HIS  53  -6.966   6.662 -10.211
  421   1HB   HIS  53          2HB       HIS  53  -5.950   8.914  -9.602
  422   2HB   HIS  53          1HB       HIS  53  -4.407   8.282 -10.178
  423    HD1  HIS  53           HD1      HIS  53  -7.526   7.225 -11.930
  424    HD2  HIS  53           HD2      HIS  53  -4.513  10.060 -12.450
  425    HE1  HIS  53           HE1      HIS  53  -7.778   8.116 -14.290
  426    H    ASN  54           H        ASN  54  -3.735   5.755  -9.204
  427    HA   ASN  54           HA       ASN  54  -2.849   4.739 -11.754
  428   1HB   ASN  54          2HB       ASN  54  -1.923   4.599  -8.928
  429   2HB   ASN  54          1HB       ASN  54  -1.346   3.330 -10.017
  430   1HD2  ASN  54          1HD2      ASN  54  -0.313   6.183  -8.827
  431   2HD2  ASN  54          2HD2      ASN  54   0.520   6.806 -10.168
  432    H    LEU  55           H        LEU  55  -3.439   2.811  -8.818
  433    HA   LEU  55           HA       LEU  55  -3.836   0.386 -10.257
  434   1HB   LEU  55          2HB       LEU  55  -4.796  -0.426  -8.075
  435   2HB   LEU  55          1HB       LEU  55  -3.212   0.326  -7.931
  436    HG   LEU  55           HG       LEU  55  -4.865   2.484  -7.648
  437   1HD1  LEU  55          1HD1      LEU  55  -6.260   0.003  -6.688
  438   2HD1  LEU  55          2HD1      LEU  55  -6.942   1.415  -7.494
  439   3HD1  LEU  55          3HD1      LEU  55  -6.464   1.512  -5.799
  440   1HD2  LEU  55          1HD2      LEU  55  -3.104   2.265  -6.143
  441   2HD2  LEU  55          2HD2      LEU  55  -3.528   0.602  -5.756
  442   3HD2  LEU  55          3HD2      LEU  55  -4.488   1.923  -5.103
  443    H    SER  56           H        SER  56  -5.892   3.071 -10.029
  444    HA   SER  56           HA       SER  56  -8.389   1.521 -10.141
  445   1HB   SER  56          2HB       SER  56  -7.712   4.454 -10.344
  446   2HB   SER  56          1HB       SER  56  -9.317   3.865 -10.765
  447    HG   SER  56           HG       SER  56  -9.393   4.321  -8.616
  448    H    LEU  57           H        LEU  57  -6.333   3.396 -12.351
  449    HA   LEU  57           HA       LEU  57  -7.990   2.582 -14.654
  450   1HB   LEU  57          2HB       LEU  57  -6.489   4.024 -15.946
  451   2HB   LEU  57          1HB       LEU  57  -7.072   4.889 -14.527
  452    HG   LEU  57           HG       LEU  57  -4.865   3.811 -13.455
  453   1HD1  LEU  57          1HD1      LEU  57  -4.567   3.566 -16.383
  454   2HD1  LEU  57          2HD1      LEU  57  -3.712   2.725 -15.090
  455   3HD1  LEU  57          3HD1      LEU  57  -3.208   4.345 -15.571
  456   1HD2  LEU  57          1HD2      LEU  57  -4.316   6.161 -15.201
  457   2HD2  LEU  57          2HD2      LEU  57  -4.055   5.964 -13.469
  458   3HD2  LEU  57          3HD2      LEU  57  -5.672   6.309 -14.083
  459    H    ASN  58           H        ASN  58  -5.756   1.038 -12.856
  460    HA   ASN  58           HA       ASN  58  -4.033   0.031 -15.001
  461   1HB   ASN  58          2HB       ASN  58  -4.069  -0.143 -12.100
  462   2HB   ASN  58          1HB       ASN  58  -3.830  -1.732 -12.821
  463   1HD2  ASN  58          1HD2      ASN  58  -2.507   1.588 -12.761
  464   2HD2  ASN  58          2HD2      ASN  58  -0.967   1.157 -13.327
  465    H    ARG  59           H        ARG  59  -3.898  -2.438 -15.294
  466    HA   ARG  59           HA       ARG  59  -6.631  -3.373 -15.897
  467   1HB   ARG  59          2HB       ARG  59  -5.493  -5.135 -17.190
  468   2HB   ARG  59          1HB       ARG  59  -4.899  -3.537 -17.637
  469   1HG   ARG  59          2HG       ARG  59  -2.895  -3.817 -16.374
  470   2HG   ARG  59          1HG       ARG  59  -3.530  -5.240 -15.548
  471   1HD   ARG  59          2HD       ARG  59  -1.889  -5.732 -17.424
  472   2HD   ARG  59          1HD       ARG  59  -3.445  -6.551 -17.559
  473    HE   ARG  59           HE       ARG  59  -3.659  -4.102 -18.966
  474   1HH1  ARG  59          1HH1      ARG  59  -0.871  -5.785 -19.267
  475   2HH1  ARG  59          2HH1      ARG  59  -1.128  -6.346 -20.885
  476   1HH2  ARG  59          1HH2      ARG  59  -4.457  -5.382 -20.976
  477   2HH2  ARG  59          2HH2      ARG  59  -3.156  -6.117 -21.852
  478    H    TYR  60           H        TYR  60  -3.899  -4.301 -13.812
  479    HA   TYR  60           HA       TYR  60  -5.345  -6.736 -12.989
  480   1HB   TYR  60          2HB       TYR  60  -3.313  -6.692 -11.240
  481   2HB   TYR  60          1HB       TYR  60  -3.131  -7.303 -12.880
  482    HD1  TYR  60           HD1      TYR  60  -3.114  -3.909 -11.199
  483    HD2  TYR  60           HD2      TYR  60  -1.239  -6.611 -13.958
  484    HE1  TYR  60           HE1      TYR  60  -1.382  -2.209 -11.711
  485    HE2  TYR  60           HE2      TYR  60   0.488  -4.918 -14.461
  486    HH   TYR  60           HH       TYR  60   0.640  -2.362 -14.341
  487    H    PHE  61           H        PHE  61  -4.826  -3.485 -11.753
  488    HA   PHE  61           HA       PHE  61  -5.706  -4.249  -9.084
  489   1HB   PHE  61          2HB       PHE  61  -5.217  -1.576 -10.388
  490   2HB   PHE  61          1HB       PHE  61  -5.782  -1.752  -8.720
  491    HD1  PHE  61           HD1      PHE  61  -2.903  -1.486 -10.720
  492    HD2  PHE  61           HD2      PHE  61  -4.446  -3.609  -7.326
  493    HE1  PHE  61           HE1      PHE  61  -0.602  -1.997 -10.000
  494    HE2  PHE  61           HE2      PHE  61  -2.148  -4.117  -6.605
  495    HZ   PHE  61           HZ       PHE  61  -0.223  -3.310  -7.924
  496    H    ILE  62           H        ILE  62  -7.694  -4.785  -8.687
  497    HA   ILE  62           HA       ILE  62  -9.929  -3.447 -10.140
  498    HB   ILE  62           HB       ILE  62 -11.136  -5.435 -10.051
  499   1HG1  ILE  62          2HG1      ILE  62  -9.449  -6.235  -7.653
  500   2HG1  ILE  62          1HG1      ILE  62 -11.121  -5.674  -7.606
  501   1HG2  ILE  62          1HG2      ILE  62  -9.120  -5.885 -11.362
  502   2HG2  ILE  62          2HG2      ILE  62  -9.587  -7.338 -10.478
  503   3HG2  ILE  62          3HG2      ILE  62  -8.246  -6.348  -9.901
  504   1HD1  ILE  62          1HD1      ILE  62 -10.701  -8.234  -7.547
  505   2HD1  ILE  62          2HD1      ILE  62 -10.341  -8.067  -9.265
  506   3HD1  ILE  62          3HD1      ILE  62 -11.934  -7.625  -8.651
  507    H    LYS  63           H        LYS  63 -12.030  -3.769  -8.506
  508    HA   LYS  63           HA       LYS  63 -11.146  -2.701  -5.856
  509   1HB   LYS  63          2HB       LYS  63 -13.710  -1.789  -7.123
  510   2HB   LYS  63          1HB       LYS  63 -12.694  -0.961  -5.941
  511   1HG   LYS  63          2HG       LYS  63 -10.917  -0.800  -7.752
  512   2HG   LYS  63          1HG       LYS  63 -12.145  -1.353  -8.890
  513   1HD   LYS  63          2HD       LYS  63 -12.217   1.023  -9.007
  514   2HD   LYS  63          1HD       LYS  63 -13.601   0.568  -8.010
  515   1HE   LYS  63          2HE       LYS  63 -12.668   2.232  -6.689
  516   2HE   LYS  63          1HE       LYS  63 -11.845   0.814  -6.039
  517   1HZ   LYS  63          1HZ       LYS  63  -9.975   1.253  -7.466
  518   2HZ   LYS  63          2HZ       LYS  63 -10.317   2.641  -6.548
  519   3HZ   LYS  63          3HZ       LYS  63 -10.773   2.566  -8.183
  520    H    VAL  64           H        VAL  64 -12.860  -2.972  -4.147
  521    HA   VAL  64           HA       VAL  64 -13.795  -5.641  -4.054
  522    HB   VAL  64           HB       VAL  64 -14.054  -3.234  -2.379
  523   1HG1  VAL  64          1HG1      VAL  64 -15.862  -4.392  -0.978
  524   2HG1  VAL  64          2HG1      VAL  64 -16.208  -5.359  -2.412
  525   3HG1  VAL  64          3HG1      VAL  64 -16.412  -3.608  -2.459
  526   1HG2  VAL  64          1HG2      VAL  64 -13.664  -4.962  -0.609
  527   2HG2  VAL  64          2HG2      VAL  64 -12.441  -4.968  -1.879
  528   3HG2  VAL  64          3HG2      VAL  64 -13.707  -6.197  -1.868
  529    HA   PRO  65           HA       PRO  65 -18.078  -3.939  -5.302
  530   1HB   PRO  65          2HB       PRO  65 -18.202  -1.280  -5.996
  531   2HB   PRO  65          1HB       PRO  65 -18.444  -1.869  -4.342
  532   1HG   PRO  65          2HG       PRO  65 -16.083  -0.469  -5.508
  533   2HG   PRO  65          1HG       PRO  65 -16.644  -0.513  -3.829
  534   1HD   PRO  65          2HD       PRO  65 -14.502  -2.026  -4.900
  535   2HD   PRO  65          1HD       PRO  65 -15.282  -2.290  -3.332
  536    H    ARG  66           H        ARG  66 -19.020  -2.855  -7.497
  537    HA   ARG  66           HA       ARG  66 -16.947  -2.947  -9.628
  538   1HB   ARG  66          2HB       ARG  66 -19.281  -4.789  -9.286
  539   2HB   ARG  66          1HB       ARG  66 -18.854  -4.285 -10.922
  540   1HG   ARG  66          2HG       ARG  66 -16.492  -5.000 -10.461
  541   2HG   ARG  66          1HG       ARG  66 -17.038  -5.644  -8.912
  542   1HD   ARG  66          2HD       ARG  66 -18.856  -6.711 -10.716
  543   2HD   ARG  66          1HD       ARG  66 -17.331  -6.769 -11.599
  544    HE   ARG  66           HE       ARG  66 -16.403  -8.096  -9.712
  545   1HH1  ARG  66          1HH1      ARG  66 -19.281  -7.093  -8.477
  546   2HH1  ARG  66          2HH1      ARG  66 -19.909  -8.663  -8.106
  547   1HH2  ARG  66          1HH2      ARG  66 -17.432 -10.358  -9.843
  548   2HH2  ARG  66          2HH2      ARG  66 -18.864 -10.512  -8.880
  549    H    SER  67           H        SER  67 -17.587  -1.794 -11.547
  550    HA   SER  67           HA       SER  67 -20.130  -0.253 -11.309
  551   1HB   SER  67          2HB       SER  67 -18.489   1.603 -12.426
  552   2HB   SER  67          1HB       SER  67 -18.817   1.509 -10.698
  553    HG   SER  67           HG       SER  67 -16.503   1.369 -11.774
  554    H    GLN  68           H        GLN  68 -20.674   0.821 -13.453
  555    HA   GLN  68           HA       GLN  68 -19.693  -0.876 -15.715
  556   1HB   GLN  68          2HB       GLN  68 -22.451   0.150 -15.054
  557   2HB   GLN  68          1HB       GLN  68 -22.018  -0.306 -16.703
  558   1HG   GLN  68          2HG       GLN  68 -21.063  -2.452 -15.321
  559   2HG   GLN  68          1HG       GLN  68 -22.452  -2.013 -14.325
  560   1HE2  GLN  68          1HE2      GLN  68 -24.200  -3.279 -14.962
  561   2HE2  GLN  68          2HE2      GLN  68 -24.624  -3.617 -16.570
  562    H    GLU  69           H        GLU  69 -18.147   1.216 -15.432
  563    HA   GLU  69           HA       GLU  69 -18.610   2.827 -17.762
  564   1HB   GLU  69          2HB       GLU  69 -20.108   3.738 -15.676
  565   2HB   GLU  69          1HB       GLU  69 -18.612   4.635 -15.418
  566   1HG   GLU  69          2HG       GLU  69 -19.095   6.013 -17.127
  567   2HG   GLU  69          1HG       GLU  69 -19.252   4.641 -18.224
  568    H    GLU  70           H        GLU  70 -17.133   3.291 -14.526
  569    HA   GLU  70           HA       GLU  70 -14.456   2.875 -15.530
  570   1HB   GLU  70          2HB       GLU  70 -13.740   5.296 -15.051
  571   2HB   GLU  70          1HB       GLU  70 -14.625   5.019 -16.553
  572   1HG   GLU  70          2HG       GLU  70 -16.747   5.572 -15.223
  573   2HG   GLU  70          1HG       GLU  70 -15.669   6.179 -13.965
  574    HA   PRO  71           HA       PRO  71 -13.981   2.377 -11.180
  575   1HB   PRO  71          2HB       PRO  71 -11.240   2.172 -11.145
  576   2HB   PRO  71          1HB       PRO  71 -12.312   0.870 -11.689
  577   1HG   PRO  71          2HG       PRO  71 -10.605   2.699 -13.314
  578   2HG   PRO  71          1HG       PRO  71 -11.165   1.060 -13.686
  579   1HD   PRO  71          2HD       PRO  71 -12.255   3.459 -14.720
  580   2HD   PRO  71          1HD       PRO  71 -13.000   1.848 -14.812
  581    H    GLY  72           H        GLY  72 -14.358   4.208  -9.944
  582   1HA   GLY  72          2HA       GLY  72 -12.139   6.174  -9.729
  583   2HA   GLY  72          1HA       GLY  72 -13.762   6.781 -10.071
  584    H    LYS  73           H        LYS  73 -15.409   6.503  -8.423
  585    HA   LYS  73           HA       LYS  73 -14.424   6.845  -5.743
  586   1HB   LYS  73          2HB       LYS  73 -16.918   7.103  -7.098
  587   2HB   LYS  73          1HB       LYS  73 -17.176   6.043  -5.712
  588   1HG   LYS  73          2HG       LYS  73 -17.191   7.861  -4.387
  589   2HG   LYS  73          1HG       LYS  73 -15.496   8.126  -4.800
  590   1HD   LYS  73          2HD       LYS  73 -16.649   9.134  -7.022
  591   2HD   LYS  73          1HD       LYS  73 -17.932   9.462  -5.857
  592   1HE   LYS  73          2HE       LYS  73 -15.164  10.114  -4.991
  593   2HE   LYS  73          1HE       LYS  73 -15.860  11.145  -6.241
  594   1HZ   LYS  73          1HZ       LYS  73 -16.394  11.146  -3.490
  595   2HZ   LYS  73          2HZ       LYS  73 -17.818  10.698  -4.302
  596   3HZ   LYS  73          3HZ       LYS  73 -17.040  12.158  -4.688
  597    H    GLY  74           H        GLY  74 -13.614   5.237  -4.510
  598   1HA   GLY  74          2HA       GLY  74 -15.101   2.747  -4.154
  599   2HA   GLY  74          1HA       GLY  74 -13.548   2.527  -4.963
  600    H    SER  75           H        SER  75 -13.282   1.230  -2.808
  601    HA   SER  75           HA       SER  75 -11.813   3.003  -0.952
  602   1HB   SER  75          2HB       SER  75 -13.740   3.000   0.331
  603   2HB   SER  75          1HB       SER  75 -14.262   1.427  -0.260
  604    HG   SER  75           HG       SER  75 -12.732   2.073   1.895
  605    H    PHE  76           H        PHE  76 -12.765  -0.247  -0.056
  606    HA   PHE  76           HA       PHE  76  -9.997  -1.083   0.102
  607   1HB   PHE  76          2HB       PHE  76 -12.511  -2.011   1.054
  608   2HB   PHE  76          1HB       PHE  76 -11.797  -3.323   0.117
  609    HD1  PHE  76           HD1      PHE  76 -10.047  -0.657   2.062
  610    HD2  PHE  76           HD2      PHE  76 -11.036  -4.828   1.776
  611    HE1  PHE  76           HE1      PHE  76  -8.502  -1.153   3.937
  612    HE2  PHE  76           HE2      PHE  76  -9.490  -5.322   3.650
  613    HZ   PHE  76           HZ       PHE  76  -8.223  -3.485   4.732
  614    H    TRP  77           H        TRP  77  -9.254  -0.815  -2.121
  615    HA   TRP  77           HA       TRP  77 -10.523  -2.592  -4.127
  616   1HB   TRP  77          2HB       TRP  77  -9.153  -1.451  -5.758
  617   2HB   TRP  77          1HB       TRP  77  -9.851  -0.228  -4.696
  618    HD1  TRP  77           HD1      TRP  77  -8.215   1.368  -3.558
  619    HE1  TRP  77           HE1      TRP  77  -5.657   1.447  -3.240
  620    HE3  TRP  77           HE3      TRP  77  -6.953  -3.197  -5.459
  621    HZ2  TRP  77           HZ2      TRP  77  -3.380  -0.208  -3.735
  622    HZ3  TRP  77           HZ3      TRP  77  -4.584  -3.918  -5.525
  623    HH2  TRP  77           HH2      TRP  77  -2.804  -2.424  -4.677
  624    H    ARG  78           H        ARG  78  -9.502  -4.408  -4.968
  625    HA   ARG  78           HA       ARG  78  -6.886  -5.173  -3.713
  626   1HB   ARG  78          2HB       ARG  78  -7.814  -7.577  -4.229
  627   2HB   ARG  78          1HB       ARG  78  -8.406  -6.739  -2.799
  628   1HG   ARG  78          2HG       ARG  78 -10.489  -6.404  -3.689
  629   2HG   ARG  78          1HG       ARG  78  -9.865  -6.199  -5.326
  630   1HD   ARG  78          2HD       ARG  78  -9.484  -8.618  -5.504
  631   2HD   ARG  78          1HD       ARG  78 -10.065  -8.842  -3.854
  632    HE   ARG  78           HE       ARG  78 -11.941  -7.549  -5.732
  633   1HH1  ARG  78          1HH2      ARG  78 -10.788 -10.645  -5.501
  634   2HH1  ARG  78          2HH2      ARG  78 -12.289 -11.384  -5.058
  635   1HH2  ARG  78          1HH1      ARG  78 -13.921  -8.365  -4.538
  636   2HH2  ARG  78          2HH1      ARG  78 -14.067 -10.091  -4.512
  637    H    ILE  79           H        ILE  79  -5.592  -6.697  -5.063
  638    HA   ILE  79           HA       ILE  79  -5.903  -6.001  -7.952
  639    HB   ILE  79           HB       ILE  79  -3.678  -5.609  -6.906
  640   1HG1  ILE  79          2HG1      ILE  79  -3.159  -7.857  -8.772
  641   2HG1  ILE  79          1HG1      ILE  79  -4.249  -6.604  -9.367
  642   1HG2  ILE  79          1HG2      ILE  79  -3.690  -8.624  -6.627
  643   2HG2  ILE  79          2HG2      ILE  79  -3.699  -7.460  -5.302
  644   3HG2  ILE  79          3HG2      ILE  79  -2.292  -7.582  -6.360
  645   1HD1  ILE  79          1HD1      ILE  79  -1.729  -5.746  -8.012
  646   2HD1  ILE  79          2HD1      ILE  79  -2.621  -4.966  -9.318
  647   3HD1  ILE  79          3HD1      ILE  79  -1.618  -6.371  -9.653
  648    H    ASP  80           H        ASP  80  -5.705  -7.754  -9.544
  649    HA   ASP  80           HA       ASP  80  -7.411  -9.940  -8.973
  650   1HB   ASP  80          2HB       ASP  80  -5.451  -9.409 -11.206
  651   2HB   ASP  80          1HB       ASP  80  -6.421 -10.881 -11.152
  652    HA   PRO  81           HA       PRO  81  -4.654 -12.798  -7.097
  653   1HB   PRO  81          2HB       PRO  81  -6.188 -15.048  -7.457
  654   2HB   PRO  81          1HB       PRO  81  -6.550 -13.800  -6.251
  655   1HG   PRO  81          2HG       PRO  81  -7.921 -14.365  -8.833
  656   2HG   PRO  81          1HG       PRO  81  -8.552 -13.575  -7.378
  657   1HD   PRO  81          2HD       PRO  81  -7.686 -12.282  -9.762
  658   2HD   PRO  81          1HD       PRO  81  -8.086 -11.494  -8.220
  659    H    ALA  82           H        ALA  82  -6.047 -13.721 -10.259
  660    HA   ALA  82           HA       ALA  82  -3.889 -15.626 -10.788
  661   1HB   ALA  82          1HB       ALA  82  -6.468 -15.096 -11.854
  662   2HB   ALA  82          2HB       ALA  82  -5.370 -16.405 -12.289
  663   3HB   ALA  82          3HB       ALA  82  -5.314 -14.879 -13.170
  664    H    SER  83           H        SER  83  -4.270 -12.248 -11.105
  665    HA   SER  83           HA       SER  83  -2.232 -12.112 -13.268
  666   1HB   SER  83          2HB       SER  83  -3.800  -9.885 -11.930
  667   2HB   SER  83          1HB       SER  83  -2.732  -9.701 -13.316
  668    HG   SER  83           HG       SER  83  -5.200 -10.101 -13.516
  669    H    GLU  84           H        GLU  84  -2.484 -12.103  -9.891
  670    HA   GLU  84           HA       GLU  84  -0.555 -10.180  -9.131
  671   1HB   GLU  84          2HB       GLU  84  -1.590 -12.705  -7.912
  672   2HB   GLU  84          1HB       GLU  84  -0.118 -12.004  -7.239
  673   1HG   GLU  84          2HG       GLU  84  -1.206 -10.188  -6.391
  674   2HG   GLU  84          1HG       GLU  84  -2.304 -10.078  -7.768
  675    H    ALA  85           H        ALA  85   0.037 -13.703  -9.542
  676    HA   ALA  85           HA       ALA  85   2.783 -13.749  -9.262
  677   1HB   ALA  85          1HB       ALA  85   2.189 -15.865  -9.834
  678   2HB   ALA  85          2HB       ALA  85   2.473 -15.343 -11.495
  679   3HB   ALA  85          3HB       ALA  85   0.841 -15.309 -10.828
  680    H    LYS  86           H        LYS  86   0.989 -12.245 -11.865
  681    HA   LYS  86           HA       LYS  86   3.378 -11.906 -13.537
  682   1HB   LYS  86          2HB       LYS  86   0.864 -12.088 -14.283
  683   2HB   LYS  86          1HB       LYS  86   0.835 -10.359 -13.934
  684   1HG   LYS  86          2HG       LYS  86   3.139 -10.506 -15.355
  685   2HG   LYS  86          1HG       LYS  86   2.239 -11.828 -16.099
  686   1HD   LYS  86          2HD       LYS  86   1.731  -9.814 -17.333
  687   2HD   LYS  86          1HD       LYS  86   0.301 -10.242 -16.391
  688   1HE   LYS  86          2HE       LYS  86   0.417  -8.342 -15.172
  689   2HE   LYS  86          1HE       LYS  86   2.147  -8.540 -14.895
  690   1HZ   LYS  86          1HZ       LYS  86   1.694  -6.553 -16.181
  691   2HZ   LYS  86          2HZ       LYS  86   0.898  -7.471 -17.368
  692   3HZ   LYS  86          3HZ       LYS  86   2.565  -7.673 -17.111
  693    H    LEU  87           H        LEU  87   1.110  -9.529 -12.082
  694    HA   LEU  87           HA       LEU  87   2.751  -7.288 -12.371
  695   1HB   LEU  87          2HB       LEU  87   1.577  -6.614 -10.059
  696   2HB   LEU  87          1HB       LEU  87   0.714  -6.608 -11.580
  697    HG   LEU  87           HG       LEU  87   0.676  -9.252 -10.364
  698   1HD1  LEU  87          1HD1      LEU  87   0.597  -8.443  -8.205
  699   2HD1  LEU  87          2HD1      LEU  87  -1.101  -8.248  -8.637
  700   3HD1  LEU  87          3HD1      LEU  87  -0.009  -6.865  -8.709
  701   1HD2  LEU  87          1HD2      LEU  87  -1.816  -8.827 -10.634
  702   2HD2  LEU  87          2HD2      LEU  87  -0.879  -8.634 -12.117
  703   3HD2  LEU  87          3HD2      LEU  87  -1.405  -7.216 -11.220
  704    H    VAL  88           H        VAL  88   2.454  -9.202  -9.407
  705    HA   VAL  88           HA       VAL  88   4.373  -8.079  -7.814
  706    HB   VAL  88           HB       VAL  88   4.836 -10.351  -7.001
  707   1HG1  VAL  88          1HG1      VAL  88   2.879 -10.212  -5.880
  708   2HG1  VAL  88          2HG1      VAL  88   1.976 -10.644  -7.333
  709   3HG1  VAL  88          3HG1      VAL  88   2.397  -8.960  -7.025
  710   1HG2  VAL  88          1HG2      VAL  88   3.057 -11.945  -8.384
  711   2HG2  VAL  88          2HG2      VAL  88   4.807 -11.944  -8.614
  712   3HG2  VAL  88          3HG2      VAL  88   3.778 -10.962  -9.658
  713    H    GLU  89           H        GLU  89   4.992  -9.993 -10.707
  714    HA   GLU  89           HA       GLU  89   7.690 -10.666 -10.309
  715   1HB   GLU  89          2HB       GLU  89   6.161 -11.202 -12.326
  716   2HB   GLU  89          1HB       GLU  89   6.691  -9.647 -12.970
  717   1HG   GLU  89          2HG       GLU  89   8.570 -10.633 -13.719
  718   2HG   GLU  89          1HG       GLU  89   9.018 -10.979 -12.048
  719    H    GLN  90           H        GLN  90   6.388  -7.659 -11.743
  720    HA   GLN  90           HA       GLN  90   9.035  -6.423 -11.746
  721   1HB   GLN  90          2HB       GLN  90   6.315  -5.718 -12.651
  722   2HB   GLN  90          1HB       GLN  90   7.263  -4.353 -12.058
  723   1HG   GLN  90          2HG       GLN  90   8.394  -4.320 -14.001
  724   2HG   GLN  90          1HG       GLN  90   8.999  -5.940 -13.654
  725   1HE2  GLN  90          1HE2      GLN  90   6.111  -4.282 -15.032
  726   2HE2  GLN  90          2HE2      GLN  90   5.724  -5.534 -16.112
  727    H    ALA  91           H        ALA  91   6.580  -6.938  -9.438
  728    HA   ALA  91           HA       ALA  91   6.923  -4.545  -7.875
  729   1HB   ALA  91          1HB       ALA  91   5.658  -5.627  -6.173
  730   2HB   ALA  91          2HB       ALA  91   6.014  -7.219  -6.842
  731   3HB   ALA  91          3HB       ALA  91   4.960  -6.109  -7.718
  732    H    PHE  92           H        PHE  92   8.016  -7.868  -7.118
  733    HA   PHE  92           HA       PHE  92   9.847  -6.980  -5.097
  734   1HB   PHE  92          2HB       PHE  92  10.101  -9.519  -6.727
  735   2HB   PHE  92          1HB       PHE  92  10.675  -9.233  -5.083
  736    HD1  PHE  92           HD1      PHE  92   8.613 -11.351  -6.305
  737    HD2  PHE  92           HD2      PHE  92   8.241  -7.694  -4.083
  738    HE1  PHE  92           HE1      PHE  92   6.431 -12.117  -5.410
  739    HE2  PHE  92           HE2      PHE  92   6.059  -8.460  -3.187
  740    HZ   PHE  92           HZ       PHE  92   5.153 -10.671  -3.852
  741    H    ARG  93           H        ARG  93   9.969  -6.798  -8.492
  742    HA   ARG  93           HA       ARG  93  12.945  -6.628  -8.494
  743   1HB   ARG  93          2HB       ARG  93  10.863  -7.157 -10.573
  744   2HB   ARG  93          1HB       ARG  93  12.347  -6.352 -11.083
  745   1HG   ARG  93          2HG       ARG  93  13.684  -8.170 -10.094
  746   2HG   ARG  93          1HG       ARG  93  12.205  -8.976  -9.567
  747   1HD   ARG  93          2HD       ARG  93  11.486  -8.950 -12.022
  748   2HD   ARG  93          1HD       ARG  93  13.149  -8.497 -12.399
  749    HE   ARG  93           HE       ARG  93  12.296 -11.101 -11.241
  750   1HH1  ARG  93          1HH2      ARG  93  14.173  -9.586 -13.543
  751   2HH1  ARG  93          2HH2      ARG  93  15.594 -10.542 -13.284
  752   1HH2  ARG  93          1HH1      ARG  93  14.360 -12.082 -10.433
  753   2HH2  ARG  93          2HH1      ARG  93  15.700 -11.955 -11.523
  754    H    LYS  94           H        LYS  94  13.972  -4.687  -9.037
  755    HA   LYS  94           HA       LYS  94  12.256  -2.278  -8.917
  756   1HB   LYS  94          2HB       LYS  94  15.159  -2.862  -8.490
  757   2HB   LYS  94          1HB       LYS  94  14.706  -1.230  -8.982
  758   1HG   LYS  94          2HG       LYS  94  13.895  -0.752  -6.934
  759   2HG   LYS  94          1HG       LYS  94  12.936  -2.232  -6.903
  760   1HD   LYS  94          2HD       LYS  94  15.920  -2.218  -6.400
  761   2HD   LYS  94          1HD       LYS  94  14.737  -2.048  -5.102
  762   1HE   LYS  94          2HE       LYS  94  13.699  -4.191  -5.775
  763   2HE   LYS  94          1HE       LYS  94  14.906  -4.369  -7.048
  764   1HZ   LYS  94          1HZ       LYS  94  15.874  -3.884  -4.339
  765   2HZ   LYS  94          2HZ       LYS  94  16.536  -4.845  -5.573
  766   3HZ   LYS  94          3HZ       LYS  94  15.221  -5.416  -4.661
  767    H    ARG  95           H        ARG  95  11.880  -0.999 -10.686
  768    HA   ARG  95           HA       ARG  95  12.744  -1.941 -13.303
  769   1HB   ARG  95          2HB       ARG  95  11.540   0.146 -14.096
  770   2HB   ARG  95          1HB       ARG  95  10.549  -0.967 -13.151
  771   1HG   ARG  95          2HG       ARG  95  10.541   0.418 -11.277
  772   2HG   ARG  95          1HG       ARG  95  12.034   1.231 -11.746
  773   1HD   ARG  95          2HD       ARG  95   9.344   1.535 -13.111
  774   2HD   ARG  95          1HD       ARG  95  10.120   2.732 -12.074
  775    HE   ARG  95           HE       ARG  95  11.996   2.238 -14.062
  776   1HH1  ARG  95          1HH2      ARG  95   9.816   1.669 -15.945
  777   2HH1  ARG  95          2HH2      ARG  95   9.367   3.239 -16.519
  778   1HH2  ARG  95          1HH1      ARG  95  10.933   4.927 -13.928
  779   2HH2  ARG  95          2HH1      ARG  95   9.999   5.084 -15.378
  780    H    ARG  96           H        ARG  96  15.094  -1.727 -12.939
  781    HA   ARG  96           HA       ARG  96  16.002   1.038 -13.567
  782   1HB   ARG  96          2HB       ARG  96  16.352  -0.125 -11.053
  783   2HB   ARG  96          1HB       ARG  96  17.898  -0.377 -11.865
  784   1HG   ARG  96          2HG       ARG  96  18.286   1.907 -12.133
  785   2HG   ARG  96          1HG       ARG  96  16.572   2.312 -12.032
  786   1HD   ARG  96          2HD       ARG  96  16.546   1.833  -9.647
  787   2HD   ARG  96          1HD       ARG  96  18.213   1.260  -9.710
  788    HE   ARG  96           HE       ARG  96  18.688   3.529  -9.259
  789   1HH1  ARG  96          1HH1      ARG  96  15.785   4.409  -9.578
  790   2HH1  ARG  96          2HH1      ARG  96  15.923   5.549 -10.874
  791   1HH2  ARG  96          1HH2      ARG  96  19.077   4.476 -11.834
  792   2HH2  ARG  96          2HH2      ARG  96  17.788   5.587 -12.152
  793    H    GLN  97           H        GLN  97  15.828  -0.542 -15.633
  794    HA   GLN  97           HA       GLN  97  17.884  -2.483 -16.048
  795   1HB   GLN  97          2HB       GLN  97  16.491  -0.702 -18.074
  796   2HB   GLN  97          1HB       GLN  97  17.425  -2.148 -18.458
  797   1HG   GLN  97          2HG       GLN  97  15.867  -3.473 -17.008
  798   2HG   GLN  97          1HG       GLN  97  14.887  -2.020 -16.806
  799   1HE2  GLN  97          1HE2      GLN  97  15.459  -4.718 -18.864
  800   2HE2  GLN  97          2HE2      GLN  97  14.505  -4.208 -20.172
  801    H    ARG  98           H        ARG  98  17.808   1.030 -16.464
  802    HA   ARG  98           HA       ARG  98  20.635   1.302 -16.174
  803   1HB   ARG  98          2HB       ARG  98  20.384   0.225 -18.520
  804   2HB   ARG  98          1HB       ARG  98  19.764   1.800 -19.018
  805   1HG   ARG  98          2HG       ARG  98  21.826   2.717 -19.012
  806   2HG   ARG  98          1HG       ARG  98  22.195   2.042 -17.425
  807   1HD   ARG  98          2HD       ARG  98  23.671   1.201 -19.309
  808   2HD   ARG  98          1HD       ARG  98  22.861  -0.060 -18.381
  809    HE   ARG  98           HE       ARG  98  21.630   0.891 -20.923
  810   1HH1  ARG  98          1HH2      ARG  98  21.048  -1.540 -18.962
  811   2HH1  ARG  98          2HH2      ARG  98  21.523  -2.842 -20.002
  812   1HH2  ARG  98          1HH1      ARG  98  23.133  -0.784 -22.281
  813   2HH2  ARG  98          2HH1      ARG  98  22.704  -2.413 -21.881
  814    H    GLY  99           H        GLY  99  17.734   2.669 -17.724
  815   1HA   GLY  99          2HA       GLY  99  17.928   5.080 -16.135
  816   2HA   GLY  99          1HA       GLY  99  18.416   5.371 -17.804
  817    H    VAL 100           H        VAL 100  16.768   4.347 -19.451
  818    HA   VAL 100           HA       VAL 100  13.984   4.396 -18.464
  819    HB   VAL 100           HB       VAL 100  14.567   6.776 -18.968
  820   1HG1  VAL 100          1HG1      VAL 100  14.607   6.192 -21.883
  821   2HG1  VAL 100          2HG1      VAL 100  16.069   5.779 -20.987
  822   3HG1  VAL 100          3HG1      VAL 100  15.464   7.437 -20.973
  823   1HG2  VAL 100          1HG2      VAL 100  12.386   5.208 -20.023
  824   2HG2  VAL 100          2HG2      VAL 100  12.750   6.530 -21.133
  825   3HG2  VAL 100          3HG2      VAL 100  12.366   6.875 -19.447
  826    H    SER 101           HN       SER 101  15.577   2.297 -19.580
  827    HA   SER 101           HA       SER 101  15.185   1.949 -22.387
  828   1HB   SER 101          2HB       SER 101  16.086   0.344 -20.144
  829   2HB   SER 101          1HB       SER 101  15.062  -0.606 -21.216
  830    HG   SER 101           HG       SER 101  17.426  -0.402 -21.698
  Start of MODEL   18
    1   1H    GLU   1          1HT       GLU   1  15.450  12.321 -12.360
    2   2H    GLU   1          2HT       GLU   1  15.673  13.779 -11.516
    3   3H    GLU   1          3HT       GLU   1  14.106  13.187 -11.794
    4    HA   GLU   1           HA       GLU   1  15.054  11.111 -10.502
    5   1HB   GLU   1          2HB       GLU   1  17.294  12.175 -10.280
    6   2HB   GLU   1          1HB       GLU   1  16.554  13.493  -9.371
    7   1HG   GLU   1          2HG       GLU   1  15.941  10.753  -8.409
    8   2HG   GLU   1          1HG       GLU   1  17.605  11.298  -8.187
    9    H    SER   2           H        SER   2  13.703  10.787  -8.707
   10    HA   SER   2           HA       SER   2  12.642  12.835  -7.044
   11   1HB   SER   2          2HB       SER   2  10.250  12.157  -8.426
   12   2HB   SER   2          1HB       SER   2  10.999  13.744  -8.280
   13    HG   SER   2           HG       SER   2  11.459  13.563 -10.313
   14    H    LYS   3           H        LYS   3  11.183  10.013  -8.715
   15    HA   LYS   3           HA       LYS   3  10.906   8.745  -6.017
   16   1HB   LYS   3          2HB       LYS   3   9.040   8.151  -8.306
   17   2HB   LYS   3          1HB       LYS   3   8.767   7.951  -6.574
   18   1HG   LYS   3          2HG       LYS   3   8.694  10.373  -6.268
   19   2HG   LYS   3          1HG       LYS   3   9.077  10.625  -7.972
   20   1HD   LYS   3          2HD       LYS   3   6.713   8.921  -7.299
   21   2HD   LYS   3          1HD       LYS   3   6.559  10.668  -7.112
   22   1HE   LYS   3          2HE       LYS   3   7.842   9.772  -9.627
   23   2HE   LYS   3          1HE       LYS   3   6.132   9.370  -9.464
   24   1HZ   LYS   3          1HZ       LYS   3   5.723  11.716  -8.892
   25   2HZ   LYS   3          2HZ       LYS   3   6.340  11.519 -10.463
   26   3HZ   LYS   3          3HZ       LYS   3   7.352  12.064  -9.210
   27    HA   PRO   4           HA       PRO   4  13.378   5.863  -8.519
   28   1HB   PRO   4          2HB       PRO   4  15.186   5.350  -6.533
   29   2HB   PRO   4          1HB       PRO   4  15.302   6.724  -7.646
   30   1HG   PRO   4          2HG       PRO   4  14.574   6.714  -4.767
   31   2HG   PRO   4          1HG       PRO   4  15.190   8.043  -5.761
   32   1HD   PRO   4          2HD       PRO   4  12.468   7.586  -4.971
   33   2HD   PRO   4          1HD       PRO   4  13.076   8.855  -6.054
   34    HA   PRO   5           HA       PRO   5  12.186   2.596  -5.197
   35   1HB   PRO   5          2HB       PRO   5   9.515   2.704  -4.571
   36   2HB   PRO   5          1HB       PRO   5  10.779   3.479  -3.605
   37   1HG   PRO   5          2HG       PRO   5   8.786   4.727  -5.418
   38   2HG   PRO   5          1HG       PRO   5   9.663   5.439  -4.054
   39   1HD   PRO   5          2HD       PRO   5  10.251   5.766  -6.818
   40   2HD   PRO   5          1HD       PRO   5  11.245   6.313  -5.451
   41    H    TYR   6           H        TYR   6   9.013   3.227  -6.724
   42    HA   TYR   6           HA       TYR   6   9.625   1.287  -8.864
   43   1HB   TYR   6          2HB       TYR   6   7.220   0.830  -7.095
   44   2HB   TYR   6          1HB       TYR   6   7.901  -0.255  -8.309
   45    HD1  TYR   6           HD1      TYR   6   9.812  -1.645  -7.824
   46    HD2  TYR   6           HD2      TYR   6   8.417   1.234  -4.961
   47    HE1  TYR   6           HE1      TYR   6  11.275  -2.656  -6.095
   48    HE2  TYR   6           HE2      TYR   6   9.879   0.224  -3.233
   49    HH   TYR   6           HH       TYR   6  11.912  -2.610  -3.976
   50    H    SER   7           H        SER   7   8.122   1.423 -10.623
   51    HA   SER   7           HA       SER   7   7.106   3.952 -11.249
   52   1HB   SER   7          2HB       SER   7   6.404   1.179 -12.168
   53   2HB   SER   7          1HB       SER   7   5.445   2.546 -12.728
   54    HG   SER   7           HG       SER   7   8.255   2.644 -12.815
   55    H    TYR   8           H        TYR   8   4.584   4.330 -11.601
   56    HA   TYR   8           HA       TYR   8   3.411   4.020  -8.933
   57   1HB   TYR   8          2HB       TYR   8   2.744   5.629 -11.356
   58   2HB   TYR   8          1HB       TYR   8   1.461   5.286 -10.190
   59    HD1  TYR   8           HD1      TYR   8   1.214   7.401  -9.066
   60    HD2  TYR   8           HD2      TYR   8   5.090   5.608  -9.516
   61    HE1  TYR   8           HE1      TYR   8   2.170   9.058  -7.485
   62    HE2  TYR   8           HE2      TYR   8   6.046   7.264  -7.941
   63    HH   TYR   8           HH       TYR   8   4.648  10.062  -7.158
   64    H    ALA   9           H        ALA   9   3.266   1.745  -9.016
   65    HA   ALA   9           HA       ALA   9   0.695   0.698  -9.590
   66   1HB   ALA   9          1HB       ALA   9   2.333  -0.883 -11.363
   67   2HB   ALA   9          2HB       ALA   9   2.385   0.804 -11.873
   68   3HB   ALA   9          3HB       ALA   9   0.835  -0.024 -11.725
   69    H    GLN  10           H        GLN  10   4.124   0.207  -9.062
   70    HA   GLN  10           HA       GLN  10   3.829  -2.487  -7.968
   71   1HB   GLN  10          2HB       GLN  10   6.046  -0.572  -8.485
   72   2HB   GLN  10          1HB       GLN  10   6.285  -1.702  -7.153
   73   1HG   GLN  10          2HG       GLN  10   5.680  -3.574  -8.703
   74   2HG   GLN  10          1HG       GLN  10   5.619  -2.406 -10.025
   75   1HE2  GLN  10          1HE2      GLN  10   7.549  -2.298 -11.172
   76   2HE2  GLN  10          2HE2      GLN  10   9.090  -2.590 -10.524
   77    H    LEU  11           H        LEU  11   4.131   0.831  -6.747
   78    HA   LEU  11           HA       LEU  11   4.549   0.212  -4.000
   79   1HB   LEU  11          2HB       LEU  11   2.535   2.343  -4.340
   80   2HB   LEU  11          1HB       LEU  11   4.077   2.401  -3.503
   81    HG   LEU  11           HG       LEU  11   4.301   3.936  -5.253
   82   1HD1  LEU  11          1HD1      LEU  11   6.296   3.082  -5.797
   83   2HD1  LEU  11          2HD1      LEU  11   5.520   2.030  -6.979
   84   3HD1  LEU  11          3HD1      LEU  11   5.751   1.475  -5.322
   85   1HD2  LEU  11          1HD2      LEU  11   3.783   2.793  -7.650
   86   2HD2  LEU  11          2HD2      LEU  11   2.596   3.728  -6.742
   87   3HD2  LEU  11          3HD2      LEU  11   2.597   1.966  -6.645
   88    H    ILE  12           H        ILE  12   1.845  -0.149  -6.135
   89    HA   ILE  12           HA       ILE  12   0.049  -0.659  -3.883
   90    HB   ILE  12           HB       ILE  12  -0.599  -1.351  -6.723
   91   1HG1  ILE  12          2HG1      ILE  12   0.062   1.282  -5.771
   92   2HG1  ILE  12          1HG1      ILE  12  -0.511   0.806  -7.363
   93   1HG2  ILE  12          1HG2      ILE  12  -2.893  -0.788  -5.846
   94   2HG2  ILE  12          2HG2      ILE  12  -2.163  -0.580  -4.257
   95   3HG2  ILE  12          3HG2      ILE  12  -2.119  -2.156  -5.048
   96   1HD1  ILE  12          1HD1      ILE  12  -2.163   2.308  -6.718
   97   2HD1  ILE  12          2HD1      ILE  12  -2.090   1.827  -5.029
   98   3HD1  ILE  12          3HD1      ILE  12  -2.875   0.785  -6.201
   99    H    VAL  13           H        VAL  13   1.388  -2.564  -6.609
  100    HA   VAL  13           HA       VAL  13   0.375  -5.069  -5.906
  101    HB   VAL  13           HB       VAL  13   3.134  -4.399  -6.974
  102   1HG1  VAL  13          1HG1      VAL  13   1.686  -6.968  -6.491
  103   2HG1  VAL  13          2HG1      VAL  13   3.412  -6.619  -6.398
  104   3HG1  VAL  13          3HG1      VAL  13   2.638  -6.827  -7.969
  105   1HG2  VAL  13          1HG2      VAL  13   1.972  -5.079  -9.144
  106   2HG2  VAL  13          2HG2      VAL  13   1.441  -3.549  -8.445
  107   3HG2  VAL  13          3HG2      VAL  13   0.453  -4.997  -8.249
  108    H    GLN  14           H        GLN  14   3.697  -4.030  -4.986
  109    HA   GLN  14           HA       GLN  14   4.045  -6.034  -3.012
  110   1HB   GLN  14          2HB       GLN  14   5.423  -3.657  -3.870
  111   2HB   GLN  14          1HB       GLN  14   5.377  -3.692  -2.108
  112   1HG   GLN  14          2HG       GLN  14   6.453  -5.807  -2.014
  113   2HG   GLN  14          1HG       GLN  14   6.167  -6.117  -3.727
  114   1HE2  GLN  14          1HE2      GLN  14   7.825  -3.666  -1.652
  115   2HE2  GLN  14          2HE2      GLN  14   9.129  -3.437  -2.714
  116    H    ALA  15           H        ALA  15   2.195  -3.112  -2.979
  117    HA   ALA  15           HA       ALA  15   2.030  -2.775  -0.122
  118   1HB   ALA  15          1HB       ALA  15   0.705  -1.658  -2.524
  119   2HB   ALA  15          2HB       ALA  15   1.379  -0.826  -1.128
  120   3HB   ALA  15          3HB       ALA  15  -0.219  -1.564  -1.028
  121    H    ILE  16           H        ILE  16  -0.493  -3.953  -2.388
  122    HA   ILE  16           HA       ILE  16  -1.979  -5.119  -0.160
  123    HB   ILE  16           HB       ILE  16  -3.067  -6.021  -2.636
  124   1HG1  ILE  16          2HG1      ILE  16  -2.126  -3.141  -2.664
  125   2HG1  ILE  16          1HG1      ILE  16  -1.940  -4.354  -3.933
  126   1HG2  ILE  16          1HG2      ILE  16  -4.124  -5.316  -0.400
  127   2HG2  ILE  16          2HG2      ILE  16  -4.978  -4.849  -1.872
  128   3HG2  ILE  16          3HG2      ILE  16  -4.004  -3.664  -1.007
  129   1HD1  ILE  16          1HD1      ILE  16  -4.610  -4.353  -3.796
  130   2HD1  ILE  16          2HD1      ILE  16  -3.735  -3.196  -4.798
  131   3HD1  ILE  16          3HD1      ILE  16  -4.329  -2.715  -3.210
  132    H    SER  17           H        SER  17  -0.401  -6.416  -3.102
  133    HA   SER  17           HA       SER  17  -0.888  -9.155  -2.563
  134   1HB   SER  17          2HB       SER  17   0.872  -9.631  -4.120
  135   2HB   SER  17          1HB       SER  17   0.067  -8.173  -4.693
  136    HG   SER  17           HG       SER  17   2.235  -7.761  -4.727
  137    H    SER  18           H        SER  18   1.874  -7.127  -1.580
  138    HA   SER  18           HA       SER  18   3.173  -9.325  -0.186
  139   1HB   SER  18          2HB       SER  18   4.114  -6.994  -1.138
  140   2HB   SER  18          1HB       SER  18   3.827  -6.509   0.531
  141    HG   SER  18           HG       SER  18   5.085  -8.959   0.054
  142    H    ALA  19           H        ALA  19   0.467  -7.502   0.580
  143    HA   ALA  19           HA       ALA  19   1.017  -7.682   3.508
  144   1HB   ALA  19          1HB       ALA  19  -0.582  -5.883   1.809
  145   2HB   ALA  19          2HB       ALA  19   0.122  -5.593   3.399
  146   3HB   ALA  19          3HB       ALA  19  -1.423  -6.430   3.260
  147    H    GLN  20           H        GLN  20  -0.237  -9.075   4.786
  148    HA   GLN  20           HA       GLN  20  -1.409 -11.367   3.761
  149   1HB   GLN  20          2HB       GLN  20  -2.937 -11.217   5.886
  150   2HB   GLN  20          1HB       GLN  20  -1.192 -11.359   6.100
  151   1HG   GLN  20          2HG       GLN  20  -1.057  -9.320   7.059
  152   2HG   GLN  20          1HG       GLN  20  -2.020  -8.581   5.779
  153   1HE2  GLN  20          1HE2      GLN  20  -2.373  -7.911   8.569
  154   2HE2  GLN  20          2HE2      GLN  20  -3.920  -8.434   9.036
  155    H    ASP  21           H        ASP  21  -2.789  -8.158   4.003
  156    HA   ASP  21           HA       ASP  21  -5.424  -9.099   3.054
  157   1HB   ASP  21          2HB       ASP  21  -4.325  -6.608   4.228
  158   2HB   ASP  21          1HB       ASP  21  -5.607  -6.390   3.036
  159    H    ARG  22           H        ARG  22  -5.171  -9.700   0.885
  160    HA   ARG  22           HA       ARG  22  -3.513  -8.355  -1.011
  161   1HB   ARG  22          2HB       ARG  22  -5.720 -10.347  -1.122
  162   2HB   ARG  22          1HB       ARG  22  -5.380  -9.461  -2.608
  163   1HG   ARG  22          2HG       ARG  22  -3.309 -10.413  -2.867
  164   2HG   ARG  22          1HG       ARG  22  -3.026 -10.519  -1.129
  165   1HD   ARG  22          2HD       ARG  22  -3.305 -12.770  -1.958
  166   2HD   ARG  22          1HD       ARG  22  -4.754 -12.356  -1.041
  167    HE   ARG  22           HE       ARG  22  -4.867 -11.881  -3.957
  168   1HH1  ARG  22          1HH2      ARG  22  -7.350 -12.055  -2.391
  169   2HH1  ARG  22          2HH2      ARG  22  -7.870 -13.686  -2.656
  170   1HH2  ARG  22          1HH1      ARG  22  -4.778 -14.766  -3.799
  171   2HH2  ARG  22          2HH1      ARG  22  -6.414 -15.221  -3.453
  172    H    GLN  23           H        GLN  23  -6.351  -7.289   0.475
  173    HA   GLN  23           HA       GLN  23  -6.857  -5.374  -1.766
  174   1HB   GLN  23          2HB       GLN  23  -9.178  -5.197  -0.583
  175   2HB   GLN  23          1HB       GLN  23  -8.856  -6.603  -1.599
  176   1HG   GLN  23          2HG       GLN  23  -8.812  -8.039   0.171
  177   2HG   GLN  23          1HG       GLN  23  -8.008  -6.874   1.223
  178   1HE2  GLN  23          1HE2      GLN  23  -9.413  -6.732   3.010
  179   2HE2  GLN  23          2HE2      GLN  23 -11.067  -6.371   2.894
  180    H    LEU  24           H        LEU  24  -6.021  -3.412  -1.188
  181    HA   LEU  24           HA       LEU  24  -6.154  -2.646   1.696
  182   1HB   LEU  24          2HB       LEU  24  -4.224  -1.880  -0.504
  183   2HB   LEU  24          1HB       LEU  24  -4.308  -1.031   1.035
  184    HG   LEU  24           HG       LEU  24  -4.002  -4.024   0.942
  185   1HD1  LEU  24          1HD1      LEU  24  -1.810  -1.928   0.868
  186   2HD1  LEU  24          2HD1      LEU  24  -2.163  -3.112  -0.390
  187   3HD1  LEU  24          3HD1      LEU  24  -1.555  -3.645   1.177
  188   1HD2  LEU  24          1HD2      LEU  24  -4.615  -2.585   3.030
  189   2HD2  LEU  24          2HD2      LEU  24  -2.922  -2.092   2.985
  190   3HD2  LEU  24          3HD2      LEU  24  -3.340  -3.794   3.185
  191    H    THR  25           H        THR  25  -6.877  -0.535   2.203
  192    HA   THR  25           HA       THR  25  -8.723   0.629   0.254
  193    HB   THR  25           HB       THR  25  -9.115   0.535   2.775
  194    HG1  THR  25           HG1      THR  25 -10.191   1.979   1.281
  195   1HG2  THR  25          1HG2      THR  25  -7.776   1.664   4.216
  196   2HG2  THR  25          2HG2      THR  25  -7.619   3.046   3.132
  197   3HG2  THR  25          3HG2      THR  25  -6.601   1.625   2.901
  198    H    LEU  26           H        LEU  26  -8.497   3.264   0.241
  199    HA   LEU  26           HA       LEU  26  -6.184   3.807  -1.320
  200   1HB   LEU  26          2HB       LEU  26  -8.246   5.516   0.032
  201   2HB   LEU  26          1HB       LEU  26  -6.796   6.285  -0.616
  202    HG   LEU  26           HG       LEU  26  -7.308   4.909  -2.771
  203   1HD1  LEU  26          1HD1      LEU  26  -9.940   4.786  -2.902
  204   2HD1  LEU  26          2HD1      LEU  26  -9.818   4.643  -1.148
  205   3HD1  LEU  26          3HD1      LEU  26  -9.030   3.455  -2.187
  206   1HD2  LEU  26          1HD2      LEU  26  -9.281   7.099  -2.088
  207   2HD2  LEU  26          2HD2      LEU  26  -8.538   6.752  -3.649
  208   3HD2  LEU  26          3HD2      LEU  26  -7.568   7.435  -2.344
  209    H    SER  27           H        SER  27  -6.882   4.672   2.086
  210    HA   SER  27           HA       SER  27  -4.110   5.553   2.477
  211   1HB   SER  27          2HB       SER  27  -6.350   6.417   3.613
  212   2HB   SER  27          1HB       SER  27  -5.989   5.133   4.761
  213    HG   SER  27           HG       SER  27  -4.688   6.571   5.582
  214    H    GLY  28           H        GLY  28  -4.861   2.627   1.885
  215   1HA   GLY  28          2HA       GLY  28  -3.740   1.389   4.365
  216   2HA   GLY  28          1HA       GLY  28  -4.568   0.504   3.076
  217    H    ILE  29           H        ILE  29  -3.450   1.451   0.869
  218    HA   ILE  29           HA       ILE  29  -1.011   0.083   0.561
  219    HB   ILE  29           HB       ILE  29  -2.700   0.801  -1.169
  220   1HG1  ILE  29          2HG1      ILE  29   0.269   1.000  -1.409
  221   2HG1  ILE  29          1HG1      ILE  29  -0.841  -0.145  -2.162
  222   1HG2  ILE  29          1HG2      ILE  29  -2.894   2.967  -1.849
  223   2HG2  ILE  29          2HG2      ILE  29  -1.200   3.331  -1.525
  224   3HG2  ILE  29          3HG2      ILE  29  -2.363   3.282  -0.200
  225   1HD1  ILE  29          1HD1      ILE  29  -1.699   2.153  -3.295
  226   2HD1  ILE  29          2HD1      ILE  29  -0.465   1.122  -4.012
  227   3HD1  ILE  29          3HD1      ILE  29   0.006   2.538  -3.075
  228    H    TYR  30           H        TYR  30  -1.743   3.336   1.502
  229    HA   TYR  30           HA       TYR  30   0.912   4.397   1.096
  230   1HB   TYR  30          2HB       TYR  30  -1.232   5.439   2.954
  231   2HB   TYR  30          1HB       TYR  30   0.105   6.352   2.250
  232    HD1  TYR  30           HD1      TYR  30  -2.953   6.887   1.937
  233    HD2  TYR  30           HD2      TYR  30  -0.071   4.810  -0.474
  234    HE1  TYR  30           HE1      TYR  30  -4.336   7.294  -0.077
  235    HE2  TYR  30           HE2      TYR  30  -1.448   5.221  -2.486
  236    HH   TYR  30           HH       TYR  30  -4.672   6.512  -2.266
  237    H    ALA  31           H        ALA  31  -0.837   3.317   4.009
  238    HA   ALA  31           HA       ALA  31   1.459   3.654   5.726
  239   1HB   ALA  31          1HB       ALA  31  -0.742   1.674   6.274
  240   2HB   ALA  31          2HB       ALA  31  -1.071   3.405   6.345
  241   3HB   ALA  31          3HB       ALA  31   0.139   2.693   7.412
  242    H    HIS  32           H        HIS  32   0.572   1.281   3.390
  243    HA   HIS  32           HA       HIS  32   2.038  -0.922   4.608
  244   1HB   HIS  32          2HB       HIS  32   0.162  -1.307   3.042
  245   2HB   HIS  32          1HB       HIS  32   1.092  -0.542   1.751
  246    HD1  HIS  32           HD1      HIS  32   0.318  -3.786   2.905
  247    HD2  HIS  32           HD2      HIS  32   3.867  -1.973   1.687
  248    HE1  HIS  32           HE1      HIS  32   1.921  -5.662   2.330
  249    H    ILE  33           H        ILE  33   2.630   0.642   1.450
  250    HA   ILE  33           HA       ILE  33   5.341  -0.182   1.268
  251    HB   ILE  33           HB       ILE  33   5.533   1.597  -0.454
  252   1HG1  ILE  33          2HG1      ILE  33   3.036   2.593  -0.819
  253   2HG1  ILE  33          1HG1      ILE  33   3.092   2.502   0.943
  254   1HG2  ILE  33          1HG2      ILE  33   4.678  -0.245  -1.518
  255   2HG2  ILE  33          2HG2      ILE  33   3.237   0.767  -1.631
  256   3HG2  ILE  33          3HG2      ILE  33   3.374  -0.435  -0.348
  257   1HD1  ILE  33          1HD1      ILE  33   4.702   4.178  -0.919
  258   2HD1  ILE  33          2HD1      ILE  33   5.528   3.552   0.508
  259   3HD1  ILE  33          3HD1      ILE  33   4.092   4.558   0.691
  260    H    THR  34           H        THR  34   3.928   2.657   2.785
  261    HA   THR  34           HA       THR  34   6.221   4.287   2.972
  262    HB   THR  34           HB       THR  34   5.159   5.052   5.196
  263    HG1  THR  34           HG1      THR  34   3.996   2.811   5.064
  264   1HG2  THR  34          1HG2      THR  34   4.038   5.168   2.453
  265   2HG2  THR  34          2HG2      THR  34   4.533   6.478   3.525
  266   3HG2  THR  34          3HG2      THR  34   2.969   5.696   3.752
  267    H    LYS  35           H        LYS  35   5.488   1.292   4.562
  268    HA   LYS  35           HA       LYS  35   7.579   1.666   6.603
  269   1HB   LYS  35          2HB       LYS  35   5.296   0.217   6.636
  270   2HB   LYS  35          1HB       LYS  35   6.426  -1.028   6.104
  271   1HG   LYS  35          2HG       LYS  35   6.803   0.728   8.547
  272   2HG   LYS  35          1HG       LYS  35   6.242  -0.944   8.581
  273   1HD   LYS  35          2HD       LYS  35   8.389  -1.530   7.310
  274   2HD   LYS  35          1HD       LYS  35   8.947   0.093   7.718
  275   1HE   LYS  35          2HE       LYS  35   7.856  -1.668   9.890
  276   2HE   LYS  35          1HE       LYS  35   9.505  -1.924   9.320
  277   1HZ   LYS  35          1HZ       LYS  35   9.157  -0.303  11.231
  278   2HZ   LYS  35          2HZ       LYS  35   8.529   0.762  10.066
  279   3HZ   LYS  35          3HZ       LYS  35  10.133   0.213   9.943
  280    H    HIS  36           H        HIS  36   7.157   0.111   3.481
  281    HA   HIS  36           HA       HIS  36   9.721  -1.324   3.713
  282   1HB   HIS  36          2HB       HIS  36   7.632  -1.120   1.538
  283   2HB   HIS  36          1HB       HIS  36   9.164  -1.962   1.300
  284    HD1  HIS  36           HD1      HIS  36   9.660  -3.952   3.078
  285    HD2  HIS  36           HD2      HIS  36   5.715  -2.621   2.882
  286    HE1  HIS  36           HE1      HIS  36   8.247  -5.733   4.193
  287    H    TYR  37           H        TYR  37   8.428   0.946   1.243
  288    HA   TYR  37           HA       TYR  37  11.137   1.667   0.445
  289   1HB   TYR  37          2HB       TYR  37   8.669   3.219  -0.305
  290   2HB   TYR  37          1HB       TYR  37  10.127   2.962  -1.254
  291    HD1  TYR  37           HD1      TYR  37   7.318   2.506  -2.248
  292    HD2  TYR  37           HD2      TYR  37  10.113  -0.136  -0.336
  293    HE1  TYR  37           HE1      TYR  37   6.235   0.572  -3.344
  294    HE2  TYR  37           HE2      TYR  37   9.022  -2.078  -1.435
  295    HH   TYR  37           HH       TYR  37   6.514  -1.631  -3.870
  296    HA   PRO  38           HA       PRO  38  11.488   4.885   3.478
  297   1HB   PRO  38          2HB       PRO  38  13.876   5.891   2.565
  298   2HB   PRO  38          1HB       PRO  38  13.739   4.404   3.520
  299   1HG   PRO  38          2HG       PRO  38  14.279   4.718   0.605
  300   2HG   PRO  38          1HG       PRO  38  14.726   3.394   1.693
  301   1HD   PRO  38          2HD       PRO  38  12.574   3.381  -0.153
  302   2HD   PRO  38          1HD       PRO  38  12.848   2.200   1.146
  303    H    TYR  39           H        TYR  39  11.958   5.590   0.014
  304    HA   TYR  39           HA       TYR  39  11.806   8.424   0.183
  305   1HB   TYR  39          2HB       TYR  39  12.487   7.280  -1.877
  306   2HB   TYR  39          1HB       TYR  39  10.869   6.594  -2.048
  307    HD1  TYR  39           HD1      TYR  39   9.185   7.790  -3.173
  308    HD2  TYR  39           HD2      TYR  39  12.677   9.859  -1.768
  309    HE1  TYR  39           HE1      TYR  39   8.430   9.850  -4.331
  310    HE2  TYR  39           HE2      TYR  39  11.924  11.918  -2.926
  311    HH   TYR  39           HH       TYR  39   9.384  12.774  -3.680
  312    H    TYR  40           H        TYR  40   9.254   5.967  -0.016
  313    HA   TYR  40           HA       TYR  40   7.153   8.025  -0.080
  314   1HB   TYR  40          2HB       TYR  40   7.247   5.034  -0.179
  315   2HB   TYR  40          1HB       TYR  40   5.750   5.802   0.350
  316    HD1  TYR  40           HD1      TYR  40   5.629   8.250  -1.223
  317    HD2  TYR  40           HD2      TYR  40   6.913   4.322  -2.396
  318    HE1  TYR  40           HE1      TYR  40   5.062   8.766  -3.579
  319    HE2  TYR  40           HE2      TYR  40   6.345   4.839  -4.750
  320    HH   TYR  40           HH       TYR  40   6.093   7.596  -6.014
  321    H    ARG  41           H        ARG  41   8.747   8.405   2.156
  322    HA   ARG  41           HA       ARG  41   7.101   7.304   4.394
  323   1HB   ARG  41          2HB       ARG  41   9.421   6.685   4.643
  324   2HB   ARG  41          1HB       ARG  41   9.949   8.339   4.331
  325   1HG   ARG  41          2HG       ARG  41   9.439   9.043   6.444
  326   2HG   ARG  41          1HG       ARG  41   8.015   8.008   6.554
  327   1HD   ARG  41          2HD       ARG  41   9.393   6.060   6.985
  328   2HD   ARG  41          1HD       ARG  41  10.865   6.986   6.693
  329    HE   ARG  41           HE       ARG  41   9.197   8.062   8.845
  330   1HH1  ARG  41          1HH2      ARG  41  11.425   5.578   8.021
  331   2HH1  ARG  41          2HH2      ARG  41  12.269   5.644   9.532
  332   1HH2  ARG  41          1HH1      ARG  41  10.402   8.295  10.761
  333   2HH2  ARG  41          2HH1      ARG  41  11.690   7.182  11.083
  334    H    THR  42           H        THR  42   9.092  10.237   3.844
  335    HA   THR  42           HA       THR  42   7.120  11.802   5.390
  336    HB   THR  42           HB       THR  42   8.992  13.603   4.486
  337    HG1  THR  42           HG1      THR  42  10.631  12.519   3.804
  338   1HG2  THR  42          1HG2      THR  42  10.022  13.318   6.716
  339   2HG2  THR  42          2HG2      THR  42   9.165  11.789   6.908
  340   3HG2  THR  42          3HG2      THR  42   8.261  13.299   6.811
  341    H    ALA  43           H        ALA  43   8.528  11.781   2.111
  342    HA   ALA  43           HA       ALA  43   6.802  13.915   1.165
  343   1HB   ALA  43          1HB       ALA  43   7.899  12.013  -0.818
  344   2HB   ALA  43          2HB       ALA  43   9.097  12.777   0.226
  345   3HB   ALA  43          3HB       ALA  43   8.023  13.771  -0.757
  346    H    ASP  44           H        ASP  44   4.600  13.572   0.989
  347    HA   ASP  44           HA       ASP  44   3.713  11.112  -0.413
  348   1HB   ASP  44          2HB       ASP  44   1.890  10.814   1.302
  349   2HB   ASP  44          1HB       ASP  44   3.511  10.484   1.912
  350    H    LYS  45           H        LYS  45   3.725  14.324  -0.454
  351    HA   LYS  45           HA       LYS  45   0.844  14.754  -0.945
  352   1HB   LYS  45          2HB       LYS  45   3.251  16.485  -0.629
  353   2HB   LYS  45          1HB       LYS  45   1.942  17.104  -1.637
  354   1HG   LYS  45          2HG       LYS  45   1.142  15.884   0.952
  355   2HG   LYS  45          1HG       LYS  45   1.988  17.429   1.041
  356   1HD   LYS  45          2HD       LYS  45  -0.131  17.270  -1.019
  357   2HD   LYS  45          1HD       LYS  45  -0.696  17.208   0.652
  358   1HE   LYS  45          2HE       LYS  45  -0.636  19.512   0.236
  359   2HE   LYS  45          1HE       LYS  45   0.927  19.232   1.003
  360   1HZ   LYS  45          1HZ       LYS  45   0.531  20.390  -1.423
  361   2HZ   LYS  45          2HZ       LYS  45   0.987  18.804  -1.827
  362   3HZ   LYS  45          3HZ       LYS  45   1.999  19.762  -0.855
  363    H    GLY  46           H        GLY  46   1.222  13.026  -2.775
  364   1HA   GLY  46          2HA       GLY  46   0.989  14.345  -5.287
  365   2HA   GLY  46          1HA       GLY  46   2.633  13.713  -5.149
  366    H    TRP  47           H        TRP  47   2.494  11.308  -4.101
  367    HA   TRP  47           HA       TRP  47   1.019   9.768  -6.094
  368   1HB   TRP  47          2HB       TRP  47   2.216   7.881  -5.310
  369   2HB   TRP  47          1HB       TRP  47   3.346   9.225  -5.193
  370    HD1  TRP  47           HD1      TRP  47   3.141  10.510  -2.599
  371    HE1  TRP  47           HE1      TRP  47   3.260   9.291  -0.335
  372    HE3  TRP  47           HE3      TRP  47   1.840   5.792  -4.065
  373    HZ2  TRP  47           HZ2      TRP  47   2.868   6.662   0.715
  374    HZ3  TRP  47           HZ3      TRP  47   1.734   3.951  -2.416
  375    HH2  TRP  47           HH2      TRP  47   2.247   4.382  -0.033
  376    H    GLN  48           H        GLN  48  -0.012  11.181  -3.337
  377    HA   GLN  48           HA       GLN  48  -1.414   9.042  -2.024
  378   1HB   GLN  48          2HB       GLN  48  -1.056  11.748  -1.548
  379   2HB   GLN  48          1HB       GLN  48  -2.762  11.653  -1.981
  380   1HG   GLN  48          2HG       GLN  48  -2.562  11.325   0.417
  381   2HG   GLN  48          1HG       GLN  48  -3.017   9.787  -0.320
  382   1HE2  GLN  48          1HE2      GLN  48  -1.433   8.064  -0.330
  383   2HE2  GLN  48          2HE2      GLN  48   0.020   8.170   0.540
  384    H    ASN  49           H        ASN  49  -2.825  11.648  -4.036
  385    HA   ASN  49           HA       ASN  49  -5.166  10.050  -4.663
  386   1HB   ASN  49          2HB       ASN  49  -4.089  12.633  -5.828
  387   2HB   ASN  49          1HB       ASN  49  -5.632  11.916  -6.295
  388   1HD2  ASN  49          1HD2      ASN  49  -5.157  14.509  -4.848
  389   2HD2  ASN  49          2HD2      ASN  49  -6.006  14.373  -3.384
  390    H    SER  50           H        SER  50  -1.984  10.174  -5.879
  391    HA   SER  50           HA       SER  50  -2.542   9.524  -8.638
  392   1HB   SER  50          2HB       SER  50  -0.266   9.432  -8.900
  393   2HB   SER  50          1HB       SER  50  -0.277  10.254  -7.345
  394    HG   SER  50           HG       SER  50  -0.040   8.234  -6.350
  395    H    ILE  51           H        ILE  51  -1.727   7.525  -5.786
  396    HA   ILE  51           HA       ILE  51  -1.717   5.012  -7.079
  397    HB   ILE  51           HB       ILE  51  -1.868   6.011  -4.344
  398   1HG1  ILE  51          2HG1      ILE  51  -0.417   4.134  -3.931
  399   2HG1  ILE  51          1HG1      ILE  51  -0.933   3.343  -5.412
  400   1HG2  ILE  51          1HG2      ILE  51  -3.917   4.942  -3.941
  401   2HG2  ILE  51          2HG2      ILE  51  -2.749   3.689  -3.526
  402   3HG2  ILE  51          3HG2      ILE  51  -3.573   3.640  -5.081
  403   1HD1  ILE  51          1HD1      ILE  51   0.339   6.067  -5.469
  404   2HD1  ILE  51          2HD1      ILE  51   0.174   4.905  -6.785
  405   3HD1  ILE  51          3HD1      ILE  51   1.313   4.598  -5.474
  406    H    ARG  52           H        ARG  52  -4.474   6.602  -5.429
  407    HA   ARG  52           HA       ARG  52  -6.460   4.719  -5.989
  408   1HB   ARG  52          2HB       ARG  52  -6.907   6.676  -4.612
  409   2HB   ARG  52          1HB       ARG  52  -6.666   7.744  -5.994
  410   1HG   ARG  52          2HG       ARG  52  -8.563   6.130  -7.027
  411   2HG   ARG  52          1HG       ARG  52  -8.990   6.014  -5.320
  412   1HD   ARG  52          2HD       ARG  52  -9.712   8.165  -5.230
  413   2HD   ARG  52          1HD       ARG  52  -8.383   8.751  -6.230
  414    HE   ARG  52           HE       ARG  52  -9.829   8.614  -8.079
  415   1HH1  ARG  52          1HH1      ARG  52 -11.744   7.977  -5.505
  416   2HH1  ARG  52          2HH1      ARG  52 -12.813   6.867  -6.295
  417   1HH2  ARG  52          1HH2      ARG  52 -10.830   6.567  -9.126
  418   2HH2  ARG  52          2HH2      ARG  52 -12.295   6.069  -8.348
  419    H    HIS  53           H        HIS  53  -5.666   7.552  -8.023
  420    HA   HIS  53           HA       HIS  53  -7.342   6.719 -10.206
  421   1HB   HIS  53          2HB       HIS  53  -6.697   9.047  -9.952
  422   2HB   HIS  53          1HB       HIS  53  -4.990   8.628 -10.084
  423    HD1  HIS  53           HD1      HIS  53  -4.167   7.753 -12.457
  424    HD2  HIS  53           HD2      HIS  53  -8.029   9.321 -12.403
  425    HE1  HIS  53           HE1      HIS  53  -4.807   8.162 -14.873
  426    H    ASN  54           H        ASN  54  -4.210   5.705  -9.190
  427    HA   ASN  54           HA       ASN  54  -3.193   4.909 -11.779
  428   1HB   ASN  54          2HB       ASN  54  -2.348   4.727  -8.993
  429   2HB   ASN  54          1HB       ASN  54  -1.981   3.251  -9.892
  430   1HD2  ASN  54          1HD2      ASN  54  -0.938   6.475  -9.326
  431   2HD2  ASN  54          2HD2      ASN  54   0.191   6.576 -10.587
  432    H    LEU  55           H        LEU  55  -4.985   3.254  -9.202
  433    HA   LEU  55           HA       LEU  55  -4.863   0.663 -10.445
  434   1HB   LEU  55          2HB       LEU  55  -6.942   1.708  -8.506
  435   2HB   LEU  55          1HB       LEU  55  -6.534   0.017  -8.809
  436    HG   LEU  55           HG       LEU  55  -4.627   2.110  -7.708
  437   1HD1  LEU  55          1HD1      LEU  55  -6.285   1.487  -6.039
  438   2HD1  LEU  55          2HD1      LEU  55  -4.750   0.718  -5.640
  439   3HD1  LEU  55          3HD1      LEU  55  -6.041  -0.225  -6.386
  440   1HD2  LEU  55          1HD2      LEU  55  -3.866  -0.668  -7.391
  441   2HD2  LEU  55          2HD2      LEU  55  -2.967   0.647  -8.144
  442   3HD2  LEU  55          3HD2      LEU  55  -4.118  -0.292  -9.092
  443    H    SER  56           H        SER  56  -6.393   3.416 -11.509
  444    HA   SER  56           HA       SER  56  -8.807   2.094 -12.549
  445   1HB   SER  56          2HB       SER  56  -8.506   4.616 -11.890
  446   2HB   SER  56          1HB       SER  56  -7.780   4.764 -13.488
  447    HG   SER  56           HG       SER  56  -9.693   3.927 -14.365
  448    H    LEU  57           H        LEU  57  -5.604   3.056 -13.651
  449    HA   LEU  57           HA       LEU  57  -6.206   2.239 -16.427
  450   1HB   LEU  57          2HB       LEU  57  -3.520   3.054 -15.297
  451   2HB   LEU  57          1HB       LEU  57  -4.048   3.103 -16.981
  452    HG   LEU  57           HG       LEU  57  -5.917   4.616 -15.449
  453   1HD1  LEU  57          1HD1      LEU  57  -3.639   6.261 -15.065
  454   2HD1  LEU  57          2HD1      LEU  57  -3.255   4.694 -14.352
  455   3HD1  LEU  57          3HD1      LEU  57  -4.688   5.575 -13.824
  456   1HD2  LEU  57          1HD2      LEU  57  -5.722   5.805 -17.354
  457   2HD2  LEU  57          2HD2      LEU  57  -4.378   4.769 -17.834
  458   3HD2  LEU  57          3HD2      LEU  57  -4.070   6.251 -16.929
  459    H    ASN  58           H        ASN  58  -3.810   1.327 -13.914
  460    HA   ASN  58           HA       ASN  58  -2.610  -0.854 -15.101
  461   1HB   ASN  58          2HB       ASN  58  -3.569  -0.568 -12.242
  462   2HB   ASN  58          1HB       ASN  58  -2.532  -1.888 -12.785
  463   1HD2  ASN  58          1HD2      ASN  58  -2.447   1.239 -11.502
  464   2HD2  ASN  58          2HD2      ASN  58  -0.861   1.655 -11.942
  465    H    ARG  59           H        ARG  59  -3.172  -2.973 -15.591
  466    HA   ARG  59           HA       ARG  59  -6.066  -3.554 -15.577
  467   1HB   ARG  59          2HB       ARG  59  -5.450  -5.465 -17.021
  468   2HB   ARG  59          1HB       ARG  59  -4.795  -3.950 -17.644
  469   1HG   ARG  59          2HG       ARG  59  -2.815  -4.850 -15.913
  470   2HG   ARG  59          1HG       ARG  59  -3.384  -6.325 -16.695
  471   1HD   ARG  59          2HD       ARG  59  -3.117  -4.131 -18.596
  472   2HD   ARG  59          1HD       ARG  59  -1.594  -4.478 -17.778
  473    HE   ARG  59           HE       ARG  59  -2.054  -6.922 -18.494
  474   1HH1  ARG  59          1HH1      ARG  59  -4.635  -6.245 -19.900
  475   2HH1  ARG  59          2HH1      ARG  59  -4.113  -6.102 -21.545
  476   1HH2  ARG  59          1HH2      ARG  59  -0.752  -5.832 -20.735
  477   2HH2  ARG  59          2HH2      ARG  59  -1.915  -5.869 -22.018
  478    H    TYR  60           H        TYR  60  -3.422  -4.200 -13.549
  479    HA   TYR  60           HA       TYR  60  -4.722  -6.712 -12.597
  480   1HB   TYR  60          2HB       TYR  60  -2.539  -7.025 -11.327
  481   2HB   TYR  60          1HB       TYR  60  -2.447  -7.178 -13.076
  482    HD1  TYR  60           HD1      TYR  60  -1.633  -5.216 -14.438
  483    HD2  TYR  60           HD2      TYR  60  -1.314  -5.343 -10.157
  484    HE1  TYR  60           HE1      TYR  60   0.096  -3.448 -14.518
  485    HE2  TYR  60           HE2      TYR  60   0.414  -3.574 -10.238
  486    HH   TYR  60           HH       TYR  60   0.911  -1.596 -12.724
  487    H    PHE  61           H        PHE  61  -5.858  -4.189 -11.929
  488    HA   PHE  61           HA       PHE  61  -5.632  -4.390  -8.984
  489   1HB   PHE  61          2HB       PHE  61  -5.104  -1.901 -10.593
  490   2HB   PHE  61          1HB       PHE  61  -5.747  -1.792  -8.952
  491    HD1  PHE  61           HD1      PHE  61  -4.490  -3.668  -7.314
  492    HD2  PHE  61           HD2      PHE  61  -2.808  -1.658 -10.716
  493    HE1  PHE  61           HE1      PHE  61  -2.220  -4.039  -6.424
  494    HE2  PHE  61           HE2      PHE  61  -0.545  -2.038  -9.825
  495    HZ   PHE  61           HZ       PHE  61  -0.246  -3.226  -7.670
  496    H    ILE  62           H        ILE  62  -7.678  -5.111  -8.714
  497    HA   ILE  62           HA       ILE  62  -9.886  -3.635 -10.077
  498    HB   ILE  62           HB       ILE  62 -11.272  -5.587  -9.573
  499   1HG1  ILE  62          2HG1      ILE  62  -8.777  -6.669  -8.219
  500   2HG1  ILE  62          1HG1      ILE  62 -10.239  -6.137  -7.387
  501   1HG2  ILE  62          1HG2      ILE  62  -8.564  -6.085 -10.814
  502   2HG2  ILE  62          2HG2      ILE  62 -10.110  -5.829 -11.624
  503   3HG2  ILE  62          3HG2      ILE  62  -9.799  -7.342 -10.774
  504   1HD1  ILE  62          1HD1      ILE  62 -11.488  -7.841  -8.860
  505   2HD1  ILE  62          2HD1      ILE  62 -10.480  -8.489  -7.565
  506   3HD1  ILE  62          3HD1      ILE  62  -9.896  -8.504  -9.229
  507    H    LYS  63           H        LYS  63 -11.965  -3.595  -8.647
  508    HA   LYS  63           HA       LYS  63 -11.181  -2.755  -5.883
  509   1HB   LYS  63          2HB       LYS  63 -13.561  -1.651  -7.377
  510   2HB   LYS  63          1HB       LYS  63 -12.731  -0.967  -5.980
  511   1HG   LYS  63          2HG       LYS  63 -11.086  -0.018  -7.252
  512   2HG   LYS  63          1HG       LYS  63 -11.064  -1.350  -8.407
  513   1HD   LYS  63          2HD       LYS  63 -11.951   0.532  -9.590
  514   2HD   LYS  63          1HD       LYS  63 -13.326  -0.514  -9.229
  515   1HE   LYS  63          2HE       LYS  63 -13.963   0.862  -7.345
  516   2HE   LYS  63          1HE       LYS  63 -12.495   1.828  -7.495
  517   1HZ   LYS  63          1HZ       LYS  63 -13.232   2.628  -9.617
  518   2HZ   LYS  63          2HZ       LYS  63 -14.463   2.898  -8.477
  519   3HZ   LYS  63          3HZ       LYS  63 -14.593   1.616  -9.586
  520    H    VAL  64           H        VAL  64 -12.501  -3.487  -4.205
  521    HA   VAL  64           HA       VAL  64 -14.412  -5.626  -4.952
  522    HB   VAL  64           HB       VAL  64 -12.642  -6.076  -3.246
  523   1HG1  VAL  64          1HG1      VAL  64 -12.405  -4.817  -1.343
  524   2HG1  VAL  64          2HG1      VAL  64 -14.132  -4.473  -1.234
  525   3HG1  VAL  64          3HG1      VAL  64 -13.124  -3.569  -2.363
  526   1HG2  VAL  64          1HG2      VAL  64 -15.542  -6.131  -2.369
  527   2HG2  VAL  64          2HG2      VAL  64 -14.253  -6.954  -1.491
  528   3HG2  VAL  64          3HG2      VAL  64 -14.634  -7.428  -3.146
  529    HA   PRO  65           HA       PRO  65 -17.569  -2.553  -4.106
  530   1HB   PRO  65          2HB       PRO  65 -19.632  -4.069  -5.109
  531   2HB   PRO  65          1HB       PRO  65 -18.536  -3.115  -6.121
  532   1HG   PRO  65          2HG       PRO  65 -18.627  -6.068  -5.717
  533   2HG   PRO  65          1HG       PRO  65 -18.029  -5.142  -7.106
  534   1HD   PRO  65          2HD       PRO  65 -16.433  -6.344  -5.097
  535   2HD   PRO  65          1HD       PRO  65 -15.883  -5.159  -6.301
  536    H    ARG  66           H        ARG  66 -19.511  -2.524  -2.707
  537    HA   ARG  66           HA       ARG  66 -19.501  -4.780  -0.741
  538   1HB   ARG  66          2HB       ARG  66 -18.776  -2.725   0.311
  539   2HB   ARG  66          1HB       ARG  66 -20.133  -1.836  -0.383
  540   1HG   ARG  66          2HG       ARG  66 -21.641  -2.687   1.126
  541   2HG   ARG  66          1HG       ARG  66 -20.805  -4.235   1.245
  542   1HD   ARG  66          2HD       ARG  66 -19.747  -3.554   3.109
  543   2HD   ARG  66          1HD       ARG  66 -19.083  -2.165   2.251
  544    HE   ARG  66           HE       ARG  66 -21.028  -1.914   4.217
  545   1HH1  ARG  66          1HH1      ARG  66 -19.987   0.415   2.627
  546   2HH1  ARG  66          2HH1      ARG  66 -21.429   1.009   1.873
  547   1HH2  ARG  66          1HH2      ARG  66 -23.249  -1.884   2.475
  548   2HH2  ARG  66          2HH2      ARG  66 -23.278  -0.295   1.786
  549    H    SER  67           H        SER  67 -21.909  -2.234  -0.876
  550    HA   SER  67           HA       SER  67 -23.937  -4.314  -1.566
  551   1HB   SER  67          2HB       SER  67 -24.162  -1.694  -0.063
  552   2HB   SER  67          1HB       SER  67 -25.561  -2.640  -0.566
  553    HG   SER  67           HG       SER  67 -24.353  -4.430   0.559
  554    H    GLN  68           H        GLN  68 -25.415  -3.889  -3.260
  555    HA   GLN  68           HA       GLN  68 -24.499  -1.871  -5.201
  556   1HB   GLN  68          2HB       GLN  68 -25.332  -4.324  -5.665
  557   2HB   GLN  68          1HB       GLN  68 -26.932  -3.585  -5.597
  558   1HG   GLN  68          2HG       GLN  68 -26.299  -3.466  -7.887
  559   2HG   GLN  68          1HG       GLN  68 -26.023  -1.844  -7.250
  560   1HE2  GLN  68          1HE2      GLN  68 -24.620  -3.565  -9.454
  561   2HE2  GLN  68          2HE2      GLN  68 -22.973  -3.407  -9.074
  562    H    GLU  69           H        GLU  69 -25.143   0.013  -3.876
  563    HA   GLU  69           HA       GLU  69 -27.648   1.107  -4.661
  564   1HB   GLU  69          2HB       GLU  69 -27.670  -0.513  -2.204
  565   2HB   GLU  69          1HB       GLU  69 -28.330   1.110  -1.996
  566   1HG   GLU  69          2HG       GLU  69 -29.465   0.388  -4.375
  567   2HG   GLU  69          1HG       GLU  69 -29.390  -1.169  -3.548
  568    H    GLU  70           H        GLU  70 -26.273   1.357  -1.389
  569    HA   GLU  70           HA       GLU  70 -25.174   4.026  -2.168
  570   1HB   GLU  70          2HB       GLU  70 -25.871   4.834   0.104
  571   2HB   GLU  70          1HB       GLU  70 -27.232   4.426  -0.943
  572   1HG   GLU  70          2HG       GLU  70 -26.589   2.021   0.333
  573   2HG   GLU  70          1HG       GLU  70 -26.454   3.242   1.597
  574    HA   PRO  71           HA       PRO  71 -21.813   1.699  -0.191
  575   1HB   PRO  71          2HB       PRO  71 -19.863   2.809  -1.780
  576   2HB   PRO  71          1HB       PRO  71 -20.811   1.387  -2.246
  577   1HG   PRO  71          2HG       PRO  71 -21.024   4.188  -3.237
  578   2HG   PRO  71          1HG       PRO  71 -21.469   2.676  -4.043
  579   1HD   PRO  71          2HD       PRO  71 -23.256   4.488  -2.793
  580   2HD   PRO  71          1HD       PRO  71 -23.641   2.840  -3.333
  581    H    GLY  72           H        GLY  72 -21.886   2.883   1.794
  582   1HA   GLY  72          2HA       GLY  72 -20.938   5.678   1.823
  583   2HA   GLY  72          1HA       GLY  72 -21.546   4.775   3.216
  584    H    LYS  73           H        LYS  73 -20.078   3.643   4.489
  585    HA   LYS  73           HA       LYS  73 -17.230   4.234   4.009
  586   1HB   LYS  73          2HB       LYS  73 -18.503   4.332   6.287
  587   2HB   LYS  73          1HB       LYS  73 -18.292   2.581   6.293
  588   1HG   LYS  73          2HG       LYS  73 -15.985   2.721   6.483
  589   2HG   LYS  73          1HG       LYS  73 -15.913   4.303   5.707
  590   1HD   LYS  73          2HD       LYS  73 -16.347   5.433   7.655
  591   2HD   LYS  73          1HD       LYS  73 -17.396   4.159   8.281
  592   1HE   LYS  73          2HE       LYS  73 -14.439   3.676   7.992
  593   2HE   LYS  73          1HE       LYS  73 -15.066   4.528   9.403
  594   1HZ   LYS  73          1HZ       LYS  73 -16.233   2.696  10.107
  595   2HZ   LYS  73          2HZ       LYS  73 -14.848   1.965   9.447
  596   3HZ   LYS  73          3HZ       LYS  73 -16.300   1.994   8.564
  597    H    GLY  74           H        GLY  74 -17.839   2.652   1.983
  598   1HA   GLY  74          2HA       GLY  74 -16.644   0.036   2.744
  599   2HA   GLY  74          1HA       GLY  74 -18.135   0.037   1.803
  600    H    SER  75           H        SER  75 -14.725   0.971   1.750
  601    HA   SER  75           HA       SER  75 -14.762   0.655  -1.201
  602   1HB   SER  75          2HB       SER  75 -13.591   3.074   0.212
  603   2HB   SER  75          1HB       SER  75 -13.467   2.733  -1.512
  604    HG   SER  75           HG       SER  75 -15.759   2.815  -1.592
  605    H    PHE  76           H        PHE  76 -13.271  -0.966  -1.446
  606    HA   PHE  76           HA       PHE  76 -10.652  -0.615  -0.071
  607   1HB   PHE  76          2HB       PHE  76 -12.588  -2.639   0.517
  608   2HB   PHE  76          1HB       PHE  76 -11.194  -3.407  -0.244
  609    HD1  PHE  76           HD1      PHE  76  -9.076  -3.539   0.869
  610    HD2  PHE  76           HD2      PHE  76 -12.267  -1.204   2.545
  611    HE1  PHE  76           HE1      PHE  76  -7.789  -3.294   2.974
  612    HE2  PHE  76           HE2      PHE  76 -10.981  -0.959   4.651
  613    HZ   PHE  76           HZ       PHE  76  -8.742  -2.003   4.866
  614    H    TRP  77           H        TRP  77  -9.050  -0.706  -1.529
  615    HA   TRP  77           HA       TRP  77  -9.550  -1.591  -4.267
  616   1HB   TRP  77          2HB       TRP  77  -7.399  -0.184  -2.792
  617   2HB   TRP  77          1HB       TRP  77  -6.861  -1.175  -4.149
  618    HD1  TRP  77           HD1      TRP  77  -8.231   2.144  -3.377
  619    HE1  TRP  77           HE1      TRP  77  -8.997   3.339  -5.530
  620    HE3  TRP  77           HE3      TRP  77  -8.143  -1.782  -6.637
  621    HZ2  TRP  77           HZ2      TRP  77  -9.503   2.706  -8.275
  622    HZ3  TRP  77           HZ3      TRP  77  -8.773  -1.460  -9.012
  623    HH2  TRP  77           HH2      TRP  77  -9.450   0.778  -9.834
  624    H    ARG  78           H        ARG  78  -8.151  -3.244  -5.310
  625    HA   ARG  78           HA       ARG  78  -6.689  -5.111  -3.600
  626   1HB   ARG  78          2HB       ARG  78  -9.152  -5.706  -3.306
  627   2HB   ARG  78          1HB       ARG  78  -9.153  -6.156  -5.012
  628   1HG   ARG  78          2HG       ARG  78  -7.266  -7.726  -4.558
  629   2HG   ARG  78          1HG       ARG  78  -7.395  -7.336  -2.842
  630   1HD   ARG  78          2HD       ARG  78  -8.662  -9.342  -3.159
  631   2HD   ARG  78          1HD       ARG  78  -9.840  -8.041  -2.997
  632    HE   ARG  78           HE       ARG  78  -9.122  -8.529  -5.770
  633   1HH1  ARG  78          1HH2      ARG  78  -9.934 -11.230  -4.835
  634   2HH1  ARG  78          2HH2      ARG  78 -11.653 -11.202  -5.046
  635   1HH2  ARG  78          1HH1      ARG  78 -11.830  -7.748  -5.304
  636   2HH2  ARG  78          2HH1      ARG  78 -12.727  -9.230  -5.311
  637    H    ILE  79           H        ILE  79  -5.603  -6.781  -4.908
  638    HA   ILE  79           HA       ILE  79  -5.313  -5.877  -7.734
  639    HB   ILE  79           HB       ILE  79  -3.126  -6.590  -7.691
  640   1HG1  ILE  79          2HG1      ILE  79  -3.988  -8.640  -5.621
  641   2HG1  ILE  79          1HG1      ILE  79  -3.480  -8.950  -7.284
  642   1HG2  ILE  79          1HG2      ILE  79  -3.429  -6.433  -4.705
  643   2HG2  ILE  79          2HG2      ILE  79  -3.724  -5.015  -5.710
  644   3HG2  ILE  79          3HG2      ILE  79  -2.141  -5.793  -5.724
  645   1HD1  ILE  79          1HD1      ILE  79  -1.829  -8.272  -4.892
  646   2HD1  ILE  79          2HD1      ILE  79  -1.305  -7.623  -6.445
  647   3HD1  ILE  79          3HD1      ILE  79  -1.472  -9.365  -6.230
  648    H    ASP  80           H        ASP  80  -5.307  -7.494  -9.443
  649    HA   ASP  80           HA       ASP  80  -7.418  -9.385  -9.242
  650   1HB   ASP  80          2HB       ASP  80  -5.789  -8.393 -11.280
  651   2HB   ASP  80          1HB       ASP  80  -5.439 -10.121 -11.249
  652    HA   PRO  81           HA       PRO  81  -5.486 -12.812  -7.303
  653   1HB   PRO  81          2HB       PRO  81  -7.174 -14.783  -8.214
  654   2HB   PRO  81          1HB       PRO  81  -7.611 -13.625  -6.945
  655   1HG   PRO  81          2HG       PRO  81  -8.491 -13.707  -9.794
  656   2HG   PRO  81          1HG       PRO  81  -9.322 -13.035  -8.381
  657   1HD   PRO  81          2HD       PRO  81  -7.916 -11.549 -10.334
  658   2HD   PRO  81          1HD       PRO  81  -8.449 -10.945  -8.750
  659    H    ALA  82           H        ALA  82  -6.362 -13.336 -10.742
  660    HA   ALA  82           HA       ALA  82  -4.171 -15.295 -11.015
  661   1HB   ALA  82          1HB       ALA  82  -6.328 -14.282 -12.870
  662   2HB   ALA  82          2HB       ALA  82  -6.113 -15.912 -12.234
  663   3HB   ALA  82          3HB       ALA  82  -5.003 -15.287 -13.455
  664    H    SER  83           H        SER  83  -4.013 -12.157 -10.693
  665    HA   SER  83           HA       SER  83  -2.037 -11.823 -12.910
  666   1HB   SER  83          2HB       SER  83  -3.409  -9.571 -11.431
  667   2HB   SER  83          1HB       SER  83  -2.482  -9.467 -12.923
  668    HG   SER  83           HG       SER  83  -4.302  -9.808 -13.903
  669    H    GLU  84           H        GLU  84  -2.521 -12.179  -9.583
  670    HA   GLU  84           HA       GLU  84  -0.560 -10.444  -8.499
  671   1HB   GLU  84          2HB       GLU  84  -2.187 -11.743  -7.136
  672   2HB   GLU  84          1HB       GLU  84  -1.313 -13.221  -7.537
  673   1HG   GLU  84          2HG       GLU  84   0.462 -11.128  -6.538
  674   2HG   GLU  84          1HG       GLU  84  -0.788 -11.555  -5.369
  675    H    ALA  85           H        ALA  85  -0.133 -13.077 -10.617
  676    HA   ALA  85           HA       ALA  85   2.609 -13.609  -9.629
  677   1HB   ALA  85          1HB       ALA  85   1.169 -15.472 -10.486
  678   2HB   ALA  85          2HB       ALA  85   2.693 -15.324 -11.360
  679   3HB   ALA  85          3HB       ALA  85   1.202 -14.718 -12.080
  680    H    LYS  86           H        LYS  86   0.962 -11.864 -12.206
  681    HA   LYS  86           HA       LYS  86   3.528 -11.285 -13.552
  682   1HB   LYS  86          2HB       LYS  86   2.142 -10.162 -15.237
  683   2HB   LYS  86          1HB       LYS  86   1.553 -11.793 -14.935
  684   1HG   LYS  86          2HG       LYS  86  -0.058 -10.728 -13.243
  685   2HG   LYS  86          1HG       LYS  86   0.384  -9.180 -13.962
  686   1HD   LYS  86          2HD       LYS  86  -0.196 -11.089 -16.047
  687   2HD   LYS  86          1HD       LYS  86  -1.544 -11.022 -14.911
  688   1HE   LYS  86          2HE       LYS  86  -2.107  -8.909 -15.521
  689   2HE   LYS  86          1HE       LYS  86  -0.424  -8.386 -15.592
  690   1HZ   LYS  86          1HZ       LYS  86  -0.397  -9.908 -17.688
  691   2HZ   LYS  86          2HZ       LYS  86  -1.002  -8.323 -17.788
  692   3HZ   LYS  86          3HZ       LYS  86  -2.072  -9.638 -17.673
  693    H    LEU  87           H        LEU  87   1.149  -9.662 -11.519
  694    HA   LEU  87           HA       LEU  87   2.250  -7.024 -11.952
  695   1HB   LEU  87          2HB       LEU  87   0.928  -6.470  -9.825
  696   2HB   LEU  87          1HB       LEU  87   0.014  -7.030 -11.204
  697    HG   LEU  87           HG       LEU  87   0.638  -9.386  -9.863
  698   1HD1  LEU  87          1HD1      LEU  87   1.360  -8.255  -7.877
  699   2HD1  LEU  87          2HD1      LEU  87  -0.263  -8.861  -7.564
  700   3HD1  LEU  87          3HD1      LEU  87  -0.017  -7.156  -7.935
  701   1HD2  LEU  87          1HD2      LEU  87  -1.778  -9.369  -9.312
  702   2HD2  LEU  87          2HD2      LEU  87  -1.504  -8.801 -10.958
  703   3HD2  LEU  87          3HD2      LEU  87  -1.841  -7.645  -9.670
  704    H    VAL  88           H        VAL  88   3.045  -9.697 -10.085
  705    HA   VAL  88           HA       VAL  88   4.594  -8.227  -8.087
  706    HB   VAL  88           HB       VAL  88   5.224 -10.540  -7.448
  707   1HG1  VAL  88          1HG1      VAL  88   3.316  -9.528  -6.366
  708   2HG1  VAL  88          2HG1      VAL  88   2.892 -11.197  -6.749
  709   3HG1  VAL  88          3HG1      VAL  88   2.297  -9.881  -7.761
  710   1HG2  VAL  88          1HG2      VAL  88   3.234 -11.366  -9.558
  711   2HG2  VAL  88          2HG2      VAL  88   4.248 -12.419  -8.579
  712   3HG2  VAL  88          3HG2      VAL  88   4.975 -11.397  -9.818
  713    H    GLU  89           H        GLU  89   5.102  -9.859 -11.132
  714    HA   GLU  89           HA       GLU  89   7.844 -10.456 -11.020
  715   1HB   GLU  89          2HB       GLU  89   5.959 -10.546 -12.988
  716   2HB   GLU  89          1HB       GLU  89   6.939  -9.188 -13.541
  717   1HG   GLU  89          2HG       GLU  89   8.913 -10.510 -13.634
  718   2HG   GLU  89          1HG       GLU  89   8.184 -11.805 -12.683
  719    H    GLN  90           H        GLN  90   6.231  -7.353 -11.453
  720    HA   GLN  90           HA       GLN  90   8.826  -5.988 -11.841
  721   1HB   GLN  90          2HB       GLN  90   6.159  -5.403 -12.562
  722   2HB   GLN  90          1HB       GLN  90   6.591  -4.210 -11.337
  723   1HG   GLN  90          2HG       GLN  90   8.695  -3.738 -12.616
  724   2HG   GLN  90          1HG       GLN  90   8.119  -4.820 -13.884
  725   1HE2  GLN  90          1HE2      GLN  90   8.446  -2.393 -14.898
  726   2HE2  GLN  90          2HE2      GLN  90   7.003  -1.506 -14.998
  727    H    ALA  91           H        ALA  91   6.398  -6.598  -9.387
  728    HA   ALA  91           HA       ALA  91   7.086  -4.677  -7.451
  729   1HB   ALA  91          1HB       ALA  91   5.176  -6.227  -7.230
  730   2HB   ALA  91          2HB       ALA  91   6.197  -6.239  -5.790
  731   3HB   ALA  91          3HB       ALA  91   6.303  -7.556  -6.959
  732    H    PHE  92           H        PHE  92   8.142  -8.066  -7.123
  733    HA   PHE  92           HA       PHE  92  10.261  -7.612  -5.368
  734   1HB   PHE  92          2HB       PHE  92  10.456  -9.616  -7.621
  735   2HB   PHE  92          1HB       PHE  92  11.092  -9.754  -5.982
  736    HD1  PHE  92           HD1      PHE  92   8.505  -8.483  -4.721
  737    HD2  PHE  92           HD2      PHE  92   9.195 -11.723  -7.456
  738    HE1  PHE  92           HE1      PHE  92   6.392  -9.552  -3.988
  739    HE2  PHE  92           HE2      PHE  92   7.080 -12.792  -6.723
  740    HZ   PHE  92           HZ       PHE  92   5.679 -11.705  -4.988
  741    H    ARG  93           H        ARG  93  10.274  -7.364  -8.915
  742    HA   ARG  93           HA       ARG  93  13.106  -6.835  -9.117
  743   1HB   ARG  93          2HB       ARG  93  10.877  -7.090 -10.903
  744   2HB   ARG  93          1HB       ARG  93  11.724  -5.588 -11.274
  745   1HG   ARG  93          2HG       ARG  93  12.859  -7.214 -12.562
  746   2HG   ARG  93          1HG       ARG  93  13.886  -6.999 -11.144
  747   1HD   ARG  93          2HD       ARG  93  13.101  -9.007 -10.140
  748   2HD   ARG  93          1HD       ARG  93  11.741  -9.125 -11.257
  749    HE   ARG  93           HE       ARG  93  13.462  -9.588 -13.054
  750   1HH1  ARG  93          1HH2      ARG  93  15.551  -8.940 -10.726
  751   2HH1  ARG  93          2HH2      ARG  93  16.234 -10.521 -10.543
  752   1HH2  ARG  93          1HH1      ARG  93  13.757 -12.092 -12.395
  753   2HH2  ARG  93          2HH1      ARG  93  15.217 -12.307 -11.489
  754    H    LYS  94           H        LYS  94  14.017  -4.707  -9.791
  755    HA   LYS  94           HA       LYS  94  12.587  -2.475  -8.407
  756   1HB   LYS  94          2HB       LYS  94  15.538  -2.982  -8.873
  757   2HB   LYS  94          1HB       LYS  94  14.906  -1.446  -8.281
  758   1HG   LYS  94          2HG       LYS  94  13.826  -2.670  -6.389
  759   2HG   LYS  94          1HG       LYS  94  14.598  -4.153  -6.951
  760   1HD   LYS  94          2HD       LYS  94  16.628  -3.546  -6.134
  761   2HD   LYS  94          1HD       LYS  94  16.443  -1.875  -6.667
  762   1HE   LYS  94          2HE       LYS  94  15.117  -3.093  -4.227
  763   2HE   LYS  94          1HE       LYS  94  16.516  -2.021  -4.201
  764   1HZ   LYS  94          1HZ       LYS  94  14.906  -0.531  -5.620
  765   2HZ   LYS  94          2HZ       LYS  94  14.863  -0.510  -3.922
  766   3HZ   LYS  94          3HZ       LYS  94  13.718  -1.414  -4.793
  767    H    ARG  95           H        ARG  95  11.816  -0.907  -9.742
  768    HA   ARG  95           HA       ARG  95  12.858  -0.804 -12.529
  769   1HB   ARG  95          2HB       ARG  95  10.375  -1.017 -12.093
  770   2HB   ARG  95          1HB       ARG  95  10.425   0.602 -11.391
  771   1HG   ARG  95          2HG       ARG  95  10.174   1.426 -13.474
  772   2HG   ARG  95          1HG       ARG  95  11.790   0.819 -13.840
  773   1HD   ARG  95          2HD       ARG  95   9.173  -0.668 -14.201
  774   2HD   ARG  95          1HD       ARG  95  10.244  -0.087 -15.477
  775    HE   ARG  95           HE       ARG  95  11.301  -2.071 -13.529
  776   1HH1  ARG  95          1HH2      ARG  95   9.563  -1.836 -16.419
  777   2HH1  ARG  95          2HH2      ARG  95  10.592  -2.902 -17.317
  778   1HH2  ARG  95          1HH1      ARG  95  12.965  -3.160 -14.802
  779   2HH2  ARG  95          2HH1      ARG  95  12.518  -3.649 -16.403
  780    H    ARG  96           H        ARG  96  14.007   0.946 -13.242
  781    HA   ARG  96           HA       ARG  96  14.155   3.321 -11.430
  782   1HB   ARG  96          2HB       ARG  96  16.571   3.436 -12.568
  783   2HB   ARG  96          1HB       ARG  96  16.287   2.489 -11.109
  784   1HG   ARG  96          2HG       ARG  96  15.876   1.228 -13.808
  785   2HG   ARG  96          1HG       ARG  96  17.503   1.364 -13.141
  786   1HD   ARG  96          2HD       ARG  96  16.023   0.425 -10.994
  787   2HD   ARG  96          1HD       ARG  96  15.320  -0.430 -12.368
  788    HE   ARG  96           HE       ARG  96  17.761  -1.071 -12.909
  789   1HH1  ARG  96          1HH1      ARG  96  16.164  -1.203  -9.928
  790   2HH1  ARG  96          2HH1      ARG  96  17.538  -1.754  -9.030
  791   1HH2  ARG  96          1HH2      ARG  96  19.745  -1.404 -11.682
  792   2HH2  ARG  96          2HH2      ARG  96  19.566  -1.868 -10.022
  793    H    GLN  97           H        GLN  97  15.889   2.992 -14.462
  794    HA   GLN  97           HA       GLN  97  13.842   4.480 -15.962
  795   1HB   GLN  97          2HB       GLN  97  15.557   6.293 -16.526
  796   2HB   GLN  97          1HB       GLN  97  14.867   6.363 -14.904
  797   1HG   GLN  97          2HG       GLN  97  17.102   4.634 -14.738
  798   2HG   GLN  97          1HG       GLN  97  17.627   6.035 -15.673
  799   1HE2  GLN  97          1HE2      GLN  97  15.784   7.935 -14.376
  800   2HE2  GLN  97          2HE2      GLN  97  16.363   8.170 -12.797
  801    H    ARG  98           H        ARG  98  14.184   4.327 -18.212
  802    HA   ARG  98           HA       ARG  98  16.568   2.707 -19.022
  803   1HB   ARG  98          2HB       ARG  98  13.705   2.268 -19.459
  804   2HB   ARG  98          1HB       ARG  98  14.632   2.250 -20.960
  805   1HG   ARG  98          2HG       ARG  98  16.287   0.751 -19.521
  806   2HG   ARG  98          1HG       ARG  98  14.821   0.424 -18.596
  807   1HD   ARG  98          2HD       ARG  98  15.036   0.119 -21.604
  808   2HD   ARG  98          1HD       ARG  98  15.206  -1.212 -20.459
  809    HE   ARG  98           HE       ARG  98  12.695   0.199 -21.113
  810   1HH1  ARG  98          1HH2      ARG  98  14.319  -1.473 -18.617
  811   2HH1  ARG  98          2HH2      ARG  98  12.976  -2.496 -18.225
  812   1HH2  ARG  98          1HH1      ARG  98  10.998  -1.348 -20.833
  813   2HH2  ARG  98          2HH1      ARG  98  11.096  -2.425 -19.480
  814    H    GLY  99           H        GLY  99  17.693   3.461 -20.799
  815   1HA   GLY  99          2HA       GLY  99  16.780   6.067 -21.908
  816   2HA   GLY  99          1HA       GLY  99  18.435   5.462 -21.963
  817    H    VAL 100           H        VAL 100  16.466   2.891 -22.670
  818    HA   VAL 100           HA       VAL 100  15.859   3.464 -25.452
  819    HB   VAL 100           HB       VAL 100  18.324   3.231 -25.586
  820   1HG1  VAL 100          1HG1      VAL 100  18.246   1.560 -23.559
  821   2HG1  VAL 100          2HG1      VAL 100  19.471   1.349 -24.810
  822   3HG1  VAL 100          3HG1      VAL 100  18.025   0.341 -24.815
  823   1HG2  VAL 100          1HG2      VAL 100  16.381   1.910 -27.111
  824   2HG2  VAL 100          2HG2      VAL 100  17.623   0.690 -26.827
  825   3HG2  VAL 100          3HG2      VAL 100  18.050   2.223 -27.589
  826    H    SER 101           HN       SER 101  14.235   2.086 -26.037
  827    HA   SER 101           HA       SER 101  13.307   0.073 -24.186
  828   1HB   SER 101          2HB       SER 101  12.523   0.446 -27.091
  829   2HB   SER 101          1HB       SER 101  11.600  -0.401 -25.852
  830    HG   SER 101           HG       SER 101  11.420   2.108 -26.465
  Start of MODEL   19
    1   1H    GLU   1          1HT       GLU   1  10.233  16.934  -4.139
    2   2H    GLU   1          2HT       GLU   1  10.886  15.444  -3.652
    3   3H    GLU   1          3HT       GLU   1   9.517  16.072  -2.867
    4    HA   GLU   1           HA       GLU   1   8.287  15.913  -5.002
    5   1HB   GLU   1          2HB       GLU   1  10.969  15.179  -5.851
    6   2HB   GLU   1          1HB       GLU   1   9.804  13.923  -6.272
    7   1HG   GLU   1          2HG       GLU   1   9.326  16.856  -6.851
    8   2HG   GLU   1          1HG       GLU   1  10.100  15.768  -8.006
    9    H    SER   2           H        SER   2  10.432  13.484  -3.487
   10    HA   SER   2           HA       SER   2   9.841  11.552  -2.275
   11   1HB   SER   2          2HB       SER   2   7.884  13.129  -1.561
   12   2HB   SER   2          1HB       SER   2   6.932  12.195  -2.712
   13    HG   SER   2           HG       SER   2   6.948  11.375  -0.513
   14    H    LYS   3           H        LYS   3  10.658  10.515  -4.297
   15    HA   LYS   3           HA       LYS   3   8.500   8.900  -5.534
   16   1HB   LYS   3          2HB       LYS   3  10.555   9.732  -7.462
   17   2HB   LYS   3          1HB       LYS   3   8.815   9.602  -7.670
   18   1HG   LYS   3          2HG       LYS   3   8.428  11.768  -6.820
   19   2HG   LYS   3          1HG       LYS   3  10.010  11.846  -6.047
   20   1HD   LYS   3          2HD       LYS   3  10.010  11.465  -8.993
   21   2HD   LYS   3          1HD       LYS   3   9.488  13.044  -8.407
   22   1HE   LYS   3          2HE       LYS   3  11.559  13.229  -7.069
   23   2HE   LYS   3          1HE       LYS   3  12.087  11.660  -7.679
   24   1HZ   LYS   3          1HZ       LYS   3  11.805  14.210  -9.125
   25   2HZ   LYS   3          2HZ       LYS   3  11.709  12.738  -9.970
   26   3HZ   LYS   3          3HZ       LYS   3  13.115  13.133  -9.101
   27    HA   PRO   4           HA       PRO   4  12.007   6.226  -4.480
   28   1HB   PRO   4          2HB       PRO   4  10.395   4.086  -3.845
   29   2HB   PRO   4          1HB       PRO   4  10.799   5.373  -2.701
   30   1HG   PRO   4          2HG       PRO   4   8.242   4.874  -4.146
   31   2HG   PRO   4          1HG       PRO   4   8.519   5.705  -2.605
   32   1HD   PRO   4          2HD       PRO   4   8.044   6.948  -5.107
   33   2HD   PRO   4          1HD       PRO   4   8.623   7.748  -3.632
   34    HA   PRO   5           HA       PRO   5  12.073   3.797  -8.175
   35   1HB   PRO   5          2HB       PRO   5  13.126   1.402  -7.337
   36   2HB   PRO   5          1HB       PRO   5  14.064   2.888  -7.503
   37   1HG   PRO   5          2HG       PRO   5  13.125   1.543  -5.027
   38   2HG   PRO   5          1HG       PRO   5  14.504   2.629  -5.256
   39   1HD   PRO   5          2HD       PRO   5  12.000   3.327  -4.125
   40   2HD   PRO   5          1HD       PRO   5  13.275   4.455  -4.624
   41    H    TYR   6           H        TYR   6   9.448   3.729  -7.506
   42    HA   TYR   6           HA       TYR   6   8.674   1.009  -8.247
   43   1HB   TYR   6          2HB       TYR   6   7.584   2.280  -5.738
   44   2HB   TYR   6          1HB       TYR   6   7.131   0.707  -6.405
   45    HD1  TYR   6           HD1      TYR   6   8.640  -1.192  -6.311
   46    HD2  TYR   6           HD2      TYR   6   9.786   2.638  -4.766
   47    HE1  TYR   6           HE1      TYR   6  10.552  -2.244  -5.125
   48    HE2  TYR   6           HE2      TYR   6  11.697   1.594  -3.569
   49    HH   TYR   6           HH       TYR   6  12.881  -1.385  -4.273
   50    H    SER   7           H        SER   7   7.606   1.548 -10.023
   51    HA   SER   7           HA       SER   7   6.286   3.917 -10.665
   52   1HB   SER   7          2HB       SER   7   6.035   1.071 -11.476
   53   2HB   SER   7          1HB       SER   7   4.681   2.119 -11.898
   54    HG   SER   7           HG       SER   7   6.328   2.090 -13.512
   55    H    TYR   8           H        TYR   8   3.793   4.162 -10.803
   56    HA   TYR   8           HA       TYR   8   2.738   3.640  -8.107
   57   1HB   TYR   8          2HB       TYR   8   1.608   5.180 -10.458
   58   2HB   TYR   8          1HB       TYR   8   0.852   5.085  -8.864
   59    HD1  TYR   8           HD1      TYR   8   2.937   5.301  -6.944
   60    HD2  TYR   8           HD2      TYR   8   2.637   7.257 -10.755
   61    HE1  TYR   8           HE1      TYR   8   4.436   7.101  -6.135
   62    HE2  TYR   8           HE2      TYR   8   4.134   9.061  -9.947
   63    HH   TYR   8           HH       TYR   8   4.912  10.032  -7.913
   64    H    ALA   9           H        ALA   9   3.020   1.675 -10.560
   65    HA   ALA   9           HA       ALA   9   0.249   0.565 -10.350
   66   1HB   ALA   9          1HB       ALA   9   0.866  -0.690 -12.454
   67   2HB   ALA   9          2HB       ALA   9   2.355   0.251 -12.512
   68   3HB   ALA   9          3HB       ALA   9   0.796   1.060 -12.662
   69    H    GLN  10           H        GLN  10   3.696  -0.101 -10.203
   70    HA   GLN  10           HA       GLN  10   3.234  -2.881  -9.267
   71   1HB   GLN  10          2HB       GLN  10   5.858  -2.727  -9.085
   72   2HB   GLN  10          1HB       GLN  10   5.107  -2.893 -10.671
   73   1HG   GLN  10          2HG       GLN  10   5.500  -0.679 -11.245
   74   2HG   GLN  10          1HG       GLN  10   5.568  -0.144  -9.564
   75   1HE2  GLN  10          1HE2      GLN  10   7.466  -1.791  -8.422
   76   2HE2  GLN  10          2HE2      GLN  10   8.959  -1.629  -9.214
   77    H    LEU  11           H        LEU  11   4.204   0.303  -8.201
   78    HA   LEU  11           HA       LEU  11   5.219  -0.270  -5.629
   79   1HB   LEU  11          2HB       LEU  11   5.289   1.986  -6.461
   80   2HB   LEU  11          1HB       LEU  11   3.541   2.027  -6.672
   81    HG   LEU  11           HG       LEU  11   3.728   1.415  -4.016
   82   1HD1  LEU  11          1HD1      LEU  11   6.060   1.637  -3.755
   83   2HD1  LEU  11          2HD1      LEU  11   5.432   3.199  -3.232
   84   3HD1  LEU  11          3HD1      LEU  11   6.137   3.026  -4.838
   85   1HD2  LEU  11          1HD2      LEU  11   2.276   3.126  -4.479
   86   2HD2  LEU  11          2HD2      LEU  11   3.370   3.875  -5.642
   87   3HD2  LEU  11          3HD2      LEU  11   3.627   4.107  -3.914
   88    H    ILE  12           H        ILE  12   1.911   0.011  -6.858
   89    HA   ILE  12           HA       ILE  12   0.572  -0.364  -4.302
   90    HB   ILE  12           HB       ILE  12  -0.433  -1.133  -7.048
   91   1HG1  ILE  12          2HG1      ILE  12   0.343   1.428  -6.222
   92   2HG1  ILE  12          1HG1      ILE  12  -0.708   1.048  -7.579
   93   1HG2  ILE  12          1HG2      ILE  12  -1.655  -2.010  -5.066
   94   2HG2  ILE  12          2HG2      ILE  12  -2.628  -0.916  -6.047
   95   3HG2  ILE  12          3HG2      ILE  12  -1.919  -0.350  -4.535
   96   1HD1  ILE  12          1HD1      ILE  12  -1.846   2.658  -6.168
   97   2HD1  ILE  12          2HD1      ILE  12  -1.569   1.663  -4.741
   98   3HD1  ILE  12          3HD1      ILE  12  -2.664   1.106  -5.997
   99    H    VAL  13           H        VAL  13   1.616  -2.525  -6.899
  100    HA   VAL  13           HA       VAL  13   0.524  -4.952  -6.068
  101    HB   VAL  13           HB       VAL  13   3.341  -4.507  -7.098
  102   1HG1  VAL  13          1HG1      VAL  13   1.554  -6.902  -6.827
  103   2HG1  VAL  13          2HG1      VAL  13   3.281  -6.757  -6.504
  104   3HG1  VAL  13          3HG1      VAL  13   2.697  -6.821  -8.166
  105   1HG2  VAL  13          1HG2      VAL  13   2.310  -4.824  -9.325
  106   2HG2  VAL  13          2HG2      VAL  13   1.646  -3.416  -8.505
  107   3HG2  VAL  13          3HG2      VAL  13   0.719  -4.911  -8.571
  108    H    GLN  14           H        GLN  14   3.757  -3.712  -5.065
  109    HA   GLN  14           HA       GLN  14   4.243  -5.729  -3.125
  110   1HB   GLN  14          2HB       GLN  14   5.095  -2.817  -3.145
  111   2HB   GLN  14          1HB       GLN  14   5.743  -4.033  -2.046
  112   1HG   GLN  14          2HG       GLN  14   6.438  -5.381  -4.042
  113   2HG   GLN  14          1HG       GLN  14   5.928  -4.039  -5.068
  114   1HE2  GLN  14          1HE2      GLN  14   7.658  -4.001  -1.909
  115   2HE2  GLN  14          2HE2      GLN  14   8.991  -3.126  -2.487
  116    H    ALA  15           H        ALA  15   2.295  -2.827  -3.036
  117    HA   ALA  15           HA       ALA  15   1.902  -2.723  -0.190
  118   1HB   ALA  15          1HB       ALA  15   1.143  -0.741  -0.980
  119   2HB   ALA  15          2HB       ALA  15  -0.364  -1.600  -1.300
  120   3HB   ALA  15          3HB       ALA  15   0.831  -1.407  -2.583
  121    H    ILE  16           H        ILE  16  -0.717  -3.309  -2.473
  122    HA   ILE  16           HA       ILE  16  -2.265  -4.798  -0.592
  123    HB   ILE  16           HB       ILE  16  -3.215  -5.646  -3.062
  124   1HG1  ILE  16          2HG1      ILE  16  -2.183  -2.802  -3.300
  125   2HG1  ILE  16          1HG1      ILE  16  -1.634  -4.183  -4.257
  126   1HG2  ILE  16          1HG2      ILE  16  -4.016  -4.090  -0.887
  127   2HG2  ILE  16          2HG2      ILE  16  -5.033  -4.653  -2.214
  128   3HG2  ILE  16          3HG2      ILE  16  -4.274  -3.064  -2.299
  129   1HD1  ILE  16          1HD1      ILE  16  -4.553  -3.805  -4.245
  130   2HD1  ILE  16          2HD1      ILE  16  -3.462  -4.113  -5.592
  131   3HD1  ILE  16          3HD1      ILE  16  -3.659  -2.475  -4.981
  132    H    SER  17           H        SER  17  -0.340  -5.954  -3.377
  133    HA   SER  17           HA       SER  17  -0.882  -8.701  -3.096
  134   1HB   SER  17          2HB       SER  17   0.556  -7.444  -4.870
  135   2HB   SER  17          1HB       SER  17   1.891  -7.724  -3.755
  136    HG   SER  17           HG       SER  17   1.766  -9.828  -4.114
  137    H    SER  18           H        SER  18   1.674  -6.784  -1.497
  138    HA   SER  18           HA       SER  18   2.537  -9.085   0.091
  139   1HB   SER  18          2HB       SER  18   3.926  -6.994  -0.682
  140   2HB   SER  18          1HB       SER  18   3.242  -6.240   0.756
  141    HG   SER  18           HG       SER  18   5.019  -8.385   0.507
  142    H    ALA  19           H        ALA  19   0.035  -6.781   0.326
  143    HA   ALA  19           HA       ALA  19  -0.125  -6.370   3.136
  144   1HB   ALA  19          1HB       ALA  19  -1.553  -5.418   1.104
  145   2HB   ALA  19          2HB       ALA  19  -2.232  -5.495   2.729
  146   3HB   ALA  19          3HB       ALA  19  -2.635  -6.739   1.546
  147    H    GLN  20           H        GLN  20  -2.384  -7.368   4.195
  148    HA   GLN  20           HA       GLN  20  -1.817  -9.916   5.111
  149   1HB   GLN  20          2HB       GLN  20  -4.573  -8.771   4.545
  150   2HB   GLN  20          1HB       GLN  20  -4.256 -10.173   5.567
  151   1HG   GLN  20          2HG       GLN  20  -3.097  -7.413   6.026
  152   2HG   GLN  20          1HG       GLN  20  -4.504  -8.057   6.871
  153   1HE2  GLN  20          1HE2      GLN  20  -2.187  -7.349   8.350
  154   2HE2  GLN  20          2HE2      GLN  20  -1.460  -8.762   8.948
  155    H    ASP  21           H        ASP  21  -4.638  -9.758   2.995
  156    HA   ASP  21           HA       ASP  21  -3.762 -12.275   1.720
  157   1HB   ASP  21          2HB       ASP  21  -6.211 -11.434   2.551
  158   2HB   ASP  21          1HB       ASP  21  -6.274 -10.952   0.856
  159    H    ARG  22           H        ARG  22  -5.319  -9.339   0.408
  160    HA   ARG  22           HA       ARG  22  -3.200  -8.572  -1.318
  161   1HB   ARG  22          2HB       ARG  22  -4.401  -9.403  -3.487
  162   2HB   ARG  22          1HB       ARG  22  -3.377 -10.533  -2.601
  163   1HG   ARG  22          2HG       ARG  22  -5.458 -11.285  -1.361
  164   2HG   ARG  22          1HG       ARG  22  -6.395 -10.328  -2.509
  165   1HD   ARG  22          2HD       ARG  22  -6.226 -11.929  -4.080
  166   2HD   ARG  22          1HD       ARG  22  -4.472 -11.981  -3.906
  167    HE   ARG  22           HE       ARG  22  -5.578 -13.346  -1.685
  168   1HH1  ARG  22          1HH2      ARG  22  -3.933 -13.983  -4.437
  169   2HH1  ARG  22          2HH2      ARG  22  -4.655 -15.522  -4.773
  170   1HH2  ARG  22          1HH1      ARG  22  -7.157 -15.161  -2.399
  171   2HH2  ARG  22          2HH1      ARG  22  -6.481 -16.188  -3.618
  172    H    GLN  23           H        GLN  23  -5.381  -7.475   0.318
  173    HA   GLN  23           HA       GLN  23  -6.557  -5.691  -1.756
  174   1HB   GLN  23          2HB       GLN  23  -8.651  -5.760  -0.122
  175   2HB   GLN  23          1HB       GLN  23  -8.461  -6.963  -1.397
  176   1HG   GLN  23          2HG       GLN  23  -8.113  -8.647   0.083
  177   2HG   GLN  23          1HG       GLN  23  -7.064  -7.656   1.098
  178   1HE2  GLN  23          1HE2      GLN  23  -8.361  -8.686   2.934
  179   2HE2  GLN  23          2HE2      GLN  23  -9.847  -7.982   3.354
  180    H    LEU  24           H        LEU  24  -6.302  -3.572  -1.198
  181    HA   LEU  24           HA       LEU  24  -5.906  -2.915   1.689
  182   1HB   LEU  24          2HB       LEU  24  -4.275  -2.112  -0.715
  183   2HB   LEU  24          1HB       LEU  24  -4.366  -1.060   0.688
  184    HG   LEU  24           HG       LEU  24  -3.661  -3.982   0.948
  185   1HD1  LEU  24          1HD1      LEU  24  -1.339  -3.429   0.816
  186   2HD1  LEU  24          2HD1      LEU  24  -1.680  -1.699   0.806
  187   3HD1  LEU  24          3HD1      LEU  24  -2.090  -2.686  -0.597
  188   1HD2  LEU  24          1HD2      LEU  24  -4.101  -3.225   3.086
  189   2HD2  LEU  24          2HD2      LEU  24  -3.699  -1.554   2.689
  190   3HD2  LEU  24          3HD2      LEU  24  -2.412  -2.729   2.962
  191    H    THR  25           H        THR  25  -6.485  -0.661   2.201
  192    HA   THR  25           HA       THR  25  -8.784   0.248   0.596
  193    HB   THR  25           HB       THR  25  -9.322   1.629   2.428
  194    HG1  THR  25           HG1      THR  25  -7.512   1.909   4.060
  195   1HG2  THR  25          1HG2      THR  25  -9.372   0.171   4.235
  196   2HG2  THR  25          2HG2      THR  25  -7.720  -0.385   3.961
  197   3HG2  THR  25          3HG2      THR  25  -9.025  -0.943   2.914
  198    H    LEU  26           H        LEU  26  -8.773   2.870   0.425
  199    HA   LEU  26           HA       LEU  26  -6.741   3.510  -1.480
  200   1HB   LEU  26          2HB       LEU  26  -9.086   4.699  -0.832
  201   2HB   LEU  26          1HB       LEU  26  -7.970   5.769   0.020
  202    HG   LEU  26           HG       LEU  26  -7.446   4.966  -2.834
  203   1HD1  LEU  26          1HD1      LEU  26  -9.449   6.922  -1.779
  204   2HD1  LEU  26          2HD1      LEU  26  -9.517   5.920  -3.228
  205   3HD1  LEU  26          3HD1      LEU  26  -8.520   7.375  -3.208
  206   1HD2  LEU  26          1HD2      LEU  26  -6.071   6.919  -2.848
  207   2HD2  LEU  26          2HD2      LEU  26  -5.748   6.137  -1.302
  208   3HD2  LEU  26          3HD2      LEU  26  -6.813   7.541  -1.374
  209    H    SER  27           H        SER  27  -7.036   4.156   1.989
  210    HA   SER  27           HA       SER  27  -4.323   5.370   1.992
  211   1HB   SER  27          2HB       SER  27  -6.584   5.290   3.978
  212   2HB   SER  27          1HB       SER  27  -4.954   5.729   4.479
  213    HG   SER  27           HG       SER  27  -5.054   7.516   3.286
  214    H    GLY  28           H        GLY  28  -4.790   2.456   1.584
  215   1HA   GLY  28          2HA       GLY  28  -3.664   1.360   4.129
  216   2HA   GLY  28          1HA       GLY  28  -4.390   0.388   2.843
  217    H    ILE  29           H        ILE  29  -3.238   1.453   0.662
  218    HA   ILE  29           HA       ILE  29  -0.788   0.125   0.385
  219    HB   ILE  29           HB       ILE  29  -2.362   0.976  -1.384
  220   1HG1  ILE  29          2HG1      ILE  29   0.589   0.994  -1.383
  221   2HG1  ILE  29          1HG1      ILE  29  -0.526   0.170  -2.471
  222   1HG2  ILE  29          1HG2      ILE  29  -0.851   3.540  -1.377
  223   2HG2  ILE  29          2HG2      ILE  29  -2.163   3.354  -0.217
  224   3HG2  ILE  29          3HG2      ILE  29  -2.486   3.203  -1.941
  225   1HD1  ILE  29          1HD1      ILE  29   0.367   1.717  -3.925
  226   2HD1  ILE  29          2HD1      ILE  29   0.624   2.915  -2.657
  227   3HD1  ILE  29          3HD1      ILE  29  -0.990   2.645  -3.299
  228    H    TYR  30           H        TYR  30  -1.509   3.344   1.485
  229    HA   TYR  30           HA       TYR  30   1.192   4.359   1.276
  230   1HB   TYR  30          2HB       TYR  30  -0.977   5.347   3.139
  231   2HB   TYR  30          1HB       TYR  30   0.371   6.269   2.473
  232    HD1  TYR  30           HD1      TYR  30  -2.787   6.657   2.200
  233    HD2  TYR  30           HD2      TYR  30   0.284   5.039  -0.319
  234    HE1  TYR  30           HE1      TYR  30  -4.153   7.170   0.198
  235    HE2  TYR  30           HE2      TYR  30  -1.073   5.552  -2.322
  236    HH   TYR  30           HH       TYR  30  -4.102   7.364  -2.064
  237    H    ALA  31           H        ALA  31  -0.719   3.186   4.064
  238    HA   ALA  31           HA       ALA  31   1.487   3.363   5.903
  239   1HB   ALA  31          1HB       ALA  31   0.031   2.494   7.457
  240   2HB   ALA  31          2HB       ALA  31  -0.605   1.287   6.341
  241   3HB   ALA  31          3HB       ALA  31  -1.156   2.959   6.238
  242    H    HIS  32           H        HIS  32   0.615   1.082   3.450
  243    HA   HIS  32           HA       HIS  32   2.113  -1.157   4.557
  244   1HB   HIS  32          2HB       HIS  32   0.199  -1.428   2.971
  245   2HB   HIS  32          1HB       HIS  32   1.181  -0.678   1.711
  246    HD1  HIS  32           HD1      HIS  32   0.360  -3.910   3.023
  247    HD2  HIS  32           HD2      HIS  32   3.818  -2.191   1.455
  248    HE1  HIS  32           HE1      HIS  32   1.891  -5.825   2.399
  249    H    ILE  33           H        ILE  33   2.622   0.692   1.558
  250    HA   ILE  33           HA       ILE  33   5.295  -0.114   1.110
  251    HB   ILE  33           HB       ILE  33   3.756   1.033  -0.509
  252   1HG1  ILE  33          2HG1      ILE  33   6.286   0.837  -0.791
  253   2HG1  ILE  33          1HG1      ILE  33   5.516   2.128  -1.708
  254   1HG2  ILE  33          1HG2      ILE  33   4.601   3.520   0.991
  255   2HG2  ILE  33          2HG2      ILE  33   2.996   2.793   1.066
  256   3HG2  ILE  33          3HG2      ILE  33   3.590   3.462  -0.453
  257   1HD1  ILE  33          1HD1      ILE  33   7.007   3.528  -0.754
  258   2HD1  ILE  33          2HD1      ILE  33   7.511   2.305   0.410
  259   3HD1  ILE  33          3HD1      ILE  33   6.111   3.317   0.749
  260    H    THR  34           H        THR  34   4.038   2.737   2.802
  261    HA   THR  34           HA       THR  34   6.503   4.044   3.257
  262    HB   THR  34           HB       THR  34   5.364   5.146   5.161
  263    HG1  THR  34           HG1      THR  34   4.195   2.955   5.490
  264   1HG2  THR  34          1HG2      THR  34   4.017   4.769   2.515
  265   2HG2  THR  34          2HG2      THR  34   4.769   6.214   3.194
  266   3HG2  THR  34          3HG2      THR  34   3.181   5.694   3.763
  267    H    LYS  35           H        LYS  35   5.436   1.058   4.541
  268    HA   LYS  35           HA       LYS  35   7.070   1.264   6.980
  269   1HB   LYS  35          2HB       LYS  35   4.886  -0.040   6.820
  270   2HB   LYS  35          1HB       LYS  35   5.770  -1.225   5.857
  271   1HG   LYS  35          2HG       LYS  35   7.157  -1.837   7.644
  272   2HG   LYS  35          1HG       LYS  35   6.855  -0.336   8.519
  273   1HD   LYS  35          2HD       LYS  35   4.609  -2.270   7.974
  274   2HD   LYS  35          1HD       LYS  35   5.680  -2.502   9.356
  275   1HE   LYS  35          2HE       LYS  35   4.429   0.188   8.880
  276   2HE   LYS  35          1HE       LYS  35   3.493  -1.088   9.658
  277   1HZ   LYS  35          1HZ       LYS  35   6.205  -0.335  10.572
  278   2HZ   LYS  35          2HZ       LYS  35   5.030  -1.240  11.401
  279   3HZ   LYS  35          3HZ       LYS  35   4.812   0.428  11.164
  280    H    HIS  36           H        HIS  36   7.351  -0.042   3.731
  281    HA   HIS  36           HA       HIS  36   9.858  -1.448   4.455
  282   1HB   HIS  36          2HB       HIS  36   8.143  -1.373   1.974
  283   2HB   HIS  36          1HB       HIS  36   9.760  -2.075   1.957
  284    HD1  HIS  36           HD1      HIS  36   9.505  -4.550   2.120
  285    HD2  HIS  36           HD2      HIS  36   6.847  -2.566   4.646
  286    HE1  HIS  36           HE1      HIS  36   8.279  -6.343   3.420
  287    H    TYR  37           H        TYR  37   8.811   1.015   2.053
  288    HA   TYR  37           HA       TYR  37  11.584   1.678   1.423
  289   1HB   TYR  37          2HB       TYR  37   9.069   3.232   0.761
  290   2HB   TYR  37          1HB       TYR  37  10.638   3.417  -0.007
  291    HD1  TYR  37           HD1      TYR  37   8.482   3.009  -1.779
  292    HD2  TYR  37           HD2      TYR  37  10.612   0.067   0.511
  293    HE1  TYR  37           HE1      TYR  37   7.844   1.269  -3.420
  294    HE2  TYR  37           HE2      TYR  37   9.972  -1.677  -1.136
  295    HH   TYR  37           HH       TYR  37   7.791  -0.921  -3.837
  296    HA   PRO  38           HA       PRO  38  11.910   4.578   4.790
  297   1HB   PRO  38          2HB       PRO  38  14.436   5.458   4.149
  298   2HB   PRO  38          1HB       PRO  38  14.116   3.926   4.980
  299   1HG   PRO  38          2HG       PRO  38  14.923   4.390   2.149
  300   2HG   PRO  38          1HG       PRO  38  15.183   2.966   3.170
  301   1HD   PRO  38          2HD       PRO  38  13.201   3.235   1.160
  302   2HD   PRO  38          1HD       PRO  38  13.277   1.956   2.391
  303    H    TYR  39           H        TYR  39  11.540   5.195   1.539
  304    HA   TYR  39           HA       TYR  39  12.069   8.085   1.600
  305   1HB   TYR  39          2HB       TYR  39  12.267   6.418  -0.420
  306   2HB   TYR  39          1HB       TYR  39  10.529   6.661  -0.560
  307    HD1  TYR  39           HD1      TYR  39  12.398   7.456  -2.723
  308    HD2  TYR  39           HD2      TYR  39  11.042   9.632   0.721
  309    HE1  TYR  39           HE1      TYR  39  12.790   9.591  -3.917
  310    HE2  TYR  39           HE2      TYR  39  11.432  11.767  -0.472
  311    HH   TYR  39           HH       TYR  39  13.291  12.213  -2.873
  312    H    TYR  40           H        TYR  40   9.197   5.987   1.162
  313    HA   TYR  40           HA       TYR  40   7.397   8.259   1.593
  314   1HB   TYR  40          2HB       TYR  40   6.981   5.297   1.159
  315   2HB   TYR  40          1HB       TYR  40   5.644   6.381   1.534
  316    HD1  TYR  40           HD1      TYR  40   7.480   8.652  -0.088
  317    HD2  TYR  40           HD2      TYR  40   5.606   4.885  -0.976
  318    HE1  TYR  40           HE1      TYR  40   7.320   9.295  -2.472
  319    HE2  TYR  40           HE2      TYR  40   5.451   5.537  -3.367
  320    HH   TYR  40           HH       TYR  40   6.827   8.599  -4.530
  321    H    ARG  41           H        ARG  41   7.963   8.920   3.722
  322    HA   ARG  41           HA       ARG  41   6.851   7.137   5.840
  323   1HB   ARG  41          2HB       ARG  41   9.492   8.614   5.850
  324   2HB   ARG  41          1HB       ARG  41   8.701   8.103   7.341
  325   1HG   ARG  41          2HG       ARG  41   8.563   5.805   5.876
  326   2HG   ARG  41          1HG       ARG  41  10.083   6.483   5.289
  327   1HD   ARG  41          2HD       ARG  41  11.138   6.021   7.230
  328   2HD   ARG  41          1HD       ARG  41   9.836   6.735   8.183
  329    HE   ARG  41           HE       ARG  41   9.917   3.897   7.269
  330   1HH1  ARG  41          1HH1      ARG  41   7.143   4.930   7.644
  331   2HH1  ARG  41          2HH1      ARG  41   6.839   4.575   9.312
  332   1HH2  ARG  41          1HH2      ARG  41  10.184   4.092  10.090
  333   2HH2  ARG  41          2HH2      ARG  41   8.561   4.100  10.697
  334    H    THR  42           H        THR  42   8.379  10.360   5.827
  335    HA   THR  42           HA       THR  42   5.885  11.430   7.064
  336    HB   THR  42           HB       THR  42   7.515  13.442   7.485
  337    HG1  THR  42           HG1      THR  42   9.368  13.030   6.588
  338   1HG2  THR  42          1HG2      THR  42   8.594  11.851   9.384
  339   2HG2  THR  42          2HG2      THR  42   7.265  10.820   8.855
  340   3HG2  THR  42          3HG2      THR  42   6.934  12.442   9.460
  341    H    ALA  43           H        ALA  43   7.048  11.055   4.071
  342    HA   ALA  43           HA       ALA  43   6.027  13.717   3.171
  343   1HB   ALA  43          1HB       ALA  43   7.682  12.506   1.164
  344   2HB   ALA  43          2HB       ALA  43   8.572  12.525   2.687
  345   3HB   ALA  43          3HB       ALA  43   7.936  14.028   2.018
  346    H    ASP  44           H        ASP  44   4.559  13.657   1.434
  347    HA   ASP  44           HA       ASP  44   4.115  11.407  -0.257
  348   1HB   ASP  44          2HB       ASP  44   1.969  10.595   0.714
  349   2HB   ASP  44          1HB       ASP  44   3.341  10.287   1.780
  350    H    LYS  45           H        LYS  45   4.171  14.352  -0.249
  351    HA   LYS  45           HA       LYS  45   1.388  15.105  -0.879
  352   1HB   LYS  45          2HB       LYS  45   3.152  16.580   0.349
  353   2HB   LYS  45          1HB       LYS  45   3.800  16.871  -1.266
  354   1HG   LYS  45          2HG       LYS  45   1.961  18.081  -1.938
  355   2HG   LYS  45          1HG       LYS  45   0.855  17.176  -0.901
  356   1HD   LYS  45          2HD       LYS  45   1.357  18.450   0.979
  357   2HD   LYS  45          1HD       LYS  45   2.952  18.899   0.376
  358   1HE   LYS  45          2HE       LYS  45   0.469  19.831  -1.049
  359   2HE   LYS  45          1HE       LYS  45   1.067  20.700   0.366
  360   1HZ   LYS  45          1HZ       LYS  45   2.768  21.533  -0.780
  361   2HZ   LYS  45          2HZ       LYS  45   1.923  21.064  -2.177
  362   3HZ   LYS  45          3HZ       LYS  45   3.126  20.054  -1.528
  363    H    GLY  46           H        GLY  46   1.707  13.305  -2.682
  364   1HA   GLY  46          2HA       GLY  46   1.716  14.627  -5.206
  365   2HA   GLY  46          1HA       GLY  46   3.286  13.850  -4.984
  366    H    TRP  47           H        TRP  47   3.281  11.493  -4.614
  367    HA   TRP  47           HA       TRP  47   1.601  10.104  -6.428
  368   1HB   TRP  47          2HB       TRP  47   2.558   8.069  -5.569
  369   2HB   TRP  47          1HB       TRP  47   3.829   9.291  -5.573
  370    HD1  TRP  47           HD1      TRP  47   3.932  10.707  -3.086
  371    HE1  TRP  47           HE1      TRP  47   3.986   9.642  -0.744
  372    HE3  TRP  47           HE3      TRP  47   1.923   6.115  -4.149
  373    HZ2  TRP  47           HZ2      TRP  47   3.295   7.178   0.515
  374    HZ3  TRP  47           HZ3      TRP  47   1.649   4.437  -2.349
  375    HH2  TRP  47           HH2      TRP  47   2.329   4.961  -0.025
  376    H    GLN  48           H        GLN  48   0.857  11.251  -3.307
  377    HA   GLN  48           HA       GLN  48  -0.801   9.289  -2.210
  378   1HB   GLN  48          2HB       GLN  48  -0.289  11.815  -1.512
  379   2HB   GLN  48          1HB       GLN  48  -1.854  12.087  -2.280
  380   1HG   GLN  48          2HG       GLN  48  -2.030  11.616   0.174
  381   2HG   GLN  48          1HG       GLN  48  -2.908  10.451  -0.818
  382   1HE2  GLN  48          1HE2      GLN  48   0.588  10.255  -0.811
  383   2HE2  GLN  48          2HE2      GLN  48   0.705   8.871   0.166
  384    H    ASN  49           H        ASN  49  -1.994  11.914  -4.345
  385    HA   ASN  49           HA       ASN  49  -4.464  10.501  -4.917
  386   1HB   ASN  49          2HB       ASN  49  -3.379  13.102  -5.382
  387   2HB   ASN  49          1HB       ASN  49  -3.883  12.442  -6.939
  388   1HD2  ASN  49          1HD2      ASN  49  -6.008  12.993  -7.392
  389   2HD2  ASN  49          2HD2      ASN  49  -7.254  13.117  -6.245
  390    H    SER  50           H        SER  50  -1.297  10.136  -6.028
  391    HA   SER  50           HA       SER  50  -1.819   9.439  -8.783
  392   1HB   SER  50          2HB       SER  50   0.427  10.062  -8.090
  393   2HB   SER  50          1HB       SER  50   0.470   8.737  -6.928
  394    HG   SER  50           HG       SER  50   0.691   7.321  -8.526
  395    H    ILE  51           H        ILE  51  -1.485   7.520  -5.796
  396    HA   ILE  51           HA       ILE  51  -1.680   4.960  -7.045
  397    HB   ILE  51           HB       ILE  51  -1.997   6.049  -4.284
  398   1HG1  ILE  51          2HG1      ILE  51  -0.183   4.674  -3.804
  399   2HG1  ILE  51          1HG1      ILE  51  -0.624   3.487  -5.019
  400   1HG2  ILE  51          1HG2      ILE  51  -2.515   3.450  -3.764
  401   2HG2  ILE  51          2HG2      ILE  51  -3.405   3.627  -5.269
  402   3HG2  ILE  51          3HG2      ILE  51  -3.778   4.668  -3.896
  403   1HD1  ILE  51          1HD1      ILE  51   0.294   6.264  -5.765
  404   2HD1  ILE  51          2HD1      ILE  51   0.204   4.834  -6.793
  405   3HD1  ILE  51          3HD1      ILE  51   1.428   4.934  -5.527
  406    H    ARG  52           H        ARG  52  -4.215   6.939  -5.469
  407    HA   ARG  52           HA       ARG  52  -6.404   5.252  -5.925
  408   1HB   ARG  52          2HB       ARG  52  -6.622   7.266  -4.592
  409   2HB   ARG  52          1HB       ARG  52  -6.280   8.277  -5.994
  410   1HG   ARG  52          2HG       ARG  52  -8.322   7.236  -7.097
  411   2HG   ARG  52          1HG       ARG  52  -8.709   6.535  -5.525
  412   1HD   ARG  52          2HD       ARG  52  -9.029   8.652  -4.527
  413   2HD   ARG  52          1HD       ARG  52  -8.174   9.487  -5.823
  414    HE   ARG  52           HE       ARG  52 -10.925   8.356  -6.054
  415   1HH1  ARG  52          1HH2      ARG  52 -10.355  11.324  -6.066
  416   2HH1  ARG  52          2HH2      ARG  52 -10.383  11.677  -7.762
  417   1HH2  ARG  52          1HH1      ARG  52 -10.082   8.361  -8.728
  418   2HH2  ARG  52          2HH1      ARG  52 -10.228   9.999  -9.270
  419    H    HIS  53           H        HIS  53  -5.268   7.866  -8.102
  420    HA   HIS  53           HA       HIS  53  -7.158   7.145 -10.176
  421   1HB   HIS  53          2HB       HIS  53  -5.960   9.414  -9.737
  422   2HB   HIS  53          1HB       HIS  53  -4.637   8.711 -10.668
  423    HD1  HIS  53           HD1      HIS  53  -8.384   9.332 -11.016
  424    HD2  HIS  53           HD2      HIS  53  -5.000   8.888 -13.410
  425    HE1  HIS  53           HE1      HIS  53  -9.126   9.778 -13.396
  426    H    ASN  54           H        ASN  54  -3.978   6.004  -9.346
  427    HA   ASN  54           HA       ASN  54  -3.285   5.029 -11.986
  428   1HB   ASN  54          2HB       ASN  54  -2.149   4.919  -9.286
  429   2HB   ASN  54          1HB       ASN  54  -1.896   3.427 -10.201
  430   1HD2  ASN  54          1HD2      ASN  54  -0.530   6.451  -9.652
  431   2HD2  ASN  54          2HD2      ASN  54   0.361   6.603 -11.088
  432    H    LEU  55           H        LEU  55  -4.824   3.600  -9.142
  433    HA   LEU  55           HA       LEU  55  -4.941   0.928 -10.157
  434   1HB   LEU  55          2HB       LEU  55  -6.781   2.274  -8.159
  435   2HB   LEU  55          1HB       LEU  55  -6.520   0.535  -8.342
  436    HG   LEU  55           HG       LEU  55  -4.316   2.512  -7.702
  437   1HD1  LEU  55          1HD1      LEU  55  -4.542   1.018  -5.470
  438   2HD1  LEU  55          2HD1      LEU  55  -6.226   1.055  -5.969
  439   3HD1  LEU  55          3HD1      LEU  55  -5.369   2.561  -5.673
  440   1HD2  LEU  55          1HD2      LEU  55  -4.164  -0.002  -8.776
  441   2HD2  LEU  55          2HD2      LEU  55  -4.072  -0.355  -7.054
  442   3HD2  LEU  55          3HD2      LEU  55  -2.899   0.734  -7.795
  443    H    SER  56           H        SER  56  -6.523   3.693 -11.227
  444    HA   SER  56           HA       SER  56  -8.973   2.272 -12.072
  445   1HB   SER  56          2HB       SER  56  -9.582   4.456 -13.087
  446   2HB   SER  56          1HB       SER  56  -9.164   4.627 -11.384
  447    HG   SER  56           HG       SER  56  -7.894   5.567 -13.640
  448    H    LEU  57           H        LEU  57  -5.856   3.224 -13.295
  449    HA   LEU  57           HA       LEU  57  -6.600   2.616 -16.092
  450   1HB   LEU  57          2HB       LEU  57  -3.982   3.471 -14.816
  451   2HB   LEU  57          1HB       LEU  57  -4.202   3.196 -16.545
  452    HG   LEU  57           HG       LEU  57  -6.285   4.861 -16.079
  453   1HD1  LEU  57          1HD1      LEU  57  -6.055   6.151 -14.235
  454   2HD1  LEU  57          2HD1      LEU  57  -4.335   6.398 -14.538
  455   3HD1  LEU  57          3HD1      LEU  57  -4.881   4.961 -13.673
  456   1HD2  LEU  57          1HD2      LEU  57  -3.957   6.505 -16.427
  457   2HD2  LEU  57          2HD2      LEU  57  -5.116   5.977 -17.648
  458   3HD2  LEU  57          3HD2      LEU  57  -3.704   4.984 -17.283
  459    H    ASN  58           H        ASN  58  -4.177   1.453 -13.721
  460    HA   ASN  58           HA       ASN  58  -3.142  -0.721 -15.095
  461   1HB   ASN  58          2HB       ASN  58  -3.896  -0.578 -12.162
  462   2HB   ASN  58          1HB       ASN  58  -2.843  -1.809 -12.864
  463   1HD2  ASN  58          1HD2      ASN  58  -2.814   1.239 -11.389
  464   2HD2  ASN  58          2HD2      ASN  58  -1.274   1.747 -11.892
  465    H    ARG  59           H        ARG  59  -3.773  -2.857 -15.478
  466    HA   ARG  59           HA       ARG  59  -6.685  -3.324 -15.391
  467   1HB   ARG  59          2HB       ARG  59  -6.075  -5.360 -16.752
  468   2HB   ARG  59          1HB       ARG  59  -5.606  -3.825 -17.484
  469   1HG   ARG  59          2HG       ARG  59  -3.507  -4.744 -15.733
  470   2HG   ARG  59          1HG       ARG  59  -3.921  -6.015 -16.885
  471   1HD   ARG  59          2HD       ARG  59  -3.635  -3.212 -17.896
  472   2HD   ARG  59          1HD       ARG  59  -2.174  -4.127 -17.529
  473    HE   ARG  59           HE       ARG  59  -2.637  -5.526 -19.386
  474   1HH1  ARG  59          1HH2      ARG  59  -3.837  -3.113 -20.666
  475   2HH1  ARG  59          2HH2      ARG  59  -5.400  -3.687 -21.143
  476   1HH2  ARG  59          1HH1      ARG  59  -5.303  -6.469 -19.075
  477   2HH2  ARG  59          2HH1      ARG  59  -6.231  -5.587 -20.242
  478    H    TYR  60           H        TYR  60  -4.033  -4.066 -13.383
  479    HA   TYR  60           HA       TYR  60  -5.250  -6.634 -12.530
  480   1HB   TYR  60          2HB       TYR  60  -3.163  -6.127 -10.765
  481   2HB   TYR  60          1HB       TYR  60  -3.100  -7.180 -12.169
  482    HD1  TYR  60           HD1      TYR  60  -1.557  -4.451 -10.583
  483    HD2  TYR  60           HD2      TYR  60  -2.725  -5.868 -14.462
  484    HE1  TYR  60           HE1      TYR  60   0.155  -2.999 -11.639
  485    HE2  TYR  60           HE2      TYR  60  -1.026  -4.414 -15.517
  486    HH   TYR  60           HH       TYR  60   1.487  -3.191 -14.072
  487    H    PHE  61           H        PHE  61  -4.775  -3.340 -11.342
  488    HA   PHE  61           HA       PHE  61  -5.780  -4.041  -8.702
  489   1HB   PHE  61          2HB       PHE  61  -5.355  -1.352 -10.026
  490   2HB   PHE  61          1HB       PHE  61  -5.765  -1.590  -8.319
  491    HD1  PHE  61           HD1      PHE  61  -4.252  -3.043  -6.890
  492    HD2  PHE  61           HD2      PHE  61  -3.133  -1.656 -10.784
  493    HE1  PHE  61           HE1      PHE  61  -1.894  -3.577  -6.401
  494    HE2  PHE  61           HE2      PHE  61  -0.776  -2.171 -10.299
  495    HZ   PHE  61           HZ       PHE  61  -0.143  -3.135  -8.102
  496    H    ILE  62           H        ILE  62  -7.715  -4.957  -8.908
  497    HA   ILE  62           HA       ILE  62  -9.894  -3.624 -10.394
  498    HB   ILE  62           HB       ILE  62 -11.075  -5.645 -10.186
  499   1HG1  ILE  62          2HG1      ILE  62  -9.346  -6.262  -7.764
  500   2HG1  ILE  62          1HG1      ILE  62 -11.038  -5.765  -7.725
  501   1HG2  ILE  62          1HG2      ILE  62  -8.234  -6.635  -9.872
  502   2HG2  ILE  62          2HG2      ILE  62  -8.813  -5.871 -11.353
  503   3HG2  ILE  62          3HG2      ILE  62  -9.546  -7.373 -10.792
  504   1HD1  ILE  62          1HD1      ILE  62  -9.893  -8.406  -8.241
  505   2HD1  ILE  62          2HD1      ILE  62 -11.038  -7.913  -9.488
  506   3HD1  ILE  62          3HD1      ILE  62 -11.543  -7.968  -7.800
  507    H    LYS  63           H        LYS  63 -12.103  -4.152  -8.840
  508    HA   LYS  63           HA       LYS  63 -11.604  -2.466  -6.422
  509   1HB   LYS  63          2HB       LYS  63 -13.665  -2.434  -8.521
  510   2HB   LYS  63          1HB       LYS  63 -14.323  -2.364  -6.885
  511   1HG   LYS  63          2HG       LYS  63 -13.864  -0.149  -6.975
  512   2HG   LYS  63          1HG       LYS  63 -12.180  -0.623  -6.750
  513   1HD   LYS  63          2HD       LYS  63 -11.708   0.229  -8.777
  514   2HD   LYS  63          1HD       LYS  63 -12.756  -0.991  -9.500
  515   1HE   LYS  63          2HE       LYS  63 -14.337   1.131  -8.323
  516   2HE   LYS  63          1HE       LYS  63 -13.176   1.792  -9.475
  517   1HZ   LYS  63          1HZ       LYS  63 -15.246  -0.269  -9.943
  518   2HZ   LYS  63          2HZ       LYS  63 -13.950  -0.034 -11.015
  519   3HZ   LYS  63          3HZ       LYS  63 -15.056   1.224 -10.726
  520    H    VAL  64           H        VAL  64 -12.210  -3.309  -4.450
  521    HA   VAL  64           HA       VAL  64 -12.914  -6.096  -4.311
  522    HB   VAL  64           HB       VAL  64 -12.150  -3.984  -2.433
  523   1HG1  VAL  64          1HG1      VAL  64 -13.101  -5.205  -0.447
  524   2HG1  VAL  64          2HG1      VAL  64 -14.111  -6.124  -1.564
  525   3HG1  VAL  64          3HG1      VAL  64 -14.314  -4.378  -1.424
  526   1HG2  VAL  64          1HG2      VAL  64 -11.776  -6.803  -1.707
  527   2HG2  VAL  64          2HG2      VAL  64 -10.578  -5.526  -1.912
  528   3HG2  VAL  64          3HG2      VAL  64 -11.175  -6.406  -3.318
  529    HA   PRO  65           HA       PRO  65 -17.155  -4.463  -2.859
  530   1HB   PRO  65          2HB       PRO  65 -17.562  -1.746  -3.021
  531   2HB   PRO  65          1HB       PRO  65 -16.904  -2.555  -1.587
  532   1HG   PRO  65          2HG       PRO  65 -15.486  -0.902  -3.626
  533   2HG   PRO  65          1HG       PRO  65 -15.071  -1.186  -1.927
  534   1HD   PRO  65          2HD       PRO  65 -13.863  -2.444  -4.159
  535   2HD   PRO  65          1HD       PRO  65 -13.700  -2.950  -2.468
  536    H    ARG  66           H        ARG  66 -19.142  -3.461  -4.055
  537    HA   ARG  66           HA       ARG  66 -18.814  -2.498  -6.752
  538   1HB   ARG  66          2HB       ARG  66 -18.122  -5.015  -6.808
  539   2HB   ARG  66          1HB       ARG  66 -19.851  -5.323  -6.652
  540   1HG   ARG  66          2HG       ARG  66 -19.594  -3.318  -8.625
  541   2HG   ARG  66          1HG       ARG  66 -18.362  -4.525  -8.993
  542   1HD   ARG  66          2HD       ARG  66 -20.998  -5.626  -8.226
  543   2HD   ARG  66          1HD       ARG  66 -20.972  -4.744  -9.754
  544    HE   ARG  66           HE       ARG  66 -19.115  -6.303 -10.453
  545   1HH1  ARG  66          1HH1      ARG  66 -18.533  -7.612  -7.867
  546   2HH1  ARG  66          2HH1      ARG  66 -19.440  -9.083  -7.967
  547   1HH2  ARG  66          1HH2      ARG  66 -21.443  -7.983 -10.576
  548   2HH2  ARG  66          2HH2      ARG  66 -21.088  -9.293  -9.500
  549    H    SER  67           H        SER  67 -21.029  -4.640  -4.901
  550    HA   SER  67           HA       SER  67 -23.110  -2.544  -5.115
  551   1HB   SER  67          2HB       SER  67 -23.255  -5.262  -6.388
  552   2HB   SER  67          1HB       SER  67 -24.725  -4.502  -5.786
  553    HG   SER  67           HG       SER  67 -24.101  -4.048  -8.037
  554    H    GLN  68           H        GLN  68 -21.507  -3.844  -2.943
  555    HA   GLN  68           HA       GLN  68 -23.790  -5.002  -1.390
  556   1HB   GLN  68          2HB       GLN  68 -20.820  -5.486  -0.998
  557   2HB   GLN  68          1HB       GLN  68 -22.123  -6.225  -0.065
  558   1HG   GLN  68          2HG       GLN  68 -22.432  -7.806  -1.637
  559   2HG   GLN  68          1HG       GLN  68 -22.589  -6.584  -2.899
  560   1HE2  GLN  68          1HE2      GLN  68 -20.684  -9.180  -1.975
  561   2HE2  GLN  68          2HE2      GLN  68 -19.250  -8.761  -2.781
  562    H    GLU  69           H        GLU  69 -23.732  -4.475   0.959
  563    HA   GLU  69           HA       GLU  69 -22.569  -1.754   1.391
  564   1HB   GLU  69          2HB       GLU  69 -24.358  -1.543   3.153
  565   2HB   GLU  69          1HB       GLU  69 -24.987  -1.707   1.514
  566   1HG   GLU  69          2HG       GLU  69 -24.589  -4.321   2.667
  567   2HG   GLU  69          1HG       GLU  69 -25.582  -3.339   3.746
  568    H    GLU  70           H        GLU  70 -20.598  -3.266   1.883
  569    HA   GLU  70           HA       GLU  70 -20.683  -4.670   4.441
  570   1HB   GLU  70          2HB       GLU  70 -18.786  -4.313   2.243
  571   2HB   GLU  70          1HB       GLU  70 -18.006  -4.250   3.826
  572   1HG   GLU  70          2HG       GLU  70 -20.010  -6.375   3.644
  573   2HG   GLU  70          1HG       GLU  70 -18.707  -6.567   2.469
  574    HA   PRO  71           HA       PRO  71 -19.723  -1.214   6.985
  575   1HB   PRO  71          2HB       PRO  71 -18.729  -2.600   9.141
  576   2HB   PRO  71          1HB       PRO  71 -20.456  -2.498   8.756
  577   1HG   PRO  71          2HG       PRO  71 -18.582  -4.790   8.384
  578   2HG   PRO  71          1HG       PRO  71 -20.337  -4.803   8.627
  579   1HD   PRO  71          2HD       PRO  71 -19.007  -5.149   6.153
  580   2HD   PRO  71          1HD       PRO  71 -20.739  -4.818   6.369
  581    H    GLY  72           H        GLY  72 -17.959   0.126   6.858
  582   1HA   GLY  72          2HA       GLY  72 -15.321  -0.606   7.656
  583   2HA   GLY  72          1HA       GLY  72 -15.418  -0.701   5.894
  584    H    LYS  73           H        LYS  73 -14.791   1.149   4.916
  585    HA   LYS  73           HA       LYS  73 -15.209   3.725   6.380
  586   1HB   LYS  73          2HB       LYS  73 -12.819   2.975   5.895
  587   2HB   LYS  73          1HB       LYS  73 -13.188   3.213   4.187
  588   1HG   LYS  73          2HG       LYS  73 -14.033   5.492   5.791
  589   2HG   LYS  73          1HG       LYS  73 -12.306   5.173   5.970
  590   1HD   LYS  73          2HD       LYS  73 -11.849   5.625   3.762
  591   2HD   LYS  73          1HD       LYS  73 -13.429   5.063   3.210
  592   1HE   LYS  73          2HE       LYS  73 -13.764   7.349   4.935
  593   2HE   LYS  73          1HE       LYS  73 -12.619   7.739   3.652
  594   1HZ   LYS  73          1HZ       LYS  73 -14.294   7.879   2.237
  595   2HZ   LYS  73          2HZ       LYS  73 -15.398   7.528   3.480
  596   3HZ   LYS  73          3HZ       LYS  73 -14.734   6.271   2.548
  597    H    GLY  74           H        GLY  74 -14.750   2.638   2.994
  598   1HA   GLY  74          2HA       GLY  74 -17.326   3.684   2.171
  599   2HA   GLY  74          1HA       GLY  74 -16.004   4.748   1.691
  600    H    SER  75           H        SER  75 -14.047   2.717   1.219
  601    HA   SER  75           HA       SER  75 -15.211   0.891  -0.781
  602   1HB   SER  75          2HB       SER  75 -13.058   2.156  -2.132
  603   2HB   SER  75          1HB       SER  75 -14.765   2.201  -2.565
  604    HG   SER  75           HG       SER  75 -13.473   3.906  -0.691
  605    H    PHE  76           H        PHE  76 -13.278  -0.350  -1.863
  606    HA   PHE  76           HA       PHE  76 -10.908  -0.528  -0.108
  607   1HB   PHE  76          2HB       PHE  76 -13.033  -2.174   0.438
  608   2HB   PHE  76          1HB       PHE  76 -12.098  -3.166  -0.680
  609    HD1  PHE  76           HD1      PHE  76  -9.567  -3.413  -0.225
  610    HD2  PHE  76           HD2      PHE  76 -12.370  -1.971   2.693
  611    HE1  PHE  76           HE1      PHE  76  -7.955  -3.940   1.583
  612    HE2  PHE  76           HE2      PHE  76 -10.757  -2.498   4.502
  613    HZ   PHE  76           HZ       PHE  76  -8.549  -3.483   3.948
  614    H    TRP  77           H        TRP  77  -9.210  -0.626  -1.477
  615    HA   TRP  77           HA       TRP  77  -9.617  -1.353  -4.285
  616   1HB   TRP  77          2HB       TRP  77  -7.471  -0.120  -2.648
  617   2HB   TRP  77          1HB       TRP  77  -6.937  -1.030  -4.060
  618    HD1  TRP  77           HD1      TRP  77  -8.171   2.281  -3.085
  619    HE1  TRP  77           HE1      TRP  77  -8.823   3.660  -5.162
  620    HE3  TRP  77           HE3      TRP  77  -8.227  -1.411  -6.607
  621    HZ2  TRP  77           HZ2      TRP  77  -9.295   3.251  -7.950
  622    HZ3  TRP  77           HZ3      TRP  77  -8.780  -0.888  -8.963
  623    HH2  TRP  77           HH2      TRP  77  -9.308   1.436  -9.637
  624    H    ARG  78           H        ARG  78  -8.340  -3.028  -5.363
  625    HA   ARG  78           HA       ARG  78  -6.937  -5.022  -3.744
  626   1HB   ARG  78          2HB       ARG  78  -9.410  -5.534  -3.439
  627   2HB   ARG  78          1HB       ARG  78  -9.465  -5.883  -5.167
  628   1HG   ARG  78          2HG       ARG  78  -7.221  -7.224  -3.913
  629   2HG   ARG  78          1HG       ARG  78  -8.740  -7.667  -3.133
  630   1HD   ARG  78          2HD       ARG  78  -8.756  -7.576  -6.104
  631   2HD   ARG  78          1HD       ARG  78  -7.841  -8.890  -5.363
  632    HE   ARG  78           HE       ARG  78 -10.749  -8.581  -5.314
  633   1HH1  ARG  78          1HH1      ARG  78  -9.000 -11.116  -5.548
  634   2HH1  ARG  78          2HH1      ARG  78  -9.373 -11.894  -4.047
  635   1HH2  ARG  78          1HH2      ARG  78 -10.786  -9.062  -2.627
  636   2HH2  ARG  78          2HH2      ARG  78 -10.386 -10.732  -2.393
  637    H    ILE  79           H        ILE  79  -5.911  -6.659  -5.118
  638    HA   ILE  79           HA       ILE  79  -5.842  -5.845  -8.000
  639    HB   ILE  79           HB       ILE  79  -3.723  -5.397  -6.801
  640   1HG1  ILE  79          2HG1      ILE  79  -2.968  -7.691  -8.496
  641   2HG1  ILE  79          1HG1      ILE  79  -4.070  -6.535  -9.244
  642   1HG2  ILE  79          1HG2      ILE  79  -2.481  -7.763  -6.414
  643   2HG2  ILE  79          2HG2      ILE  79  -4.133  -8.212  -5.989
  644   3HG2  ILE  79          3HG2      ILE  79  -3.328  -6.896  -5.133
  645   1HD1  ILE  79          1HD1      ILE  79  -1.507  -6.102  -9.443
  646   2HD1  ILE  79          2HD1      ILE  79  -1.632  -5.571  -7.767
  647   3HD1  ILE  79          3HD1      ILE  79  -2.558  -4.750  -9.024
  648    H    ASP  80           H        ASP  80  -5.483  -7.665  -9.527
  649    HA   ASP  80           HA       ASP  80  -7.212  -9.863  -8.935
  650   1HB   ASP  80          2HB       ASP  80  -6.092  -8.777 -11.224
  651   2HB   ASP  80          1HB       ASP  80  -5.320 -10.359 -11.107
  652    HA   PRO  81           HA       PRO  81  -4.339 -12.536  -6.935
  653   1HB   PRO  81          2HB       PRO  81  -5.889 -14.805  -7.039
  654   2HB   PRO  81          1HB       PRO  81  -6.180 -13.473  -5.906
  655   1HG   PRO  81          2HG       PRO  81  -7.700 -14.213  -8.358
  656   2HG   PRO  81          1HG       PRO  81  -8.247 -13.332  -6.922
  657   1HD   PRO  81          2HD       PRO  81  -7.546 -12.189  -9.425
  658   2HD   PRO  81          1HD       PRO  81  -7.828 -11.306  -7.909
  659    H    ALA  82           H        ALA  82  -5.934 -13.700  -9.913
  660    HA   ALA  82           HA       ALA  82  -3.851 -15.657 -10.465
  661   1HB   ALA  82          1HB       ALA  82  -5.829 -14.538 -12.461
  662   2HB   ALA  82          2HB       ALA  82  -6.289 -15.743 -11.259
  663   3HB   ALA  82          3HB       ALA  82  -5.061 -16.127 -12.465
  664    H    SER  83           H        SER  83  -3.985 -12.298 -10.753
  665    HA   SER  83           HA       SER  83  -1.915 -12.348 -12.912
  666   1HB   SER  83          2HB       SER  83  -3.687 -10.057 -12.009
  667   2HB   SER  83          1HB       SER  83  -2.458  -9.951 -13.265
  668    HG   SER  83           HG       SER  83  -4.989 -11.015 -13.333
  669    H    GLU  84           H        GLU  84  -2.461 -11.978  -9.602
  670    HA   GLU  84           HA       GLU  84  -0.658  -9.925  -8.885
  671   1HB   GLU  84          2HB       GLU  84  -2.219 -11.062  -7.307
  672   2HB   GLU  84          1HB       GLU  84  -1.195 -12.497  -7.376
  673   1HG   GLU  84          2HG       GLU  84   0.640 -10.524  -6.830
  674   2HG   GLU  84          1HG       GLU  84  -0.774  -9.963  -5.938
  675    H    ALA  85           H        ALA  85  -0.044 -13.440  -9.250
  676    HA   ALA  85           HA       ALA  85   2.706 -13.398  -8.625
  677   1HB   ALA  85          1HB       ALA  85   1.102 -15.381  -9.301
  678   2HB   ALA  85          2HB       ALA  85   2.832 -15.507  -9.618
  679   3HB   ALA  85          3HB       ALA  85   1.726 -15.069 -10.921
  680    H    LYS  86           H        LYS  86   1.046 -12.134 -11.395
  681    HA   LYS  86           HA       LYS  86   3.474 -11.948 -13.038
  682   1HB   LYS  86          2HB       LYS  86   1.323 -12.272 -14.150
  683   2HB   LYS  86          1HB       LYS  86   0.690 -10.800 -13.412
  684   1HG   LYS  86          2HG       LYS  86   3.226 -10.407 -14.851
  685   2HG   LYS  86          1HG       LYS  86   1.894 -10.924 -15.884
  686   1HD   LYS  86          2HD       LYS  86   0.592  -9.046 -15.372
  687   2HD   LYS  86          1HD       LYS  86   1.469  -8.727 -13.875
  688   1HE   LYS  86          2HE       LYS  86   2.710  -8.480 -16.627
  689   2HE   LYS  86          1HE       LYS  86   2.009  -7.123 -15.747
  690   1HZ   LYS  86          1HZ       LYS  86   4.527  -8.430 -15.368
  691   2HZ   LYS  86          2HZ       LYS  86   3.639  -8.317 -13.924
  692   3HZ   LYS  86          3HZ       LYS  86   4.001  -6.916 -14.814
  693    H    LEU  87           H        LEU  87   1.210  -9.488 -11.721
  694    HA   LEU  87           HA       LEU  87   2.803  -7.241 -12.188
  695   1HB   LEU  87          2HB       LEU  87   1.693  -6.475  -9.866
  696   2HB   LEU  87          1HB       LEU  87   0.777  -6.556 -11.356
  697    HG   LEU  87           HG       LEU  87   0.873  -9.129  -9.967
  698   1HD1  LEU  87          1HD1      LEU  87   0.472  -8.407  -7.871
  699   2HD1  LEU  87          2HD1      LEU  87  -1.053  -7.752  -8.466
  700   3HD1  LEU  87          3HD1      LEU  87   0.383  -6.730  -8.410
  701   1HD2  LEU  87          1HD2      LEU  87  -1.569  -8.984 -10.347
  702   2HD2  LEU  87          2HD2      LEU  87  -0.677  -8.595 -11.818
  703   3HD2  LEU  87          3HD2      LEU  87  -1.389  -7.305 -10.850
  704    H    VAL  88           H        VAL  88   2.618  -8.992  -9.118
  705    HA   VAL  88           HA       VAL  88   4.577  -7.775  -7.641
  706    HB   VAL  88           HB       VAL  88   5.064 -10.022  -6.726
  707   1HG1  VAL  88          1HG1      VAL  88   2.279  -9.017  -7.164
  708   2HG1  VAL  88          2HG1      VAL  88   3.219  -9.056  -5.673
  709   3HG1  VAL  88          3HG1      VAL  88   2.511 -10.542  -6.310
  710   1HG2  VAL  88          1HG2      VAL  88   3.276 -11.708  -7.874
  711   2HG2  VAL  88          2HG2      VAL  88   4.971 -11.625  -8.353
  712   3HG2  VAL  88          3HG2      VAL  88   3.750 -10.742  -9.271
  713    H    GLU  89           H        GLU  89   5.117  -9.842 -10.444
  714    HA   GLU  89           HA       GLU  89   7.833 -10.476 -10.085
  715   1HB   GLU  89          2HB       GLU  89   6.079 -10.887 -12.110
  716   2HB   GLU  89          1HB       GLU  89   7.060  -9.604 -12.822
  717   1HG   GLU  89          2HG       GLU  89   8.956 -10.905 -12.898
  718   2HG   GLU  89          1HG       GLU  89   8.512 -11.818 -11.454
  719    H    GLN  90           H        GLN  90   6.464  -7.573 -11.671
  720    HA   GLN  90           HA       GLN  90   9.091  -6.296 -11.777
  721   1HB   GLN  90          2HB       GLN  90   7.049  -5.923 -13.359
  722   2HB   GLN  90          1HB       GLN  90   6.467  -4.846 -12.089
  723   1HG   GLN  90          2HG       GLN  90   7.999  -3.252 -12.588
  724   2HG   GLN  90          1HG       GLN  90   9.299  -4.434 -12.740
  725   1HE2  GLN  90          1HE2      GLN  90  10.157  -4.318 -14.816
  726   2HE2  GLN  90          2HE2      GLN  90   9.249  -4.125 -16.238
  727    H    ALA  91           H        ALA  91   6.677  -6.724  -9.408
  728    HA   ALA  91           HA       ALA  91   6.806  -4.267  -7.991
  729   1HB   ALA  91          1HB       ALA  91   6.307  -7.078  -7.027
  730   2HB   ALA  91          2HB       ALA  91   5.118  -5.818  -7.351
  731   3HB   ALA  91          3HB       ALA  91   6.207  -5.671  -5.975
  732    H    PHE  92           H        PHE  92   8.825  -7.197  -7.703
  733    HA   PHE  92           HA       PHE  92  10.538  -5.861  -5.708
  734   1HB   PHE  92          2HB       PHE  92  11.174  -8.488  -7.027
  735   2HB   PHE  92          1HB       PHE  92  11.567  -7.946  -5.396
  736    HD1  PHE  92           HD1      PHE  92   9.437  -7.323  -3.905
  737    HD2  PHE  92           HD2      PHE  92   9.396  -9.967  -7.292
  738    HE1  PHE  92           HE1      PHE  92   7.367  -8.388  -3.050
  739    HE2  PHE  92           HE2      PHE  92   7.325 -11.030  -6.436
  740    HZ   PHE  92           HZ       PHE  92   6.311 -10.241  -4.315
  741    H    ARG  93           H        ARG  93  10.380  -6.069  -9.102
  742    HA   ARG  93           HA       ARG  93  13.127  -6.156  -9.822
  743   1HB   ARG  93          2HB       ARG  93  11.059  -6.222 -11.350
  744   2HB   ARG  93          1HB       ARG  93  11.078  -4.461 -11.250
  745   1HG   ARG  93          2HG       ARG  93  13.352  -4.395 -12.128
  746   2HG   ARG  93          1HG       ARG  93  13.428  -6.158 -12.133
  747   1HD   ARG  93          2HD       ARG  93  12.471  -6.215 -14.165
  748   2HD   ARG  93          1HD       ARG  93  11.069  -5.342 -13.544
  749    HE   ARG  93           HE       ARG  93  12.416  -3.227 -14.019
  750   1HH1  ARG  93          1HH1      ARG  93  12.058  -5.858 -16.076
  751   2HH1  ARG  93          2HH1      ARG  93  13.202  -5.315 -17.258
  752   1HH2  ARG  93          1HH2      ARG  93  14.331  -2.664 -15.327
  753   2HH2  ARG  93          2HH2      ARG  93  14.489  -3.504 -16.833
  754    H    LYS  94           H        LYS  94  14.738  -4.738  -9.410
  755    HA   LYS  94           HA       LYS  94  14.141  -2.145  -8.176
  756   1HB   LYS  94          2HB       LYS  94  16.124  -3.783  -7.668
  757   2HB   LYS  94          1HB       LYS  94  16.882  -3.017  -9.064
  758   1HG   LYS  94          2HG       LYS  94  16.050  -0.807  -7.771
  759   2HG   LYS  94          1HG       LYS  94  16.257  -1.879  -6.386
  760   1HD   LYS  94          2HD       LYS  94  18.523  -2.373  -7.909
  761   2HD   LYS  94          1HD       LYS  94  18.287  -0.634  -8.089
  762   1HE   LYS  94          2HE       LYS  94  19.613  -0.862  -6.132
  763   2HE   LYS  94          1HE       LYS  94  17.977  -0.582  -5.536
  764   1HZ   LYS  94          1HZ       LYS  94  18.487  -3.349  -6.004
  765   2HZ   LYS  94          2HZ       LYS  94  17.929  -2.578  -4.597
  766   3HZ   LYS  94          3HZ       LYS  94  19.596  -2.693  -4.902
  767    H    ARG  95           H        ARG  95  13.844  -0.310  -9.362
  768    HA   ARG  95           HA       ARG  95  14.257  -0.304 -12.236
  769   1HB   ARG  95          2HB       ARG  95  13.802   2.149 -10.534
  770   2HB   ARG  95          1HB       ARG  95  13.309   1.868 -12.205
  771   1HG   ARG  95          2HG       ARG  95  12.096  -0.218 -10.859
  772   2HG   ARG  95          1HG       ARG  95  11.962   1.114  -9.711
  773   1HD   ARG  95          2HD       ARG  95  10.057   0.906 -11.399
  774   2HD   ARG  95          1HD       ARG  95  10.821   2.492 -11.292
  775    HE   ARG  95           HE       ARG  95  11.907   2.062 -13.420
  776   1HH1  ARG  95          1HH2      ARG  95  12.127  -0.940 -13.114
  777   2HH1  ARG  95          2HH2      ARG  95  10.977  -1.494 -14.284
  778   1HH2  ARG  95          1HH1      ARG  95   9.408   1.586 -14.584
  779   2HH2  ARG  95          2HH1      ARG  95   9.435  -0.061 -15.119
  780    H    ARG  96           H        ARG  96  15.923   0.652 -13.396
  781    HA   ARG  96           HA       ARG  96  18.144   1.846 -11.784
  782   1HB   ARG  96          2HB       ARG  96  18.494   0.275 -14.349
  783   2HB   ARG  96          1HB       ARG  96  19.747   0.780 -13.213
  784   1HG   ARG  96          2HG       ARG  96  18.916  -0.719 -11.516
  785   2HG   ARG  96          1HG       ARG  96  17.489  -1.102 -12.481
  786   1HD   ARG  96          2HD       ARG  96  18.618  -2.583 -13.784
  787   2HD   ARG  96          1HD       ARG  96  20.049  -1.557 -13.871
  788    HE   ARG  96           HE       ARG  96  19.566  -2.938 -11.301
  789   1HH1  ARG  96          1HH2      ARG  96  21.916  -1.802 -13.320
  790   2HH1  ARG  96          2HH2      ARG  96  22.918  -3.214 -13.280
  791   1HH2  ARG  96          1HH1      ARG  96  20.556  -5.172 -11.666
  792   2HH2  ARG  96          2HH1      ARG  96  22.149  -5.121 -12.343
  793    H    GLN  97           H        GLN  97  16.528   3.726 -12.511
  794    HA   GLN  97           HA       GLN  97  17.183   4.638 -15.263
  795   1HB   GLN  97          2HB       GLN  97  15.299   5.875 -13.233
  796   2HB   GLN  97          1HB       GLN  97  15.416   6.279 -14.947
  797   1HG   GLN  97          2HG       GLN  97  14.996   3.412 -14.417
  798   2HG   GLN  97          1HG       GLN  97  13.663   4.442 -13.897
  799   1HE2  GLN  97          1HE2      GLN  97  12.610   3.165 -15.824
  800   2HE2  GLN  97          2HE2      GLN  97  12.754   3.876 -17.358
  801    H    ARG  98           H        ARG  98  18.396   6.500 -15.632
  802    HA   ARG  98           HA       ARG  98  19.657   7.715 -13.208
  803   1HB   ARG  98          2HB       ARG  98  20.704   6.932 -15.879
  804   2HB   ARG  98          1HB       ARG  98  21.340   8.429 -15.194
  805   1HG   ARG  98          2HG       ARG  98  22.276   7.347 -13.351
  806   2HG   ARG  98          1HG       ARG  98  21.179   5.970 -13.474
  807   1HD   ARG  98          2HD       ARG  98  22.516   5.922 -15.902
  808   2HD   ARG  98          1HD       ARG  98  23.774   6.402 -14.764
  809    HE   ARG  98           HE       ARG  98  22.657   3.774 -14.968
  810   1HH1  ARG  98          1HH2      ARG  98  23.857   6.161 -12.790
  811   2HH1  ARG  98          2HH2      ARG  98  24.133   5.037 -11.502
  812   1HH2  ARG  98          1HH1      ARG  98  22.908   2.311 -13.258
  813   2HH2  ARG  98          2HH1      ARG  98  23.597   2.860 -11.766
  814    H    GLY  99           H        GLY  99  17.349   8.324 -15.491
  815   1HA   GLY  99          2HA       GLY  99  18.020  11.233 -15.633
  816   2HA   GLY  99          1HA       GLY  99  16.963  10.400 -16.774
  817    H    VAL 100           H        VAL 100  15.436   8.916 -14.869
  818    HA   VAL 100           HA       VAL 100  13.988  11.149 -13.500
  819    HB   VAL 100           HB       VAL 100  12.759   8.541 -14.419
  820   1HG1  VAL 100          1HG1      VAL 100  11.163  11.004 -14.297
  821   2HG1  VAL 100          2HG1      VAL 100  11.843  10.536 -12.739
  822   3HG1  VAL 100          3HG1      VAL 100  10.819   9.410 -13.629
  823   1HG2  VAL 100          1HG2      VAL 100  11.953   9.770 -16.395
  824   2HG2  VAL 100          2HG2      VAL 100  13.717   9.747 -16.365
  825   3HG2  VAL 100          3HG2      VAL 100  12.846  11.202 -15.881
  826    H    SER 101           HN       SER 101  13.150  10.695 -11.391
  827    HA   SER 101           HA       SER 101  13.391   9.804  -9.227
  828   1HB   SER 101          2HB       SER 101  11.896   8.116 -10.341
  829   2HB   SER 101          1HB       SER 101  13.331   7.178 -10.744
  830    HG   SER 101           HG       SER 101  12.356   6.497  -8.782
  Start of MODEL   20
    1   1H    GLU   1          1HT       GLU   1   9.652  17.129  -4.564
    2   2H    GLU   1          2HT       GLU   1  10.897  18.196  -5.008
    3   3H    GLU   1          3HT       GLU   1   9.893  18.560  -3.686
    4    HA   GLU   1           HA       GLU   1  12.250  16.934  -3.797
    5   1HB   GLU   1          2HB       GLU   1  10.729  18.640  -1.940
    6   2HB   GLU   1          1HB       GLU   1  11.504  17.257  -1.168
    7   1HG   GLU   1          2HG       GLU   1  13.171  18.716  -3.136
    8   2HG   GLU   1          1HG       GLU   1  12.786  19.599  -1.660
    9    H    SER   2           H        SER   2  11.637  14.808  -4.421
   10    HA   SER   2           HA       SER   2  10.524  13.194  -2.261
   11   1HB   SER   2          2HB       SER   2   8.763  14.175  -4.303
   12   2HB   SER   2          1HB       SER   2   8.939  12.433  -4.499
   13    HG   SER   2           HG       SER   2   7.307  13.363  -2.926
   14    H    LYS   3           H        LYS   3  11.117  11.012  -2.506
   15    HA   LYS   3           HA       LYS   3  13.144  10.476  -4.546
   16   1HB   LYS   3          2HB       LYS   3  13.505   8.413  -3.378
   17   2HB   LYS   3          1HB       LYS   3  13.221   9.635  -2.141
   18   1HG   LYS   3          2HG       LYS   3  10.987   8.887  -1.777
   19   2HG   LYS   3          1HG       LYS   3  10.993   7.912  -3.246
   20   1HD   LYS   3          2HD       LYS   3  12.993   7.366  -1.070
   21   2HD   LYS   3          1HD       LYS   3  11.355   6.724  -0.950
   22   1HE   LYS   3          2HE       LYS   3  11.629   5.304  -2.750
   23   2HE   LYS   3          1HE       LYS   3  12.805   6.359  -3.536
   24   1HZ   LYS   3          1HZ       LYS   3  13.279   4.691  -1.125
   25   2HZ   LYS   3          2HZ       LYS   3  14.410   5.756  -1.811
   26   3HZ   LYS   3          3HZ       LYS   3  13.884   4.396  -2.682
   27    HA   PRO   4           HA       PRO   4  10.360   8.542  -7.376
   28   1HB   PRO   4          2HB       PRO   4  12.250   7.238  -8.884
   29   2HB   PRO   4          1HB       PRO   4  11.953   8.981  -8.984
   30   1HG   PRO   4          2HG       PRO   4  14.237   7.540  -7.730
   31   2HG   PRO   4          1HG       PRO   4  14.165   9.192  -8.365
   32   1HD   PRO   4          2HD       PRO   4  14.036   8.432  -5.625
   33   2HD   PRO   4          1HD       PRO   4  13.717  10.048  -6.289
   34    HA   PRO   5           HA       PRO   5  10.275   4.454  -5.351
   35   1HB   PRO   5          2HB       PRO   5   7.532   4.233  -5.494
   36   2HB   PRO   5          1HB       PRO   5   8.352   5.152  -4.227
   37   1HG   PRO   5          2HG       PRO   5   6.849   6.137  -6.601
   38   2HG   PRO   5          1HG       PRO   5   7.119   6.924  -5.044
   39   1HD   PRO   5          2HD       PRO   5   8.503   7.466  -7.463
   40   2HD   PRO   5          1HD       PRO   5   8.941   8.047  -5.847
   41    H    TYR   6           H        TYR   6   8.451   2.542  -6.283
   42    HA   TYR   6           HA       TYR   6   9.374   2.089  -9.005
   43   1HB   TYR   6          2HB       TYR   6   7.098   0.546  -7.841
   44   2HB   TYR   6          1HB       TYR   6   8.465  -0.035  -8.794
   45    HD1  TYR   6           HD1      TYR   6  10.819   0.103  -7.674
   46    HD2  TYR   6           HD2      TYR   6   7.116   0.305  -5.506
   47    HE1  TYR   6           HE1      TYR   6  12.002  -0.535  -5.587
   48    HE2  TYR   6           HE2      TYR   6   8.298  -0.334  -3.422
   49    HH   TYR   6           HH       TYR   6  10.791  -1.784  -3.102
   50    H    SER   7           H        SER   7   7.530   1.597 -10.717
   51    HA   SER   7           HA       SER   7   6.153   3.964 -11.269
   52   1HB   SER   7          2HB       SER   7   5.325   1.111 -11.898
   53   2HB   SER   7          1HB       SER   7   4.538   2.529 -12.585
   54    HG   SER   7           HG       SER   7   6.636   1.326 -13.510
   55    H    TYR   8           H        TYR   8   3.736   4.420 -10.964
   56    HA   TYR   8           HA       TYR   8   3.071   3.768  -8.191
   57   1HB   TYR   8          2HB       TYR   8   1.725   5.472 -10.286
   58   2HB   TYR   8          1HB       TYR   8   1.009   5.177  -8.696
   59    HD1  TYR   8           HD1      TYR   8   3.137   5.184  -6.814
   60    HD2  TYR   8           HD2      TYR   8   2.725   7.591 -10.347
   61    HE1  TYR   8           HE1      TYR   8   4.628   6.889  -5.825
   62    HE2  TYR   8           HE2      TYR   8   4.214   9.298  -9.358
   63    HH   TYR   8           HH       TYR   8   4.932  10.018  -7.086
   64    H    ALA   9           H        ALA   9   2.941   1.902 -10.720
   65    HA   ALA   9           HA       ALA   9   0.296   0.697 -10.046
   66   1HB   ALA   9          1HB       ALA   9   0.292   1.271 -12.382
   67   2HB   ALA   9          2HB       ALA   9   0.580  -0.466 -12.302
   68   3HB   ALA   9          3HB       ALA   9   1.922   0.638 -12.603
   69    H    GLN  10           H        GLN  10   3.747   0.283 -10.371
   70    HA   GLN  10           HA       GLN  10   3.657  -2.620  -9.725
   71   1HB   GLN  10          2HB       GLN  10   5.340  -1.790 -11.363
   72   2HB   GLN  10          1HB       GLN  10   5.991  -0.710 -10.135
   73   1HG   GLN  10          2HG       GLN  10   6.334  -2.806  -8.698
   74   2HG   GLN  10          1HG       GLN  10   6.041  -3.728 -10.172
   75   1HE2  GLN  10          1HE2      GLN  10   8.483  -2.192  -8.376
   76   2HE2  GLN  10          2HE2      GLN  10   9.659  -2.098  -9.595
   77    H    LEU  11           H        LEU  11   4.125   0.498  -8.340
   78    HA   LEU  11           HA       LEU  11   5.423  -0.325  -5.893
   79   1HB   LEU  11          2HB       LEU  11   5.663   1.951  -6.586
   80   2HB   LEU  11          1HB       LEU  11   3.929   2.141  -6.813
   81    HG   LEU  11           HG       LEU  11   3.961   1.498  -4.193
   82   1HD1  LEU  11          1HD1      LEU  11   6.694   2.136  -4.911
   83   2HD1  LEU  11          2HD1      LEU  11   6.055   1.609  -3.354
   84   3HD1  LEU  11          3HD1      LEU  11   6.065   3.324  -3.770
   85   1HD2  LEU  11          1HD2      LEU  11   4.616   4.293  -5.111
   86   2HD2  LEU  11          2HD2      LEU  11   3.502   3.789  -3.838
   87   3HD2  LEU  11          3HD2      LEU  11   3.083   3.532  -5.532
   88    H    ILE  12           H        ILE  12   2.150   0.013  -7.053
   89    HA   ILE  12           HA       ILE  12   0.816  -0.317  -4.489
   90    HB   ILE  12           HB       ILE  12  -0.352  -1.205  -7.094
   91   1HG1  ILE  12          2HG1      ILE  12   0.564   0.856  -7.804
   92   2HG1  ILE  12          1HG1      ILE  12  -1.103   1.231  -7.358
   93   1HG2  ILE  12          1HG2      ILE  12  -2.381  -0.731  -6.107
   94   2HG2  ILE  12          2HG2      ILE  12  -1.683   0.470  -5.018
   95   3HG2  ILE  12          3HG2      ILE  12  -1.426  -1.249  -4.718
   96   1HD1  ILE  12          1HD1      ILE  12  -0.459   2.226  -5.330
   97   2HD1  ILE  12          2HD1      ILE  12   0.728   2.817  -6.487
   98   3HD1  ILE  12          3HD1      ILE  12   1.152   1.517  -5.376
   99    H    VAL  13           H        VAL  13   1.651  -2.477  -7.177
  100    HA   VAL  13           HA       VAL  13   0.494  -4.855  -6.270
  101    HB   VAL  13           HB       VAL  13   3.116  -4.428  -7.724
  102   1HG1  VAL  13          1HG1      VAL  13   3.183  -6.661  -6.877
  103   2HG1  VAL  13          2HG1      VAL  13   2.619  -6.800  -8.542
  104   3HG1  VAL  13          3HG1      VAL  13   1.470  -6.914  -7.209
  105   1HG2  VAL  13          1HG2      VAL  13   1.673  -4.962  -9.699
  106   2HG2  VAL  13          2HG2      VAL  13   1.185  -3.489  -8.867
  107   3HG2  VAL  13          3HG2      VAL  13   0.274  -4.977  -8.626
  108    H    GLN  14           H        GLN  14   3.497  -3.313  -5.191
  109    HA   GLN  14           HA       GLN  14   4.332  -5.591  -3.586
  110   1HB   GLN  14          2HB       GLN  14   5.922  -3.815  -4.330
  111   2HB   GLN  14          1HB       GLN  14   5.078  -2.660  -3.299
  112   1HG   GLN  14          2HG       GLN  14   5.841  -3.641  -1.335
  113   2HG   GLN  14          1HG       GLN  14   6.060  -5.222  -2.090
  114   1HE2  GLN  14          1HE2      GLN  14   7.257  -2.367  -3.751
  115   2HE2  GLN  14          2HE2      GLN  14   8.903  -2.656  -3.464
  116    H    ALA  15           H        ALA  15   2.295  -2.798  -3.171
  117    HA   ALA  15           HA       ALA  15   2.055  -2.876  -0.317
  118   1HB   ALA  15          1HB       ALA  15  -0.302  -1.918  -1.794
  119   2HB   ALA  15          2HB       ALA  15   1.214  -1.175  -2.304
  120   3HB   ALA  15          3HB       ALA  15   0.708  -1.077  -0.617
  121    H    ILE  16           H        ILE  16  -0.316  -3.993  -2.811
  122    HA   ILE  16           HA       ILE  16  -1.803  -5.405  -0.715
  123    HB   ILE  16           HB       ILE  16  -3.009  -6.384  -2.831
  124   1HG1  ILE  16          2HG1      ILE  16  -2.911  -4.874  -4.718
  125   2HG1  ILE  16          1HG1      ILE  16  -1.654  -3.922  -3.971
  126   1HG2  ILE  16          1HG2      ILE  16  -4.215  -4.938  -1.441
  127   2HG2  ILE  16          2HG2      ILE  16  -4.224  -4.095  -2.990
  128   3HG2  ILE  16          3HG2      ILE  16  -3.108  -3.593  -1.719
  129   1HD1  ILE  16          1HD1      ILE  16  -1.198  -5.943  -5.727
  130   2HD1  ILE  16          2HD1      ILE  16  -1.130  -6.831  -4.209
  131   3HD1  ILE  16          3HD1      ILE  16  -0.045  -5.466  -4.486
  132    H    SER  17           H        SER  17   0.614  -6.306  -3.073
  133    HA   SER  17           HA       SER  17   0.103  -9.142  -2.970
  134   1HB   SER  17          2HB       SER  17   2.678  -7.646  -3.566
  135   2HB   SER  17          1HB       SER  17   2.405  -9.359  -3.869
  136    HG   SER  17           HG       SER  17   0.942  -8.860  -5.413
  137    H    SER  18           H        SER  18   1.404  -6.846  -0.829
  138    HA   SER  18           HA       SER  18   2.634  -8.998   0.831
  139   1HB   SER  18          2HB       SER  18   4.324  -7.426   0.683
  140   2HB   SER  18          1HB       SER  18   3.200  -6.088   0.470
  141    HG   SER  18           HG       SER  18   2.941  -5.949   2.592
  142    H    ALA  19           H        ALA  19  -0.229  -7.273   0.477
  143    HA   ALA  19           HA       ALA  19  -0.628  -6.912   3.394
  144   1HB   ALA  19          1HB       ALA  19  -3.005  -6.647   1.716
  145   2HB   ALA  19          2HB       ALA  19  -1.670  -5.653   1.133
  146   3HB   ALA  19          3HB       ALA  19  -2.256  -5.461   2.785
  147    H    GLN  20           H        GLN  20  -1.947  -8.284   4.639
  148    HA   GLN  20           HA       GLN  20  -2.161 -10.994   4.153
  149   1HB   GLN  20          2HB       GLN  20  -4.597  -9.682   5.321
  150   2HB   GLN  20          1HB       GLN  20  -3.741 -11.124   5.866
  151   1HG   GLN  20          2HG       GLN  20  -1.786  -9.373   6.292
  152   2HG   GLN  20          1HG       GLN  20  -3.136  -8.245   6.397
  153   1HE2  GLN  20          1HE2      GLN  20  -5.084  -9.354   7.787
  154   2HE2  GLN  20          2HE2      GLN  20  -4.575 -10.019   9.263
  155    H    ASP  21           H        ASP  21  -4.826  -8.724   3.536
  156    HA   ASP  21           HA       ASP  21  -5.913 -10.577   1.504
  157   1HB   ASP  21          2HB       ASP  21  -7.204  -9.105   3.349
  158   2HB   ASP  21          1HB       ASP  21  -7.159  -7.921   2.042
  159    H    ARG  22           H        ARG  22  -5.578 -10.166  -0.682
  160    HA   ARG  22           HA       ARG  22  -3.699  -8.249  -1.584
  161   1HB   ARG  22          2HB       ARG  22  -5.842  -9.841  -2.996
  162   2HB   ARG  22          1HB       ARG  22  -4.781  -8.736  -3.871
  163   1HG   ARG  22          2HG       ARG  22  -3.762 -10.915  -3.965
  164   2HG   ARG  22          1HG       ARG  22  -2.818  -9.947  -2.830
  165   1HD   ARG  22          2HD       ARG  22  -3.720 -11.045  -0.953
  166   2HD   ARG  22          1HD       ARG  22  -5.097 -11.663  -1.862
  167    HE   ARG  22           HE       ARG  22  -2.805 -12.788  -3.046
  168   1HH1  ARG  22          1HH1      ARG  22  -4.098 -12.585   0.137
  169   2HH1  ARG  22          2HH1      ARG  22  -3.705 -14.222   0.546
  170   1HH2  ARG  22          1HH2      ARG  22  -2.423 -14.980  -2.582
  171   2HH2  ARG  22          2HH2      ARG  22  -2.758 -15.575  -0.990
  172    H    GLN  23           H        GLN  23  -6.808  -7.639  -0.460
  173    HA   GLN  23           HA       GLN  23  -7.258  -5.339  -2.269
  174   1HB   GLN  23          2HB       GLN  23  -9.471  -5.266  -1.384
  175   2HB   GLN  23          1HB       GLN  23  -9.113  -6.987  -1.521
  176   1HG   GLN  23          2HG       GLN  23  -8.339  -6.915   0.891
  177   2HG   GLN  23          1HG       GLN  23  -9.010  -5.288   0.977
  178   1HE2  GLN  23          1HE2      GLN  23 -10.035  -7.511   2.540
  179   2HE2  GLN  23          2HE2      GLN  23 -11.622  -7.811   2.021
  180    H    LEU  24           H        LEU  24  -6.497  -3.370  -1.659
  181    HA   LEU  24           HA       LEU  24  -6.047  -2.912   1.261
  182   1HB   LEU  24          2HB       LEU  24  -4.479  -2.074  -1.173
  183   2HB   LEU  24          1HB       LEU  24  -4.425  -1.095   0.290
  184    HG   LEU  24           HG       LEU  24  -3.770  -4.049   0.136
  185   1HD1  LEU  24          1HD1      LEU  24  -2.164  -2.151  -0.781
  186   2HD1  LEU  24          2HD1      LEU  24  -1.520  -3.465   0.203
  187   3HD1  LEU  24          3HD1      LEU  24  -1.844  -1.893   0.933
  188   1HD2  LEU  24          1HD2      LEU  24  -4.593  -2.391   2.314
  189   2HD2  LEU  24          2HD2      LEU  24  -2.880  -2.752   2.528
  190   3HD2  LEU  24          3HD2      LEU  24  -4.044  -4.067   2.372
  191    H    THR  25           H        THR  25  -6.585  -0.787   2.048
  192    HA   THR  25           HA       THR  25  -8.819   0.440   0.604
  193    HB   THR  25           HB       THR  25  -9.029   1.886   2.534
  194    HG1  THR  25           HG1      THR  25  -7.158   2.539   3.231
  195   1HG2  THR  25          1HG2      THR  25  -8.329  -0.211   4.287
  196   2HG2  THR  25          2HG2      THR  25  -8.800  -0.979   2.770
  197   3HG2  THR  25          3HG2      THR  25  -9.916   0.113   3.589
  198    H    LEU  26           H        LEU  26  -8.677   2.950   0.339
  199    HA   LEU  26           HA       LEU  26  -6.497   3.503  -1.425
  200   1HB   LEU  26          2HB       LEU  26  -8.880   4.813  -0.763
  201   2HB   LEU  26          1HB       LEU  26  -7.612   5.926  -0.250
  202    HG   LEU  26           HG       LEU  26  -7.650   4.584  -2.964
  203   1HD1  LEU  26          1HD1      LEU  26  -8.140   7.318  -3.280
  204   2HD1  LEU  26          2HD1      LEU  26  -9.174   6.853  -1.928
  205   3HD1  LEU  26          3HD1      LEU  26  -9.320   6.022  -3.477
  206   1HD2  LEU  26          1HD2      LEU  26  -6.263   7.155  -2.446
  207   2HD2  LEU  26          2HD2      LEU  26  -5.732   5.757  -3.382
  208   3HD2  LEU  26          3HD2      LEU  26  -5.583   5.751  -1.626
  209    H    SER  27           H        SER  27  -6.948   4.048   2.024
  210    HA   SER  27           HA       SER  27  -4.303   5.398   2.166
  211   1HB   SER  27          2HB       SER  27  -6.673   5.199   3.975
  212   2HB   SER  27          1HB       SER  27  -5.090   5.485   4.691
  213    HG   SER  27           HG       SER  27  -6.429   7.016   2.713
  214    H    GLY  28           H        GLY  28  -4.617   2.458   1.636
  215   1HA   GLY  28          2HA       GLY  28  -3.491   1.343   4.172
  216   2HA   GLY  28          1HA       GLY  28  -4.120   0.378   2.833
  217    H    ILE  29           H        ILE  29  -2.923   1.488   0.711
  218    HA   ILE  29           HA       ILE  29  -0.400   0.305   0.520
  219    HB   ILE  29           HB       ILE  29  -1.838   1.029  -1.343
  220   1HG1  ILE  29          2HG1      ILE  29   1.006   2.013  -1.216
  221   2HG1  ILE  29          1HG1      ILE  29   0.394   0.545  -1.983
  222   1HG2  ILE  29          1HG2      ILE  29  -2.359   3.200  -1.768
  223   2HG2  ILE  29          2HG2      ILE  29  -0.806   3.790  -1.189
  224   3HG2  ILE  29          3HG2      ILE  29  -2.072   3.366  -0.041
  225   1HD1  ILE  29          1HD1      ILE  29  -0.186   3.382  -2.845
  226   2HD1  ILE  29          2HD1      ILE  29  -0.891   1.937  -3.571
  227   3HD1  ILE  29          3HD1      ILE  29   0.845   2.227  -3.689
  228    H    TYR  30           H        TYR  30  -1.329   3.476   1.570
  229    HA   TYR  30           HA       TYR  30   1.282   4.660   1.483
  230   1HB   TYR  30          2HB       TYR  30  -1.023   5.380   3.307
  231   2HB   TYR  30          1HB       TYR  30   0.292   6.435   2.785
  232    HD1  TYR  30           HD1      TYR  30   0.486   5.384  -0.072
  233    HD2  TYR  30           HD2      TYR  30  -2.872   6.597   2.307
  234    HE1  TYR  30           HE1      TYR  30  -0.773   5.908  -2.135
  235    HE2  TYR  30           HE2      TYR  30  -4.136   7.122   0.244
  236    HH   TYR  30           HH       TYR  30  -3.743   7.662  -2.065
  237    H    ALA  31           H        ALA  31  -0.554   3.080   4.085
  238    HA   ALA  31           HA       ALA  31   1.566   3.320   6.028
  239   1HB   ALA  31          1HB       ALA  31   0.229   2.012   7.413
  240   2HB   ALA  31          2HB       ALA  31  -0.341   1.005   6.083
  241   3HB   ALA  31          3HB       ALA  31  -0.990   2.631   6.299
  242    H    HIS  32           H        HIS  32   1.110   1.390   3.227
  243    HA   HIS  32           HA       HIS  32   2.735  -0.874   4.068
  244   1HB   HIS  32          2HB       HIS  32   1.088  -1.181   2.300
  245   2HB   HIS  32          1HB       HIS  32   1.852   0.078   1.328
  246    HD1  HIS  32           HD1      HIS  32   2.348  -3.457   2.505
  247    HD2  HIS  32           HD2      HIS  32   4.274  -0.693   0.049
  248    HE1  HIS  32           HE1      HIS  32   4.166  -4.728   1.284
  249    H    ILE  33           H        ILE  33   3.347   1.472   1.435
  250    HA   ILE  33           HA       ILE  33   6.155   0.980   1.315
  251    HB   ILE  33           HB       ILE  33   6.240   3.160   0.097
  252   1HG1  ILE  33          2HG1      ILE  33   3.644   3.896  -0.275
  253   2HG1  ILE  33          1HG1      ILE  33   3.609   3.398   1.418
  254   1HG2  ILE  33          1HG2      ILE  33   3.848   1.495  -0.727
  255   2HG2  ILE  33          2HG2      ILE  33   5.514   0.964  -0.957
  256   3HG2  ILE  33          3HG2      ILE  33   4.929   2.412  -1.777
  257   1HD1  ILE  33          1HD1      ILE  33   5.794   4.822   1.620
  258   2HD1  ILE  33          2HD1      ILE  33   4.239   5.652   1.574
  259   3HD1  ILE  33          3HD1      ILE  33   5.236   5.572   0.124
  260    H    THR  34           H        THR  34   4.259   3.263   3.224
  261    HA   THR  34           HA       THR  34   6.390   4.889   4.157
  262    HB   THR  34           HB       THR  34   4.914   5.268   6.169
  263    HG1  THR  34           HG1      THR  34   3.456   3.839   6.564
  264   1HG2  THR  34          1HG2      THR  34   3.833   5.443   3.365
  265   2HG2  THR  34          2HG2      THR  34   4.534   6.726   4.351
  266   3HG2  THR  34          3HG2      THR  34   2.935   6.088   4.737
  267    H    LYS  35           H        LYS  35   5.451   1.631   4.945
  268    HA   LYS  35           HA       LYS  35   7.171   1.518   7.333
  269   1HB   LYS  35          2HB       LYS  35   5.212  -0.275   6.008
  270   2HB   LYS  35          1HB       LYS  35   6.556  -1.078   6.820
  271   1HG   LYS  35          2HG       LYS  35   6.045   0.015   8.908
  272   2HG   LYS  35          1HG       LYS  35   4.853   1.057   8.130
  273   1HD   LYS  35          2HD       LYS  35   3.624  -0.695   9.221
  274   2HD   LYS  35          1HD       LYS  35   3.586  -1.049   7.494
  275   1HE   LYS  35          2HE       LYS  35   5.094  -2.818   7.685
  276   2HE   LYS  35          1HE       LYS  35   5.790  -2.194   9.181
  277   1HZ   LYS  35          1HZ       LYS  35   3.064  -2.672   9.601
  278   2HZ   LYS  35          2HZ       LYS  35   4.393  -3.449  10.320
  279   3HZ   LYS  35          3HZ       LYS  35   3.729  -4.057   8.880
  280    H    HIS  36           H        HIS  36   7.085  -0.216   4.181
  281    HA   HIS  36           HA       HIS  36   9.772  -1.241   4.478
  282   1HB   HIS  36          2HB       HIS  36   7.794  -1.041   2.229
  283   2HB   HIS  36          1HB       HIS  36   9.471  -1.442   1.857
  284    HD1  HIS  36           HD1      HIS  36  10.461  -3.582   3.158
  285    HD2  HIS  36           HD2      HIS  36   6.315  -3.161   3.271
  286    HE1  HIS  36           HE1      HIS  36   9.534  -5.818   3.901
  287    H    TYR  37           H        TYR  37   8.477   1.266   2.279
  288    HA   TYR  37           HA       TYR  37  11.150   2.317   1.769
  289   1HB   TYR  37          2HB       TYR  37   8.396   2.910   0.840
  290   2HB   TYR  37          1HB       TYR  37   9.459   4.311   0.945
  291    HD1  TYR  37           HD1      TYR  37  12.094   2.956   0.338
  292    HD2  TYR  37           HD2      TYR  37   8.221   2.606  -1.484
  293    HE1  TYR  37           HE1      TYR  37  13.156   2.277  -1.794
  294    HE2  TYR  37           HE2      TYR  37   9.282   1.934  -3.617
  295    HH   TYR  37           HH       TYR  37  12.539   2.349  -4.259
  296    HA   PRO  38           HA       PRO  38  10.890   4.628   5.606
  297   1HB   PRO  38          2HB       PRO  38  13.513   5.461   5.551
  298   2HB   PRO  38          1HB       PRO  38  12.996   3.863   6.118
  299   1HG   PRO  38          2HG       PRO  38  14.320   4.607   3.550
  300   2HG   PRO  38          1HG       PRO  38  14.371   3.074   4.436
  301   1HD   PRO  38          2HD       PRO  38  12.804   3.596   2.147
  302   2HD   PRO  38          1HD       PRO  38  12.596   2.225   3.256
  303    H    TYR  39           H        TYR  39  12.336   5.927   2.612
  304    HA   TYR  39           HA       TYR  39  12.302   8.669   3.393
  305   1HB   TYR  39          2HB       TYR  39  13.531   7.911   1.419
  306   2HB   TYR  39          1HB       TYR  39  12.016   7.464   0.637
  307    HD1  TYR  39           HD1      TYR  39  14.372  10.095   1.193
  308    HD2  TYR  39           HD2      TYR  39  10.228   9.326   0.362
  309    HE1  TYR  39           HE1      TYR  39  14.100  12.425   0.389
  310    HE2  TYR  39           HE2      TYR  39   9.956  11.655  -0.443
  311    HH   TYR  39           HH       TYR  39  12.168  13.527  -1.433
  312    H    TYR  40           H        TYR  40   9.921   6.901   1.386
  313    HA   TYR  40           HA       TYR  40   8.049   9.009   1.195
  314   1HB   TYR  40          2HB       TYR  40   8.005   6.081   0.862
  315   2HB   TYR  40          1HB       TYR  40   6.446   6.791   1.284
  316    HD1  TYR  40           HD1      TYR  40   5.787   8.962  -0.032
  317    HD2  TYR  40           HD2      TYR  40   8.700   6.104  -1.374
  318    HE1  TYR  40           HE1      TYR  40   5.508   9.771  -2.366
  319    HE2  TYR  40           HE2      TYR  40   8.416   6.918  -3.708
  320    HH   TYR  40           HH       TYR  40   6.109   9.536  -4.469
  321    H    ARG  41           H        ARG  41   7.618  10.122   3.122
  322    HA   ARG  41           HA       ARG  41   5.909   8.709   5.049
  323   1HB   ARG  41          2HB       ARG  41   8.139   8.233   5.947
  324   2HB   ARG  41          1HB       ARG  41   8.542   9.949   5.903
  325   1HG   ARG  41          2HG       ARG  41   7.054  10.475   7.640
  326   2HG   ARG  41          1HG       ARG  41   6.114   9.000   7.405
  327   1HD   ARG  41          2HD       ARG  41   8.845   9.289   8.661
  328   2HD   ARG  41          1HD       ARG  41   7.385   8.601   9.372
  329    HE   ARG  41           HE       ARG  41   7.667   6.763   7.580
  330   1HH1  ARG  41          1HH2      ARG  41  10.279   8.505   6.933
  331   2HH1  ARG  41          2HH2      ARG  41  11.477   7.381   7.484
  332   1HH2  ARG  41          1HH1      ARG  41   9.195   5.354   9.129
  333   2HH2  ARG  41          2HH1      ARG  41  10.862   5.596   8.727
  334    H    THR  42           H        THR  42   7.802  11.637   5.672
  335    HA   THR  42           HA       THR  42   5.438  13.157   6.294
  336    HB   THR  42           HB       THR  42   7.784  13.583   7.177
  337    HG1  THR  42           HG1      THR  42   6.510  15.784   5.922
  338   1HG2  THR  42          1HG2      THR  42   8.513  13.584   4.565
  339   2HG2  THR  42          2HG2      THR  42   9.443  14.385   5.832
  340   3HG2  THR  42          3HG2      THR  42   8.325  15.317   4.837
  341    H    ALA  43           H        ALA  43   7.320  12.703   3.364
  342    HA   ALA  43           HA       ALA  43   5.860  14.883   1.998
  343   1HB   ALA  43          1HB       ALA  43   7.385  14.593   0.208
  344   2HB   ALA  43          2HB       ALA  43   7.784  12.949   0.704
  345   3HB   ALA  43          3HB       ALA  43   8.359  14.321   1.653
  346    H    ASP  44           H        ASP  44   4.060  14.487   0.732
  347    HA   ASP  44           HA       ASP  44   3.655  12.051  -0.728
  348   1HB   ASP  44          2HB       ASP  44   1.676  11.227   0.586
  349   2HB   ASP  44          1HB       ASP  44   3.212  11.046   1.434
  350    H    LYS  45           H        LYS  45   3.402  15.026  -0.922
  351    HA   LYS  45           HA       LYS  45   0.502  15.397  -1.339
  352   1HB   LYS  45          2HB       LYS  45   2.504  17.119  -0.565
  353   2HB   LYS  45          1HB       LYS  45   2.321  17.516  -2.274
  354   1HG   LYS  45          2HG       LYS  45   0.745  18.912  -1.196
  355   2HG   LYS  45          1HG       LYS  45  -0.220  17.559  -1.791
  356   1HD   LYS  45          2HD       LYS  45  -0.153  16.496   0.405
  357   2HD   LYS  45          1HD       LYS  45   0.910  17.764   1.016
  358   1HE   LYS  45          2HE       LYS  45  -0.797  19.247   1.270
  359   2HE   LYS  45          1HE       LYS  45  -1.579  18.748  -0.230
  360   1HZ   LYS  45          1HZ       LYS  45  -3.029  17.667   1.029
  361   2HZ   LYS  45          2HZ       LYS  45  -2.118  17.930   2.440
  362   3HZ   LYS  45          3HZ       LYS  45  -1.789  16.588   1.450
  363    H    GLY  46           H        GLY  46   1.638  13.410  -3.005
  364   1HA   GLY  46          2HA       GLY  46   0.963  14.540  -5.623
  365   2HA   GLY  46          1HA       GLY  46   2.644  14.021  -5.481
  366    H    TRP  47           H        TRP  47   2.813  11.693  -4.456
  367    HA   TRP  47           HA       TRP  47   1.440   9.905  -6.237
  368   1HB   TRP  47          2HB       TRP  47   2.637   8.142  -5.173
  369   2HB   TRP  47          1HB       TRP  47   3.720   9.531  -5.210
  370    HD1  TRP  47           HD1      TRP  47   3.397  11.141  -2.827
  371    HE1  TRP  47           HE1      TRP  47   3.492  10.251  -0.416
  372    HE3  TRP  47           HE3      TRP  47   2.296   6.206  -3.647
  373    HZ2  TRP  47           HZ2      TRP  47   3.159   7.798   0.986
  374    HZ3  TRP  47           HZ3      TRP  47   2.206   4.623  -1.742
  375    HH2  TRP  47           HH2      TRP  47   2.635   5.416   0.569
  376    H    GLN  48           H        GLN  48   0.230  11.426  -3.533
  377    HA   GLN  48           HA       GLN  48  -1.189   9.267  -2.263
  378   1HB   GLN  48          2HB       GLN  48  -0.842  11.888  -1.660
  379   2HB   GLN  48          1HB       GLN  48  -2.477  11.940  -2.321
  380   1HG   GLN  48          2HG       GLN  48  -2.669  11.522   0.046
  381   2HG   GLN  48          1HG       GLN  48  -3.063  10.022  -0.792
  382   1HE2  GLN  48          1HE2      GLN  48   0.258  10.420  -1.142
  383   2HE2  GLN  48          2HE2      GLN  48   0.770   9.513   0.196
  384    H    ASN  49           H        ASN  49  -2.492  11.820  -4.426
  385    HA   ASN  49           HA       ASN  49  -4.878  10.275  -5.010
  386   1HB   ASN  49          2HB       ASN  49  -4.257  12.906  -5.246
  387   2HB   ASN  49          1HB       ASN  49  -4.021  12.386  -6.915
  388   1HD2  ASN  49          1HD2      ASN  49  -6.261  14.038  -5.642
  389   2HD2  ASN  49          2HD2      ASN  49  -7.686  13.233  -6.089
  390    H    SER  50           H        SER  50  -1.670  10.435  -6.303
  391    HA   SER  50           HA       SER  50  -2.205   9.439  -8.937
  392   1HB   SER  50          2HB       SER  50   0.293   8.741  -7.410
  393   2HB   SER  50          1HB       SER  50   0.112   9.121  -9.120
  394    HG   SER  50           HG       SER  50   1.022  10.832  -7.810
  395    H    ILE  51           H        ILE  51  -1.509   7.824  -5.844
  396    HA   ILE  51           HA       ILE  51  -1.434   5.156  -6.848
  397    HB   ILE  51           HB       ILE  51  -1.773   6.463  -4.195
  398   1HG1  ILE  51          2HG1      ILE  51   0.131   5.241  -3.650
  399   2HG1  ILE  51          1HG1      ILE  51  -0.287   3.917  -4.725
  400   1HG2  ILE  51          1HG2      ILE  51  -3.679   4.795  -4.286
  401   2HG2  ILE  51          2HG2      ILE  51  -2.485   4.478  -3.034
  402   3HG2  ILE  51          3HG2      ILE  51  -2.473   3.529  -4.518
  403   1HD1  ILE  51          1HD1      ILE  51   0.299   6.582  -5.940
  404   2HD1  ILE  51          2HD1      ILE  51   0.572   4.967  -6.595
  405   3HD1  ILE  51          3HD1      ILE  51   1.650   5.609  -5.356
  406    H    ARG  52           H        ARG  52  -4.155   6.914  -5.315
  407    HA   ARG  52           HA       ARG  52  -6.161   4.999  -5.619
  408   1HB   ARG  52          2HB       ARG  52  -6.630   7.085  -4.486
  409   2HB   ARG  52          1HB       ARG  52  -6.313   8.009  -5.950
  410   1HG   ARG  52          2HG       ARG  52  -8.263   6.111  -6.674
  411   2HG   ARG  52          1HG       ARG  52  -8.769   6.734  -5.105
  412   1HD   ARG  52          2HD       ARG  52  -7.817   8.689  -7.158
  413   2HD   ARG  52          1HD       ARG  52  -9.432   8.001  -7.342
  414    HE   ARG  52           HE       ARG  52  -8.992   8.961  -4.645
  415   1HH1  ARG  52          1HH1      ARG  52  -9.868   9.773  -7.883
  416   2HH1  ARG  52          2HH1      ARG  52 -10.647  11.255  -7.439
  417   1HH2  ARG  52          1HH2      ARG  52  -9.939  10.928  -4.062
  418   2HH2  ARG  52          2HH2      ARG  52 -10.688  11.908  -5.279
  419    H    HIS  53           H        HIS  53  -5.694   7.682  -7.916
  420    HA   HIS  53           HA       HIS  53  -7.300   6.607  -9.980
  421   1HB   HIS  53          2HB       HIS  53  -5.816   8.910  -9.569
  422   2HB   HIS  53          1HB       HIS  53  -5.002   8.147 -10.936
  423    HD1  HIS  53           HD1      HIS  53  -8.626   8.802  -9.899
  424    HD2  HIS  53           HD2      HIS  53  -6.228   8.816 -13.308
  425    HE1  HIS  53           HE1      HIS  53 -10.111   9.536 -11.815
  426    H    ASN  54           H        ASN  54  -4.028   5.838  -9.061
  427    HA   ASN  54           HA       ASN  54  -3.243   4.667 -11.584
  428   1HB   ASN  54          2HB       ASN  54  -2.139   4.806  -8.838
  429   2HB   ASN  54          1HB       ASN  54  -1.633   3.410  -9.800
  430   1HD2  ASN  54          1HD2      ASN  54  -0.470   6.344  -9.041
  431   2HD2  ASN  54          2HD2      ASN  54   0.232   6.809 -10.515
  432    H    LEU  55           H        LEU  55  -3.602   2.893  -8.510
  433    HA   LEU  55           HA       LEU  55  -4.038   0.394  -9.771
  434   1HB   LEU  55          2HB       LEU  55  -5.124  -0.218  -7.502
  435   2HB   LEU  55          1HB       LEU  55  -3.428   0.256  -7.511
  436    HG   LEU  55           HG       LEU  55  -4.784   2.672  -7.251
  437   1HD1  LEU  55          1HD1      LEU  55  -6.301   0.438  -6.019
  438   2HD1  LEU  55          2HD1      LEU  55  -6.880   1.978  -6.652
  439   3HD1  LEU  55          3HD1      LEU  55  -6.110   1.909  -5.067
  440   1HD2  LEU  55          1HD2      LEU  55  -3.975   2.477  -4.854
  441   2HD2  LEU  55          2HD2      LEU  55  -2.746   2.159  -6.078
  442   3HD2  LEU  55          3HD2      LEU  55  -3.511   0.817  -5.227
  443    H    SER  56           H        SER  56  -6.157   3.036  -9.729
  444    HA   SER  56           HA       SER  56  -8.610   1.417  -9.684
  445   1HB   SER  56          2HB       SER  56  -8.001   4.341 -10.132
  446   2HB   SER  56          1HB       SER  56  -9.600   3.686 -10.473
  447    HG   SER  56           HG       SER  56  -9.723   3.007  -8.329
  448    H    LEU  57           H        LEU  57  -6.906   3.458 -12.064
  449    HA   LEU  57           HA       LEU  57  -8.353   2.119 -14.264
  450   1HB   LEU  57          2HB       LEU  57  -7.237   3.788 -15.676
  451   2HB   LEU  57          1HB       LEU  57  -8.019   4.578 -14.311
  452    HG   LEU  57           HG       LEU  57  -5.566   4.049 -13.254
  453   1HD1  LEU  57          1HD1      LEU  57  -5.327   4.124 -16.219
  454   2HD1  LEU  57          2HD1      LEU  57  -4.309   3.314 -15.030
  455   3HD1  LEU  57          3HD1      LEU  57  -4.134   5.047 -15.305
  456   1HD2  LEU  57          1HD2      LEU  57  -6.111   6.495 -14.953
  457   2HD2  LEU  57          2HD2      LEU  57  -5.158   6.398 -13.472
  458   3HD2  LEU  57          3HD2      LEU  57  -6.912   6.221 -13.407
  459    H    ASN  58           H        ASN  58  -5.963   1.107 -12.426
  460    HA   ASN  58           HA       ASN  58  -3.776   0.617 -14.225
  461   1HB   ASN  58          2HB       ASN  58  -4.511  -0.227 -11.515
  462   2HB   ASN  58          1HB       ASN  58  -3.703  -1.499 -12.428
  463   1HD2  ASN  58          1HD2      ASN  58  -3.138   1.977 -12.956
  464   2HD2  ASN  58          2HD2      ASN  58  -1.528   1.967 -12.421
  465    H    ARG  59           H        ARG  59  -3.140  -1.797 -14.703
  466    HA   ARG  59           HA       ARG  59  -5.370  -2.897 -16.290
  467   1HB   ARG  59          2HB       ARG  59  -3.681  -4.232 -17.402
  468   2HB   ARG  59          1HB       ARG  59  -3.083  -2.578 -17.272
  469   1HG   ARG  59          2HG       ARG  59  -2.283  -3.820 -14.889
  470   2HG   ARG  59          1HG       ARG  59  -1.976  -5.016 -16.150
  471   1HD   ARG  59          2HD       ARG  59  -1.159  -2.156 -16.584
  472   2HD   ARG  59          1HD       ARG  59  -0.142  -3.218 -15.610
  473    HE   ARG  59           HE       ARG  59   0.195  -4.618 -17.582
  474   1HH1  ARG  59          1HH2      ARG  59   0.387  -1.524 -18.300
  475   2HH1  ARG  59          2HH2      ARG  59  -0.271  -1.584 -19.901
  476   1HH2  ARG  59          1HH1      ARG  59  -1.527  -4.797 -19.552
  477   2HH2  ARG  59          2HH1      ARG  59  -1.355  -3.436 -20.610
  478    H    TYR  60           H        TYR  60  -3.460  -3.759 -13.442
  479    HA   TYR  60           HA       TYR  60  -4.950  -6.348 -13.368
  480   1HB   TYR  60          2HB       TYR  60  -3.159  -6.692 -11.391
  481   2HB   TYR  60          1HB       TYR  60  -2.829  -7.119 -13.065
  482    HD1  TYR  60           HD1      TYR  60  -0.660  -6.613 -13.609
  483    HD2  TYR  60           HD2      TYR  60  -2.865  -3.828 -11.194
  484    HE1  TYR  60           HE1      TYR  60   1.262  -5.065 -13.661
  485    HE2  TYR  60           HE2      TYR  60  -0.936  -2.274 -11.260
  486    HH   TYR  60           HH       TYR  60   1.691  -2.606 -11.592
  487    H    PHE  61           H        PHE  61  -4.596  -3.306 -11.732
  488    HA   PHE  61           HA       PHE  61  -5.680  -4.324  -9.223
  489   1HB   PHE  61          2HB       PHE  61  -5.253  -1.514 -10.268
  490   2HB   PHE  61          1HB       PHE  61  -5.871  -1.875  -8.650
  491    HD1  PHE  61           HD1      PHE  61  -2.961  -1.013 -10.251
  492    HD2  PHE  61           HD2      PHE  61  -4.452  -4.035  -7.600
  493    HE1  PHE  61           HE1      PHE  61  -0.662  -1.457  -9.471
  494    HE2  PHE  61           HE2      PHE  61  -2.155  -4.478  -6.819
  495    HZ   PHE  61           HZ       PHE  61  -0.263  -3.187  -7.740
  496    H    ILE  62           H        ILE  62  -7.780  -4.150  -8.491
  497    HA   ILE  62           HA       ILE  62  -9.839  -3.165 -10.399
  498    HB   ILE  62           HB       ILE  62 -11.043  -5.190 -10.392
  499   1HG1  ILE  62          2HG1      ILE  62  -9.460  -6.748  -8.471
  500   2HG1  ILE  62          1HG1      ILE  62 -10.299  -5.400  -7.714
  501   1HG2  ILE  62          1HG2      ILE  62  -8.182  -6.158 -10.153
  502   2HG2  ILE  62          2HG2      ILE  62  -8.816  -5.345 -11.583
  503   3HG2  ILE  62          3HG2      ILE  62  -9.486  -6.898 -11.081
  504   1HD1  ILE  62          1HD1      ILE  62 -12.066  -6.656  -9.600
  505   2HD1  ILE  62          2HD1      ILE  62 -12.255  -6.497  -7.855
  506   3HD1  ILE  62          3HD1      ILE  62 -11.399  -7.884  -8.525
  507    H    LYS  63           H        LYS  63 -12.013  -2.943  -9.283
  508    HA   LYS  63           HA       LYS  63 -11.605  -2.309  -6.385
  509   1HB   LYS  63          2HB       LYS  63 -12.473  -0.630  -8.473
  510   2HB   LYS  63          1HB       LYS  63 -13.927  -1.021  -7.553
  511   1HG   LYS  63          2HG       LYS  63 -12.235  -0.557  -5.506
  512   2HG   LYS  63          1HG       LYS  63 -11.508   0.497  -6.718
  513   1HD   LYS  63          2HD       LYS  63 -13.308   1.913  -6.765
  514   2HD   LYS  63          1HD       LYS  63 -14.468   0.616  -6.477
  515   1HE   LYS  63          2HE       LYS  63 -14.577   1.314  -4.337
  516   2HE   LYS  63          1HE       LYS  63 -12.930   0.717  -4.139
  517   1HZ   LYS  63          1HZ       LYS  63 -12.072   2.845  -4.765
  518   2HZ   LYS  63          2HZ       LYS  63 -13.201   3.071  -3.517
  519   3HZ   LYS  63          3HZ       LYS  63 -13.622   3.430  -5.123
  520    H    VAL  64           H        VAL  64 -13.112  -3.153  -4.925
  521    HA   VAL  64           HA       VAL  64 -15.250  -4.869  -6.130
  522    HB   VAL  64           HB       VAL  64 -14.990  -6.235  -3.988
  523   1HG1  VAL  64          1HG1      VAL  64 -13.122  -6.049  -6.284
  524   2HG1  VAL  64          2HG1      VAL  64 -14.078  -7.419  -5.720
  525   3HG1  VAL  64          3HG1      VAL  64 -12.561  -7.011  -4.917
  526   1HG2  VAL  64          1HG2      VAL  64 -13.743  -4.456  -2.760
  527   2HG2  VAL  64          2HG2      VAL  64 -12.389  -4.679  -3.868
  528   3HG2  VAL  64          3HG2      VAL  64 -12.873  -5.988  -2.791
  529    HA   PRO  65           HA       PRO  65 -17.322  -1.756  -3.462
  530   1HB   PRO  65          2HB       PRO  65 -19.260  -1.162  -5.321
  531   2HB   PRO  65          1HB       PRO  65 -17.695  -0.333  -5.242
  532   1HG   PRO  65          2HG       PRO  65 -18.636  -2.386  -7.192
  533   2HG   PRO  65          1HG       PRO  65 -17.427  -1.109  -7.403
  534   1HD   PRO  65          2HD       PRO  65 -16.872  -3.845  -6.943
  535   2HD   PRO  65          1HD       PRO  65 -15.710  -2.508  -6.807
  536    H    ARG  66           H        ARG  66 -19.633  -1.869  -2.670
  537    HA   ARG  66           HA       ARG  66 -20.702  -4.645  -2.978
  538   1HB   ARG  66          2HB       ARG  66 -19.956  -3.405  -0.668
  539   2HB   ARG  66          1HB       ARG  66 -21.667  -2.981  -0.728
  540   1HG   ARG  66          2HG       ARG  66 -22.363  -5.170  -0.531
  541   2HG   ARG  66          1HG       ARG  66 -20.925  -5.809  -1.332
  542   1HD   ARG  66          2HD       ARG  66 -19.625  -5.677   0.608
  543   2HD   ARG  66          1HD       ARG  66 -20.671  -4.463   1.343
  544    HE   ARG  66           HE       ARG  66 -22.253  -6.762   1.077
  545   1HH1  ARG  66          1HH1      ARG  66 -19.474  -7.968   1.639
  546   2HH1  ARG  66          2HH1      ARG  66 -19.546  -8.144   3.360
  547   1HH2  ARG  66          1HH2      ARG  66 -22.292  -6.059   3.724
  548   2HH2  ARG  66          2HH2      ARG  66 -21.142  -7.064   4.541
  549    H    SER  67           H        SER  67 -23.198  -3.788  -1.605
  550    HA   SER  67           HA       SER  67 -24.504  -2.578  -3.990
  551   1HB   SER  67          2HB       SER  67 -25.553  -4.630  -3.403
  552   2HB   SER  67          1HB       SER  67 -25.524  -4.244  -1.685
  553    HG   SER  67           HG       SER  67 -26.946  -2.756  -3.641
  554    H    GLN  68           H        GLN  68 -23.273  -1.589  -1.076
  555    HA   GLN  68           HA       GLN  68 -25.449   0.317  -0.453
  556   1HB   GLN  68          2HB       GLN  68 -24.003  -0.946   1.292
  557   2HB   GLN  68          1HB       GLN  68 -22.751   0.231   0.892
  558   1HG   GLN  68          2HG       GLN  68 -23.807   1.371   2.602
  559   2HG   GLN  68          1HG       GLN  68 -24.763   1.946   1.235
  560   1HE2  GLN  68          1HE2      GLN  68 -25.042   0.532   4.288
  561   2HE2  GLN  68          2HE2      GLN  68 -26.604  -0.115   4.128
  562    H    GLU  69           H        GLU  69 -24.232   0.648  -2.998
  563    HA   GLU  69           HA       GLU  69 -22.218   2.754  -2.842
  564   1HB   GLU  69          2HB       GLU  69 -22.664   1.052  -4.770
  565   2HB   GLU  69          1HB       GLU  69 -23.918   2.190  -5.264
  566   1HG   GLU  69          2HG       GLU  69 -22.260   3.996  -5.383
  567   2HG   GLU  69          1HG       GLU  69 -20.997   2.889  -4.842
  568    H    GLU  70           H        GLU  70 -23.150   4.478  -1.643
  569    HA   GLU  70           HA       GLU  70 -25.783   5.510  -2.378
  570   1HB   GLU  70          2HB       GLU  70 -23.811   5.994  -0.269
  571   2HB   GLU  70          1HB       GLU  70 -24.552   7.481  -0.861
  572   1HG   GLU  70          2HG       GLU  70 -26.592   5.482  -0.608
  573   2HG   GLU  70          1HG       GLU  70 -25.681   5.554   0.901
  574    HA   PRO  71           HA       PRO  71 -23.233   9.036  -4.279
  575   1HB   PRO  71          2HB       PRO  71 -20.492   8.920  -4.137
  576   2HB   PRO  71          1HB       PRO  71 -21.502   9.653  -2.882
  577   1HG   PRO  71          2HG       PRO  71 -20.075   7.034  -2.835
  578   2HG   PRO  71          1HG       PRO  71 -20.532   8.089  -1.488
  579   1HD   PRO  71          2HD       PRO  71 -21.892   5.733  -2.288
  580   2HD   PRO  71          1HD       PRO  71 -22.494   6.967  -1.163
  581    H    GLY  72           H        GLY  72 -20.496   6.786  -4.720
  582   1HA   GLY  72          2HA       GLY  72 -21.452   5.420  -7.013
  583   2HA   GLY  72          1HA       GLY  72 -20.632   6.881  -7.570
  584    H    LYS  73           H        LYS  73 -19.887   4.606  -4.888
  585    HA   LYS  73           HA       LYS  73 -17.674   3.356  -6.169
  586   1HB   LYS  73          2HB       LYS  73 -17.171   6.056  -5.315
  587   2HB   LYS  73          1HB       LYS  73 -16.203   4.952  -4.339
  588   1HG   LYS  73          2HG       LYS  73 -15.199   3.971  -6.280
  589   2HG   LYS  73          1HG       LYS  73 -16.345   4.773  -7.357
  590   1HD   LYS  73          2HD       LYS  73 -15.302   6.833  -7.161
  591   2HD   LYS  73          1HD       LYS  73 -14.664   6.472  -5.555
  592   1HE   LYS  73          2HE       LYS  73 -13.105   4.817  -6.597
  593   2HE   LYS  73          1HE       LYS  73 -13.683   5.326  -8.184
  594   1HZ   LYS  73          1HZ       LYS  73 -12.806   7.426  -6.364
  595   2HZ   LYS  73          2HZ       LYS  73 -12.621   7.298  -8.048
  596   3HZ   LYS  73          3HZ       LYS  73 -11.596   6.429  -7.010
  597    H    GLY  74           H        GLY  74 -16.123   2.403  -4.422
  598   1HA   GLY  74          2HA       GLY  74 -17.773   1.727  -2.019
  599   2HA   GLY  74          1HA       GLY  74 -16.646   0.604  -2.781
  600    H    SER  75           H        SER  75 -14.839   0.370  -1.546
  601    HA   SER  75           HA       SER  75 -13.148   2.570  -0.855
  602   1HB   SER  75          2HB       SER  75 -13.582   1.916   1.762
  603   2HB   SER  75          1HB       SER  75 -14.303   3.311   0.962
  604    HG   SER  75           HG       SER  75 -15.590   1.393   2.080
  605    H    PHE  76           H        PHE  76 -13.001  -0.140  -1.955
  606    HA   PHE  76           HA       PHE  76 -10.656  -1.039  -0.510
  607   1HB   PHE  76          2HB       PHE  76 -13.136  -2.051   0.399
  608   2HB   PHE  76          1HB       PHE  76 -12.383  -3.350  -0.530
  609    HD1  PHE  76           HD1      PHE  76 -12.771  -2.551   2.668
  610    HD2  PHE  76           HD2      PHE  76  -9.525  -2.899  -0.125
  611    HE1  PHE  76           HE1      PHE  76 -11.203  -2.981   4.542
  612    HE2  PHE  76           HE2      PHE  76  -7.958  -3.331   1.750
  613    HZ   PHE  76           HZ       PHE  76  -8.797  -3.371   4.082
  614    H    TRP  77           H        TRP  77  -9.521  -1.165  -2.421
  615    HA   TRP  77           HA       TRP  77 -10.736  -2.754  -4.640
  616   1HB   TRP  77          2HB       TRP  77  -9.146  -1.623  -6.092
  617   2HB   TRP  77          1HB       TRP  77  -9.969  -0.414  -5.112
  618    HD1  TRP  77           HD1      TRP  77  -8.541   1.034  -3.531
  619    HE1  TRP  77           HE1      TRP  77  -6.027   1.153  -2.977
  620    HE3  TRP  77           HE3      TRP  77  -6.930  -3.216  -5.854
  621    HZ2  TRP  77           HZ2      TRP  77  -3.644  -0.357  -3.463
  622    HZ3  TRP  77           HZ3      TRP  77  -4.536  -3.850  -5.790
  623    HH2  TRP  77           HH2      TRP  77  -2.897  -2.425  -4.609
  624    H    ARG  78           H        ARG  78  -9.534  -4.479  -5.584
  625    HA   ARG  78           HA       ARG  78  -7.062  -5.304  -4.116
  626   1HB   ARG  78          2HB       ARG  78  -7.963  -7.709  -4.641
  627   2HB   ARG  78          1HB       ARG  78  -8.572  -6.853  -3.233
  628   1HG   ARG  78          2HG       ARG  78 -10.523  -6.092  -4.513
  629   2HG   ARG  78          1HG       ARG  78  -9.902  -6.902  -5.951
  630   1HD   ARG  78          2HD       ARG  78 -11.085  -8.087  -3.470
  631   2HD   ARG  78          1HD       ARG  78 -11.350  -8.519  -5.157
  632    HE   ARG  78           HE       ARG  78  -8.757  -9.157  -3.827
  633   1HH1  ARG  78          1HH2      ARG  78 -11.270 -10.963  -3.557
  634   2HH1  ARG  78          2HH2      ARG  78 -10.918 -12.156  -4.763
  635   1HH2  ARG  78          1HH1      ARG  78  -8.428 -10.276  -6.276
  636   2HH2  ARG  78          2HH1      ARG  78  -9.308 -11.767  -6.301
  637    H    ILE  79           H        ILE  79  -5.589  -6.542  -5.383
  638    HA   ILE  79           HA       ILE  79  -5.794  -5.966  -8.276
  639    HB   ILE  79           HB       ILE  79  -3.626  -5.654  -7.140
  640   1HG1  ILE  79          2HG1      ILE  79  -3.010  -7.993  -8.842
  641   2HG1  ILE  79          1HG1      ILE  79  -4.070  -6.796  -9.584
  642   1HG2  ILE  79          1HG2      ILE  79  -4.155  -7.721  -5.610
  643   2HG2  ILE  79          2HG2      ILE  79  -2.485  -7.355  -6.042
  644   3HG2  ILE  79          3HG2      ILE  79  -3.358  -8.630  -6.893
  645   1HD1  ILE  79          1HD1      ILE  79  -1.496  -6.489  -9.824
  646   2HD1  ILE  79          2HD1      ILE  79  -1.574  -5.917  -8.160
  647   3HD1  ILE  79          3HD1      ILE  79  -2.483  -5.088  -9.424
  648    H    ASP  80           H        ASP  80  -5.555  -7.749  -9.877
  649    HA   ASP  80           HA       ASP  80  -7.406  -9.826  -9.441
  650   1HB   ASP  80          2HB       ASP  80  -5.267  -9.339 -11.486
  651   2HB   ASP  80          1HB       ASP  80  -6.096 -10.896 -11.457
  652    HA   PRO  81           HA       PRO  81  -4.997 -12.709  -7.164
  653   1HB   PRO  81          2HB       PRO  81  -6.658 -14.874  -7.499
  654   2HB   PRO  81          1HB       PRO  81  -7.009 -13.529  -6.399
  655   1HG   PRO  81          2HG       PRO  81  -8.254 -14.170  -9.023
  656   2HG   PRO  81          1HG       PRO  81  -8.907 -13.227  -7.673
  657   1HD   PRO  81          2HD       PRO  81  -7.779 -12.194 -10.081
  658   2HD   PRO  81          1HD       PRO  81  -8.241 -11.255  -8.643
  659    H    ALA  82           H        ALA  82  -6.036 -13.479 -10.464
  660    HA   ALA  82           HA       ALA  82  -4.083 -15.674 -10.671
  661   1HB   ALA  82          1HB       ALA  82  -5.135 -14.905 -13.224
  662   2HB   ALA  82          2HB       ALA  82  -6.456 -14.919 -12.056
  663   3HB   ALA  82          3HB       ALA  82  -5.476 -16.366 -12.297
  664    H    SER  83           H        SER  83  -4.059 -12.290 -11.083
  665    HA   SER  83           HA       SER  83  -1.685 -12.514 -12.881
  666   1HB   SER  83          2HB       SER  83  -3.879 -10.602 -12.729
  667   2HB   SER  83          1HB       SER  83  -2.316  -9.793 -12.613
  668    HG   SER  83           HG       SER  83  -3.344 -11.461 -14.652
  669    H    GLU  84           H        GLU  84  -2.675 -11.971  -9.677
  670    HA   GLU  84           HA       GLU  84  -0.784 -10.050  -8.810
  671   1HB   GLU  84          2HB       GLU  84  -2.682 -10.992  -7.438
  672   2HB   GLU  84          1HB       GLU  84  -1.721 -12.456  -7.223
  673   1HG   GLU  84          2HG       GLU  84   0.029 -10.352  -6.607
  674   2HG   GLU  84          1HG       GLU  84  -1.501  -9.908  -5.849
  675    H    ALA  85           H        ALA  85  -0.265 -13.209 -10.017
  676    HA   ALA  85           HA       ALA  85   2.310 -13.502  -8.585
  677   1HB   ALA  85          1HB       ALA  85   0.786 -15.200 -10.565
  678   2HB   ALA  85          2HB       ALA  85   1.258 -15.594  -8.912
  679   3HB   ALA  85          3HB       ALA  85   2.474 -15.545 -10.189
  680    H    LYS  86           H        LYS  86   1.075 -12.426 -11.682
  681    HA   LYS  86           HA       LYS  86   3.752 -12.395 -12.889
  682   1HB   LYS  86          2HB       LYS  86   2.690 -11.827 -14.902
  683   2HB   LYS  86          1HB       LYS  86   1.509 -12.860 -14.105
  684   1HG   LYS  86          2HG       LYS  86   0.137 -11.099 -14.692
  685   2HG   LYS  86          1HG       LYS  86   0.677 -10.524 -13.118
  686   1HD   LYS  86          2HD       LYS  86   1.958  -8.862 -14.016
  687   2HD   LYS  86          1HD       LYS  86   2.460  -9.856 -15.384
  688   1HE   LYS  86          2HE       LYS  86   0.061  -9.602 -16.254
  689   2HE   LYS  86          1HE       LYS  86  -0.129  -8.333 -15.045
  690   1HZ   LYS  86          1HZ       LYS  86   1.105  -6.926 -16.229
  691   2HZ   LYS  86          2HZ       LYS  86   0.873  -7.989 -17.534
  692   3HZ   LYS  86          3HZ       LYS  86   2.281  -8.094 -16.589
  693    H    LEU  87           H        LEU  87   1.443 -10.029 -11.554
  694    HA   LEU  87           HA       LEU  87   2.985  -7.727 -12.347
  695   1HB   LEU  87          2HB       LEU  87   1.732  -6.745 -10.193
  696   2HB   LEU  87          1HB       LEU  87   0.908  -6.969 -11.719
  697    HG   LEU  87           HG       LEU  87   0.827  -9.405 -10.138
  698   1HD1  LEU  87          1HD1      LEU  87   0.649  -8.416  -8.100
  699   2HD1  LEU  87          2HD1      LEU  87  -0.991  -8.058  -8.639
  700   3HD1  LEU  87          3HD1      LEU  87   0.274  -6.837  -8.789
  701   1HD2  LEU  87          1HD2      LEU  87  -1.197  -7.482 -11.317
  702   2HD2  LEU  87          2HD2      LEU  87  -1.663  -8.965 -10.485
  703   3HD2  LEU  87          3HD2      LEU  87  -0.706  -9.042 -11.965
  704    H    VAL  88           H        VAL  88   2.593  -9.339  -9.239
  705    HA   VAL  88           HA       VAL  88   4.422  -8.007  -7.671
  706    HB   VAL  88           HB       VAL  88   4.857 -10.237  -6.645
  707   1HG1  VAL  88          1HG1      VAL  88   3.002  -9.111  -5.740
  708   2HG1  VAL  88          2HG1      VAL  88   2.325 -10.668  -6.215
  709   3HG1  VAL  88          3HG1      VAL  88   2.082  -9.250  -7.236
  710   1HG2  VAL  88          1HG2      VAL  88   4.810 -11.645  -8.591
  711   2HG2  VAL  88          2HG2      VAL  88   3.187 -11.094  -9.008
  712   3HG2  VAL  88          3HG2      VAL  88   3.435 -12.115  -7.591
  713    H    GLU  89           H        GLU  89   5.121 -10.183 -10.342
  714    HA   GLU  89           HA       GLU  89   7.798 -10.845  -9.783
  715   1HB   GLU  89          2HB       GLU  89   6.101 -10.752 -12.148
  716   2HB   GLU  89          1HB       GLU  89   7.763 -10.303 -12.533
  717   1HG   GLU  89          2HG       GLU  89   7.929 -12.501 -10.759
  718   2HG   GLU  89          1HG       GLU  89   6.696 -12.917 -11.951
  719    H    GLN  90           H        GLN  90   6.561  -7.980 -11.523
  720    HA   GLN  90           HA       GLN  90   9.208  -6.736 -11.534
  721   1HB   GLN  90          2HB       GLN  90   6.658  -6.275 -12.792
  722   2HB   GLN  90          1HB       GLN  90   7.182  -4.794 -11.989
  723   1HG   GLN  90          2HG       GLN  90   8.968  -4.512 -13.382
  724   2HG   GLN  90          1HG       GLN  90   9.289  -6.244 -13.485
  725   1HE2  GLN  90          1HE2      GLN  90   6.945  -3.768 -14.645
  726   2HE2  GLN  90          2HE2      GLN  90   6.592  -4.570 -16.099
  727    H    ALA  91           H        ALA  91   6.626  -7.047  -9.320
  728    HA   ALA  91           HA       ALA  91   6.913  -4.538  -7.945
  729   1HB   ALA  91          1HB       ALA  91   4.915  -5.979  -7.726
  730   2HB   ALA  91          2HB       ALA  91   5.621  -5.568  -6.162
  731   3HB   ALA  91          3HB       ALA  91   5.893  -7.165  -6.861
  732    H    PHE  92           H        PHE  92   8.430  -7.716  -7.562
  733    HA   PHE  92           HA       PHE  92  10.000  -6.745  -5.255
  734   1HB   PHE  92          2HB       PHE  92  10.146  -9.425  -6.662
  735   2HB   PHE  92          1HB       PHE  92  10.801  -9.025  -5.075
  736    HD1  PHE  92           HD1      PHE  92   8.307 -10.839  -6.460
  737    HD2  PHE  92           HD2      PHE  92   8.771  -7.597  -3.681
  738    HE1  PHE  92           HE1      PHE  92   6.139 -11.427  -5.412
  739    HE2  PHE  92           HE2      PHE  92   6.602  -8.185  -2.633
  740    HZ   PHE  92           HZ       PHE  92   5.285 -10.100  -3.499
  741    H    ARG  93           H        ARG  93  10.957  -5.078  -6.912
  742    HA   ARG  93           HA       ARG  93  13.652  -5.853  -7.470
  743   1HB   ARG  93          2HB       ARG  93  13.645  -5.892  -9.904
  744   2HB   ARG  93          1HB       ARG  93  12.534  -7.123  -9.307
  745   1HG   ARG  93          2HG       ARG  93  10.627  -5.790  -9.807
  746   2HG   ARG  93          1HG       ARG  93  11.606  -4.342 -10.040
  747   1HD   ARG  93          2HD       ARG  93  12.090  -6.756 -11.764
  748   2HD   ARG  93          1HD       ARG  93  10.755  -5.667 -12.141
  749    HE   ARG  93           HE       ARG  93  13.639  -4.950 -12.219
  750   1HH1  ARG  93          1HH2      ARG  93  10.902  -3.245 -11.532
  751   2HH1  ARG  93          2HH2      ARG  93  10.941  -2.223 -12.929
  752   1HH2  ARG  93          1HH1      ARG  93  13.447  -4.026 -14.509
  753   2HH2  ARG  93          2HH1      ARG  93  12.382  -2.664 -14.614
  754    H    LYS  94           H        LYS  94  14.895  -4.071  -8.358
  755    HA   LYS  94           HA       LYS  94  13.725  -1.478  -7.681
  756   1HB   LYS  94          2HB       LYS  94  16.340  -2.581  -7.856
  757   2HB   LYS  94          1HB       LYS  94  16.269  -1.234  -8.994
  758   1HG   LYS  94          2HG       LYS  94  15.000  -0.113  -6.886
  759   2HG   LYS  94          1HG       LYS  94  16.071  -1.222  -6.032
  760   1HD   LYS  94          2HD       LYS  94  17.377   0.234  -8.229
  761   2HD   LYS  94          1HD       LYS  94  16.799   1.274  -6.927
  762   1HE   LYS  94          2HE       LYS  94  19.117   0.489  -6.516
  763   2HE   LYS  94          1HE       LYS  94  18.001  -0.087  -5.276
  764   1HZ   LYS  94          1HZ       LYS  94  19.104  -1.601  -7.572
  765   2HZ   LYS  94          2HZ       LYS  94  17.792  -2.157  -6.647
  766   3HZ   LYS  94          3HZ       LYS  94  19.308  -1.923  -5.920
  767    H    ARG  95           H        ARG  95  13.846   0.370  -9.226
  768    HA   ARG  95           HA       ARG  95  13.769  -0.424 -12.090
  769   1HB   ARG  95          2HB       ARG  95  11.440  -0.515 -11.438
  770   2HB   ARG  95          1HB       ARG  95  11.562   1.039 -10.613
  771   1HG   ARG  95          2HG       ARG  95  11.776   2.234 -12.639
  772   2HG   ARG  95          1HG       ARG  95  12.190   0.782 -13.551
  773   1HD   ARG  95          2HD       ARG  95  10.005   0.711 -14.133
  774   2HD   ARG  95          1HD       ARG  95   9.713   0.156 -12.485
  775    HE   ARG  95           HE       ARG  95   8.715   2.241 -12.051
  776   1HH1  ARG  95          1HH1      ARG  95  10.728   2.350 -14.853
  777   2HH1  ARG  95          2HH1      ARG  95  10.403   4.020 -15.180
  778   1HH2  ARG  95          1HH2      ARG  95   8.346   4.438 -12.420
  779   2HH2  ARG  95          2HH2      ARG  95   9.056   5.201 -13.804
  780    H    ARG  96           H        ARG  96  14.573   1.189 -13.436
  781    HA   ARG  96           HA       ARG  96  15.726   3.544 -12.063
  782   1HB   ARG  96          2HB       ARG  96  16.175   2.200 -14.715
  783   2HB   ARG  96          1HB       ARG  96  16.706   3.866 -14.476
  784   1HG   ARG  96          2HG       ARG  96  18.600   2.766 -13.745
  785   2HG   ARG  96          1HG       ARG  96  17.705   2.830 -12.227
  786   1HD   ARG  96          2HD       ARG  96  18.021   0.577 -12.203
  787   2HD   ARG  96          1HD       ARG  96  16.680   0.555 -13.348
  788    HE   ARG  96           HE       ARG  96  18.285  -0.369 -14.805
  789   1HH1  ARG  96          1HH1      ARG  96  20.516  -0.020 -12.717
  790   2HH1  ARG  96          2HH1      ARG  96  21.642   0.946 -13.611
  791   1HH2  ARG  96          1HH2      ARG  96  19.352   1.827 -16.060
  792   2HH2  ARG  96          2HH2      ARG  96  20.983   1.991 -15.503
  793    H    GLN  97           H        GLN  97  15.756   5.515 -13.858
  794    HA   GLN  97           HA       GLN  97  12.874   5.956 -14.540
  795   1HB   GLN  97          2HB       GLN  97  13.451   8.418 -14.207
  796   2HB   GLN  97          1HB       GLN  97  13.435   7.438 -12.741
  797   1HG   GLN  97          2HG       GLN  97  15.761   7.422 -12.563
  798   2HG   GLN  97          1HG       GLN  97  15.995   7.746 -14.281
  799   1HE2  GLN  97          1HE2      GLN  97  15.635   9.991 -15.033
  800   2HE2  GLN  97          2HE2      GLN  97  15.681  11.283 -13.933
  801    H    ARG  98           H        ARG  98  12.554   6.138 -16.699
  802    HA   ARG  98           HA       ARG  98  14.451   7.649 -18.354
  803   1HB   ARG  98          2HB       ARG  98  14.987   4.990 -18.131
  804   2HB   ARG  98          1HB       ARG  98  13.867   4.975 -19.492
  805   1HG   ARG  98          2HG       ARG  98  15.297   6.138 -20.862
  806   2HG   ARG  98          1HG       ARG  98  15.987   7.065 -19.530
  807   1HD   ARG  98          2HD       ARG  98  17.007   4.796 -18.774
  808   2HD   ARG  98          1HD       ARG  98  16.656   4.265 -20.419
  809    HE   ARG  98           HE       ARG  98  18.049   6.775 -20.488
  810   1HH1  ARG  98          1HH1      ARG  98  19.275   4.566 -18.515
  811   2HH1  ARG  98          2HH1      ARG  98  20.577   4.025 -19.522
  812   1HH2  ARG  98          1HH2      ARG  98  19.374   5.593 -22.372
  813   2HH2  ARG  98          2HH2      ARG  98  20.633   4.607 -21.706
  814    H    GLY  99           H        GLY  99  12.438   8.921 -18.485
  815   1HA   GLY  99          2HA       GLY  99  10.743   7.966 -20.709
  816   2HA   GLY  99          1HA       GLY  99   9.914   8.350 -19.201
  817    H    VAL 100           H        VAL 100  10.846  10.604 -18.280
  818    HA   VAL 100           HA       VAL 100  10.191  12.574 -20.354
  819    HB   VAL 100           HB       VAL 100  10.923  12.899 -17.427
  820   1HG1  VAL 100          1HG1      VAL 100  10.222  15.191 -17.641
  821   2HG1  VAL 100          2HG1      VAL 100   9.680  14.929 -19.299
  822   3HG1  VAL 100          3HG1      VAL 100  11.401  14.890 -18.917
  823   1HG2  VAL 100          1HG2      VAL 100   8.335  12.675 -18.957
  824   2HG2  VAL 100          2HG2      VAL 100   8.396  13.536 -17.418
  825   3HG2  VAL 100          3HG2      VAL 100   8.827  11.827 -17.492
  826    H    SER 101           HN       SER 101  13.037  11.517 -18.551
  827    HA   SER 101           HA       SER 101  14.903  12.361 -20.488
  828   1HB   SER 101          2HB       SER 101  14.302  14.651 -20.059
  829   2HB   SER 101          1HB       SER 101  14.370  14.403 -18.317
  830    HG   SER 101           HG       SER 101  16.383  14.862 -20.132