*HEADER    TRANSCRIPTION REGULATOR                 27-APR-05   1ZIT              
*TITLE     STRUCTURE OF THE RECEIVER DOMAIN OF NTRC4 FROM AQUIFEX                
*TITLE    2 AEOLICUS                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TRANSCRIPTIONAL REGULATOR (NTRC FAMILY);                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RECEIVER DOMAIN;                                           
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS VF5;                           
*SOURCE   3 GENE: AQ_164;                                                        
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                                
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21A                                    
*KEYWDS    (BETA/ALPHA)5                                                         
*EXPDTA    NMR, 38 STRUCTURES                                                    
*AUTHOR    K.MATSUBARA, J.G.PELTON, D.E.WEMMER                                   
*REVDAT   1   09-MAY-06 1ZIT    0                                                
assign ( resid 2 and name HA )( resid 2 and name HB# ) 2.6 0.8 0.0
assign ( resid 2 and name HA )( resid 2 and name HG# ) 3.4 1.6 0.0
assign ( resid 2 and name HA )( resid 2 and name HD# ) 3.4 1.6 0.0
assign ( resid 2 and name HA )( resid 3 and name HN ) 2.9 1.1 0.0
assign ( resid 2 and name HB2 )( resid 2 and name HD2 ) 4.2 2.5 0.0
assign ( resid 2 and name HB2 )( resid 2 and name HD1 ) 4.2 2.5 0.0
assign ( resid 2 and name HB2 )( resid 26 and name HA ) 5.0 3.2 0.0
assign ( resid 2 and name HB1 )( resid 2 and name HD2 ) 4.2 2.5 0.0
assign ( resid 2 and name HB1 )( resid 2 and name HD1 ) 4.2 2.5 0.0
assign ( resid 2 and name HB1 )( resid 26 and name HA ) 5.0 3.2 0.0
assign ( resid 2 and name HB# )( resid 2 and name HD# ) 3.3 1.5 0.0
assign ( resid 2 and name HB# )( resid 26 and name HA ) 4.1 2.3 0.0
assign ( resid 2 and name HD2 )( resid 117 and name HB2 ) 6.8 5.0 0.0
assign ( resid 2 and name HD2 )( resid 117 and name HB1 ) 6.8 5.0 0.0
assign ( resid 2 and name HD1 )( resid 117 and name HB2 ) 6.8 5.0 0.0
assign ( resid 2 and name HD1 )( resid 117 and name HB1 ) 6.8 5.0 0.0
assign ( resid 2 and name HD# )( resid 117 and name HD# ) 5.0 3.2 0.0
assign ( resid 2 and name HE# )( resid 117 and name HB# ) 5.0 3.2 0.0
assign ( resid 3 and name HN )( resid 3 and name HB# ) 3.7 1.9 0.0
assign ( resid 3 and name HN )( resid 3 and name HG# ) 4.2 2.4 0.0
assign ( resid 3 and name HN )( resid 3 and name HD# ) 5.9 4.1 0.0
assign ( resid 3 and name HN )( resid 47 and name HG2 ) 5.0 3.2 0.0
assign ( resid 3 and name HN )( resid 47 and name HG1 ) 5.0 3.2 0.0
assign ( resid 3 and name HN )( resid 47 and name HG# ) 5.9 4.1 0.0
assign ( resid 3 and name HN )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 3 and name HA )( resid 3 and name HG# ) 3.7 1.9 0.0
assign ( resid 3 and name HA )( resid 3 and name HD# ) 4.2 2.4 0.0
assign ( resid 3 and name HA )( resid 4 and name HN ) 2.9 1.1 0.0
assign ( resid 3 and name HA )( resid 27 and name HN ) 5.0 3.2 0.0
assign ( resid 3 and name HA )( resid 27 and name HB2 ) 3.3 1.5 0.0
assign ( resid 3 and name HA )( resid 27 and name HB1 ) 3.3 1.5 0.0
assign ( resid 3 and name HA )( resid 27 and name HB# ) 2.8 1.0 0.0
assign ( resid 3 and name HB2 )( resid 27 and name HB2 ) 6.8 5.0 0.0
assign ( resid 3 and name HB2 )( resid 27 and name HB1 ) 6.8 5.0 0.0
assign ( resid 3 and name HB1 )( resid 27 and name HB2 ) 6.8 5.0 0.0
assign ( resid 3 and name HB1 )( resid 27 and name HB1 ) 6.8 5.0 0.0
assign ( resid 3 and name HB# )( resid 3 and name HD# ) 3.6 1.8 0.0
assign ( resid 3 and name HB# )( resid 27 and name HB# ) 5.8 4.0 0.0
assign ( resid 3 and name HB# )( resid 47 and name HD# ) 6.8 5.0 0.0
assign ( resid 3 and name HG2 )( resid 27 and name HB2 ) 5.0 3.2 0.0
assign ( resid 3 and name HG2 )( resid 27 and name HB1 ) 5.0 3.2 0.0
assign ( resid 3 and name HG1 )( resid 27 and name HB2 ) 5.0 3.2 0.0
assign ( resid 3 and name HG1 )( resid 27 and name HB1 ) 5.0 3.2 0.0
assign ( resid 3 and name HG# )( resid 27 and name HB# ) 4.1 2.3 0.0
assign ( resid 3 and name HD# )( resid 4 and name HN ) 5.9 4.1 0.0
assign ( resid 3 and name HD# )( resid 117 and name HE# ) 5.9 4.1 0.0
assign ( resid 4 and name HN )( resid 4 and name HB ) 3.3 1.5 0.0
assign ( resid 4 and name HN )( resid 5 and name HN ) 5.0 3.2 0.0
assign ( resid 4 and name HN )( resid 28 and name HA ) 3.3 1.5 0.0
assign ( resid 4 and name HN )( resid 28 and name HB# ) 5.0 3.2 0.0
assign ( resid 4 and name HN )( resid 29 and name HN ) 5.0 3.2 0.0
assign ( resid 4 and name HN )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 4 and name HA )( resid 5 and name HN ) 2.5 0.7 0.0
assign ( resid 4 and name HA )( resid 48 and name HN ) 3.3 1.5 0.0
assign ( resid 4 and name HA )( resid 48 and name HB ) 5.0 3.2 0.0
assign ( resid 4 and name HA )( resid 48 and name HG1# ) 5.0 3.2 0.0
assign ( resid 4 and name HB )( resid 28 and name HA ) 5.0 3.2 0.0
assign ( resid 4 and name HB )( resid 29 and name HN ) 5.0 3.2 0.0
assign ( resid 4 and name HG1# )( resid 5 and name HN ) 2.9 1.1 0.0
assign ( resid 4 and name HG1# )( resid 48 and name HG2# ) 5.0 3.2 0.0
assign ( resid 4 and name HG2# )( resid 5 and name HN ) 5.0 3.2 0.0
assign ( resid 4 and name HG2# )( resid 26 and name HE# ) 5.0 3.2 0.0
assign ( resid 4 and name HG2# )( resid 48 and name HB ) 4.3 2.5 0.0
assign ( resid 4 and name HG2# )( resid 48 and name HG1# ) 4.6 2.8 0.0
assign ( resid 4 and name HG2# )( resid 48 and name HG2# ) 4.6 2.8 0.0
assign ( resid 4 and name HG2# )( resid 113 and name HG2# ) 4.6 2.8 0.0
assign ( resid 4 and name HG2# )( resid 113 and name HD1# ) 5.4 3.6 0.0
assign ( resid 4 and name HG2# )( resid 117 and name HD# ) 5.0 3.2 0.0
assign ( resid 4 and name O )( resid 29 and name N ) 3.3 1.5 0.0
assign ( resid 4 and name O )( resid 29 and name HN ) 2.3 0.5 0.0
assign ( resid 5 and name N )( resid 48 and name O ) 3.3 1.5 0.0
assign ( resid 5 and name HN )( resid 5 and name HB2 ) 3.3 1.5 0.0
assign ( resid 5 and name HN )( resid 5 and name HB1 ) 3.3 1.5 0.0
assign ( resid 5 and name HN )( resid 6 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HN )( resid 46 and name HD# ) 5.0 3.2 0.0
assign ( resid 5 and name HN )( resid 48 and name O ) 2.3 0.5 0.0
assign ( resid 5 and name HN )( resid 49 and name HA ) 2.9 1.1 0.0
assign ( resid 5 and name HN )( resid 50 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HA )( resid 5 and name HD1# ) 3.5 1.7 0.0
assign ( resid 5 and name HA )( resid 5 and name HD2# ) 5.0 3.2 0.0
assign ( resid 5 and name HA )( resid 6 and name HN ) 2.9 1.1 0.0
assign ( resid 5 and name HA )( resid 29 and name HN ) 3.3 1.5 0.0
assign ( resid 5 and name HA )( resid 30 and name HA ) 5.0 3.2 0.0
assign ( resid 5 and name HA )( resid 50 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HB# )( resid 5 and name HD1# ) 3.3 1.5 0.0
assign ( resid 5 and name HB# )( resid 5 and name HD2# ) 3.3 1.5 0.0
assign ( resid 5 and name HB# )( resid 46 and name HD# ) 5.9 4.1 0.0
assign ( resid 5 and name HB# )( resid 49 and name HG2# ) 5.2 3.4 0.0
assign ( resid 5 and name HB# )( resid 49 and name HD1# ) 5.2 3.4 0.0
assign ( resid 5 and name HG )( resid 7 and name HG2# ) 4.3 2.5 0.0
assign ( resid 5 and name HD1# )( resid 6 and name HN ) 3.3 1.5 0.0
assign ( resid 5 and name HD1# )( resid 7 and name HG2# ) 7.1 5.3 0.0
assign ( resid 5 and name HD1# )( resid 29 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HD1# )( resid 29 and name HA ) 5.0 3.2 0.0
assign ( resid 5 and name HD1# )( resid 29 and name HB2 ) 4.3 2.5 0.0
assign ( resid 5 and name HD1# )( resid 29 and name HB1 ) 4.3 2.5 0.0
assign ( resid 5 and name HD1# )( resid 29 and name HB# ) 3.9 2.0 0.0
assign ( resid 5 and name HD1# )( resid 30 and name HN ) 6.0 4.2 0.0
assign ( resid 5 and name HD1# )( resid 30 and name HA ) 4.3 2.5 0.0
assign ( resid 5 and name HD1# )( resid 31 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HD1# )( resid 31 and name HB# ) 5.4 3.6 0.0
assign ( resid 5 and name HD1# )( resid 40 and name HB# ) 5.2 3.4 0.0
assign ( resid 5 and name HD1# )( resid 41 and name HG1# ) 5.2 3.4 0.0
assign ( resid 5 and name HD1# )( resid 46 and name HE# ) 3.3 1.5 0.0
assign ( resid 5 and name HD1# )( resid 46 and name HZ ) 5.0 3.2 0.0
assign ( resid 5 and name HD1# )( resid 49 and name HD1# ) 7.1 5.3 0.0
assign ( resid 5 and name HD2# )( resid 6 and name HN ) 6.0 4.2 0.0
assign ( resid 5 and name HD2# )( resid 7 and name HG1# ) 7.1 5.3 0.0
assign ( resid 5 and name HD2# )( resid 7 and name HG2# ) 4.6 2.8 0.0
assign ( resid 5 and name HD2# )( resid 31 and name HB# ) 7.1 5.3 0.0
assign ( resid 5 and name HD2# )( resid 37 and name HA ) 4.3 2.5 0.0
assign ( resid 5 and name HD2# )( resid 37 and name HB# ) 5.4 3.6 0.0
assign ( resid 5 and name HD2# )( resid 41 and name HN ) 5.0 3.2 0.0
assign ( resid 5 and name HD2# )( resid 41 and name HG12 ) 4.3 2.5 0.0
assign ( resid 5 and name HD2# )( resid 41 and name HG11 ) 4.3 2.5 0.0
assign ( resid 5 and name HD2# )( resid 41 and name HG1# ) 3.9 2.0 0.0
assign ( resid 5 and name HD2# )( resid 41 and name HD1# ) 4.6 2.8 0.0
assign ( resid 5 and name HD2# )( resid 46 and name HD# ) 5.0 3.2 0.0
assign ( resid 5 and name HD2# )( resid 46 and name HE# ) 5.0 3.2 0.0
assign ( resid 5 and name HD2# )( resid 49 and name HG2# ) 4.6 2.8 0.0
assign ( resid 5 and name HD2# )( resid 49 and name HD1# ) 5.4 3.6 0.0
assign ( resid 5 and name O )( resid 50 and name N ) 3.3 1.5 0.0
assign ( resid 5 and name O )( resid 50 and name HN ) 2.3 0.5 0.0
assign ( resid 6 and name HN )( resid 6 and name HB ) 3.3 1.5 0.0
assign ( resid 6 and name HN )( resid 6 and name HG2# ) 3.3 1.5 0.0
assign ( resid 6 and name HN )( resid 29 and name HN ) 3.3 1.5 0.0
assign ( resid 6 and name HN )( resid 30 and name HA ) 3.3 1.5 0.0
assign ( resid 6 and name HN )( resid 30 and name HG2# ) 6.0 4.2 0.0
assign ( resid 6 and name HA )( resid 7 and name HN ) 2.9 1.1 0.0
assign ( resid 6 and name HA )( resid 50 and name HN ) 3.3 1.5 0.0
assign ( resid 6 and name HB )( resid 7 and name HN ) 5.0 3.2 0.0
assign ( resid 6 and name HB )( resid 14 and name HG2# ) 4.3 2.5 0.0
assign ( resid 6 and name HB )( resid 17 and name HD1# ) 6.0 4.2 0.0
assign ( resid 6 and name HB )( resid 30 and name HA ) 3.3 1.5 0.0
assign ( resid 6 and name HB )( resid 30 and name HG2# ) 4.3 2.5 0.0
assign ( resid 6 and name HB )( resid 31 and name HN ) 5.0 3.2 0.0
assign ( resid 6 and name HG1# )( resid 7 and name HN ) 4.3 2.5 0.0
assign ( resid 6 and name HG1# )( resid 8 and name HB2 ) 4.3 2.5 0.0
assign ( resid 6 and name HG1# )( resid 8 and name HB1 ) 4.3 2.5 0.0
assign ( resid 6 and name HG1# )( resid 14 and name HN ) 5.0 3.2 0.0
assign ( resid 6 and name HG1# )( resid 14 and name HG2# ) 4.6 2.8 0.0
assign ( resid 6 and name HG1# )( resid 17 and name HG ) 4.3 2.5 0.0
assign ( resid 6 and name HG1# )( resid 17 and name HD1# ) 4.6 2.8 0.0
assign ( resid 6 and name HG1# )( resid 17 and name HD2# ) 7.1 5.3 0.0
assign ( resid 6 and name HG2# )( resid 17 and name HG ) 4.3 2.5 0.0
assign ( resid 6 and name HG2# )( resid 17 and name HD1# ) 4.6 2.8 0.0
assign ( resid 6 and name HG2# )( resid 17 and name HD2# ) 7.1 5.3 0.0
assign ( resid 6 and name HG2# )( resid 28 and name HA ) 6.0 4.2 0.0
assign ( resid 6 and name HG2# )( resid 28 and name HB# ) 4.4 2.6 0.0
assign ( resid 6 and name HG2# )( resid 28 and name HG# ) 6.9 5.1 0.0
assign ( resid 6 and name HG2# )( resid 30 and name HA ) 4.3 2.5 0.0
assign ( resid 6 and name HG2# )( resid 30 and name HG2# ) 4.6 2.8 0.0
assign ( resid 7 and name N )( resid 50 and name O ) 3.3 1.5 0.0
assign ( resid 7 and name HN )( resid 7 and name HB ) 3.3 1.5 0.0
assign ( resid 7 and name HN )( resid 7 and name HG2# ) 3.5 1.7 0.0
assign ( resid 7 and name HN )( resid 8 and name HN ) 5.0 3.2 0.0
assign ( resid 7 and name HN )( resid 50 and name O ) 2.3 0.5 0.0
assign ( resid 7 and name HN )( resid 51 and name HA ) 3.3 1.5 0.0
assign ( resid 7 and name HN )( resid 51 and name HB2 ) 6.0 4.2 0.0
assign ( resid 7 and name HN )( resid 51 and name HB1 ) 6.0 4.2 0.0
assign ( resid 7 and name HN )( resid 51 and name HB# ) 5.5 3.7 0.0
assign ( resid 7 and name HA )( resid 7 and name HG2# ) 3.3 1.5 0.0
assign ( resid 7 and name HA )( resid 8 and name HN ) 2.9 1.1 0.0
assign ( resid 7 and name HA )( resid 14 and name HG2# ) 6.0 4.2 0.0
assign ( resid 7 and name HA )( resid 30 and name HB ) 5.0 3.2 0.0
assign ( resid 7 and name HA )( resid 31 and name HN ) 3.3 1.5 0.0
assign ( resid 7 and name HB )( resid 31 and name HB# ) 6.0 4.2 0.0
assign ( resid 7 and name HB )( resid 34 and name HD2# ) 5.0 3.2 0.0
assign ( resid 7 and name HB )( resid 51 and name HA ) 3.3 1.5 0.0
assign ( resid 7 and name HB )( resid 51 and name HD1# ) 3.5 1.7 0.0
assign ( resid 7 and name HB )( resid 52 and name HN ) 5.0 3.2 0.0
assign ( resid 7 and name HG1# )( resid 8 and name HN ) 5.0 3.2 0.0
assign ( resid 7 and name HG1# )( resid 31 and name HB# ) 5.4 3.6 0.0
assign ( resid 7 and name HG1# )( resid 34 and name HA ) 4.3 2.5 0.0
assign ( resid 7 and name HG1# )( resid 34 and name HD2# ) 4.6 2.8 0.0
assign ( resid 7 and name HG1# )( resid 51 and name HA ) 4.3 2.5 0.0
assign ( resid 7 and name HG2# )( resid 31 and name HN ) 6.0 4.2 0.0
assign ( resid 7 and name HG2# )( resid 31 and name HB# ) 5.4 3.6 0.0
assign ( resid 7 and name HG2# )( resid 51 and name HA ) 6.0 4.2 0.0
assign ( resid 8 and name HN )( resid 8 and name HB# ) 3.7 1.9 0.0
assign ( resid 8 and name HN )( resid 9 and name HN ) 5.0 3.2 0.0
assign ( resid 8 and name HN )( resid 31 and name HN ) 5.0 3.2 0.0
assign ( resid 8 and name HN )( resid 31 and name HB# ) 6.0 4.2 0.0
assign ( resid 8 and name HN )( resid 32 and name HA ) 3.3 1.5 0.0
assign ( resid 8 and name HN )( resid 32 and name HG# ) 5.9 4.1 0.0
assign ( resid 8 and name HN )( resid 51 and name HD1# ) 6.0 4.2 0.0
assign ( resid 8 and name HA )( resid 9 and name HN ) 2.9 1.1 0.0
assign ( resid 8 and name HB2 )( resid 14 and name HG2# ) 4.3 2.5 0.0
assign ( resid 8 and name HB1 )( resid 14 and name HG2# ) 4.3 2.5 0.0
assign ( resid 8 and name HB# )( resid 14 and name HG2# ) 3.9 2.0 0.0
assign ( resid 9 and name HN )( resid 9 and name HB2 ) 3.3 1.5 0.0
assign ( resid 9 and name HN )( resid 9 and name HB1 ) 3.3 1.5 0.0
assign ( resid 9 and name HN )( resid 9 and name HB# ) 3.7 1.9 0.0
assign ( resid 9 and name HN )( resid 10 and name HN ) 3.3 1.5 0.0
assign ( resid 9 and name HN )( resid 32 and name HA ) 5.0 3.2 0.0
assign ( resid 9 and name HN )( resid 54 and name HN ) 3.3 1.5 0.0
assign ( resid 9 and name HA )( resid 54 and name HB# ) 5.9 4.1 0.0
assign ( resid 9 and name HB2 )( resid 56 and name HG2 ) 5.0 3.2 0.0
assign ( resid 9 and name HB2 )( resid 56 and name HG1 ) 5.0 3.2 0.0
assign ( resid 9 and name HB1 )( resid 56 and name HG2 ) 5.0 3.2 0.0
assign ( resid 9 and name HB1 )( resid 56 and name HG1 ) 5.0 3.2 0.0
assign ( resid 9 and name HB# )( resid 56 and name HB# ) 5.0 3.2 0.0
assign ( resid 10 and name HN )( resid 10 and name HB# ) 3.7 1.9 0.0
assign ( resid 12 and name HA )( resid 12 and name HB# ) 2.6 0.8 0.0
assign ( resid 13 and name HN )( resid 13 and name HB ) 3.3 1.5 0.0
assign ( resid 13 and name HN )( resid 13 and name HG1# ) 4.2 2.4 0.0
assign ( resid 13 and name HN )( resid 14 and name HN ) 5.0 3.2 0.0
assign ( resid 13 and name HA )( resid 13 and name HD1# ) 3.5 1.7 0.0
assign ( resid 13 and name HB )( resid 14 and name HN ) 3.3 1.5 0.0
assign ( resid 13 and name HG2# )( resid 14 and name HN ) 4.3 2.5 0.0
assign ( resid 13 and name HG2# )( resid 14 and name HA ) 5.0 3.2 0.0
assign ( resid 13 and name HG2# )( resid 17 and name HN ) 5.0 3.2 0.0
assign ( resid 13 and name HG2# )( resid 17 and name HB2 ) 4.3 2.5 0.0
assign ( resid 13 and name HG2# )( resid 17 and name HB1 ) 4.3 2.5 0.0
assign ( resid 13 and name HG2# )( resid 17 and name HB# ) 3.9 2.0 0.0
assign ( resid 13 and name HG2# )( resid 17 and name HD1# ) 7.1 5.3 0.0
assign ( resid 13 and name HG2# )( resid 18 and name HN ) 5.0 3.2 0.0
assign ( resid 13 and name HD1# )( resid 17 and name HB# ) 6.9 5.1 0.0
assign ( resid 14 and name HN )( resid 14 and name HG2# ) 3.3 1.5 0.0
assign ( resid 14 and name HN )( resid 15 and name HN ) 5.0 3.2 0.0
assign ( resid 14 and name HA )( resid 14 and name HG2# ) 3.3 1.5 0.0
assign ( resid 14 and name HA )( resid 17 and name HB# ) 5.9 4.1 0.0
assign ( resid 14 and name HG2# )( resid 17 and name HB# ) 6.9 5.1 0.0
assign ( resid 15 and name HN )( resid 15 and name HB# ) 3.7 1.9 0.0
assign ( resid 15 and name HA )( resid 18 and name HB# ) 5.9 4.1 0.0
assign ( resid 15 and name HB# )( resid 16 and name HN ) 4.2 2.4 0.0
assign ( resid 16 and name HN )( resid 17 and name HN ) 5.0 3.2 0.0
assign ( resid 16 and name HA )( resid 16 and name HB# ) 2.6 0.8 0.0
assign ( resid 16 and name HA )( resid 18 and name HN ) 5.0 3.2 0.0
assign ( resid 16 and name HA )( resid 19 and name HB# ) 4.3 2.5 0.0
assign ( resid 16 and name HB# )( resid 17 and name HN ) 4.2 2.4 0.0
assign ( resid 17 and name HN )( resid 17 and name HB2 ) 3.3 1.5 0.0
assign ( resid 17 and name HN )( resid 17 and name HB1 ) 3.3 1.5 0.0
assign ( resid 17 and name HN )( resid 17 and name HB# ) 2.8 1.0 0.0
assign ( resid 17 and name HN )( resid 17 and name HG ) 5.0 3.2 0.0
assign ( resid 17 and name HN )( resid 17 and name HD2# ) 5.0 3.2 0.0
assign ( resid 17 and name HN )( resid 18 and name HN ) 3.3 1.5 0.0
assign ( resid 17 and name HA )( resid 17 and name HB2 ) 3.3 1.5 0.0
assign ( resid 17 and name HA )( resid 17 and name HB1 ) 3.3 1.5 0.0
assign ( resid 17 and name HA )( resid 17 and name HB# ) 3.3 1.5 0.0
assign ( resid 17 and name HA )( resid 17 and name HD1# ) 4.3 2.5 0.0
assign ( resid 17 and name HA )( resid 17 and name HD2# ) 3.5 1.7 0.0
assign ( resid 17 and name HA )( resid 20 and name HB ) 2.5 0.7 0.0
assign ( resid 17 and name HA )( resid 20 and name HD1# ) 3.5 1.7 0.0
assign ( resid 17 and name HA )( resid 21 and name HN ) 5.0 3.2 0.0
assign ( resid 17 and name HA )( resid 106 and name HG1# ) 5.0 3.2 0.0
assign ( resid 17 and name HB2 )( resid 18 and name HN ) 5.0 3.2 0.0
assign ( resid 17 and name HB1 )( resid 18 and name HN ) 5.0 3.2 0.0
assign ( resid 17 and name HB# )( resid 18 and name HN ) 4.1 2.3 0.0
assign ( resid 17 and name HG )( resid 18 and name HN ) 5.0 3.2 0.0
assign ( resid 17 and name HG )( resid 106 and name HG2# ) 4.3 2.5 0.0
assign ( resid 17 and name HD1# )( resid 21 and name HD1# ) 7.1 5.3 0.0
assign ( resid 17 and name HD2# )( resid 20 and name HB ) 4.3 2.5 0.0
assign ( resid 17 and name HD2# )( resid 20 and name HG2# ) 7.1 5.3 0.0
assign ( resid 17 and name HD2# )( resid 20 and name HD1# ) 4.6 2.8 0.0
assign ( resid 17 and name HD2# )( resid 21 and name HD1# ) 4.6 2.8 0.0
assign ( resid 17 and name HD2# )( resid 106 and name HG2# ) 4.6 2.8 0.0
assign ( resid 17 and name HD2# )( resid 109 and name HD# ) 5.0 3.2 0.0
assign ( resid 17 and name HD2# )( resid 109 and name HE# ) 5.0 3.2 0.0
assign ( resid 18 and name HN )( resid 18 and name HA ) 2.9 1.1 0.0
assign ( resid 18 and name HN )( resid 18 and name HB# ) 3.7 1.9 0.0
assign ( resid 18 and name HN )( resid 19 and name HN ) 3.3 1.5 0.0
assign ( resid 18 and name HN )( resid 21 and name HD1# ) 6.0 4.2 0.0
assign ( resid 18 and name HA )( resid 21 and name HB2 ) 5.0 3.2 0.0
assign ( resid 18 and name HA )( resid 21 and name HB1 ) 5.0 3.2 0.0
assign ( resid 18 and name HA )( resid 21 and name HD1# ) 4.3 2.5 0.0
assign ( resid 18 and name HB# )( resid 19 and name HN ) 4.2 2.4 0.0
assign ( resid 18 and name O )( resid 22 and name N ) 3.3 1.5 0.0
assign ( resid 18 and name O )( resid 22 and name HN ) 2.3 0.5 0.0
assign ( resid 19 and name HN )( resid 19 and name HB# ) 3.3 1.5 0.0
assign ( resid 19 and name HN )( resid 20 and name HN ) 3.3 1.5 0.0
assign ( resid 19 and name HN )( resid 20 and name HB ) 5.0 3.2 0.0
assign ( resid 19 and name HA )( resid 22 and name HB# ) 3.4 1.6 0.0
assign ( resid 19 and name HB# )( resid 20 and name HN ) 3.3 1.5 0.0
assign ( resid 20 and name HN )( resid 20 and name HB ) 2.9 1.1 0.0
assign ( resid 20 and name HN )( resid 20 and name HG12 ) 5.0 3.2 0.0
assign ( resid 20 and name HN )( resid 20 and name HG11 ) 5.0 3.2 0.0
assign ( resid 20 and name HN )( resid 20 and name HG1# ) 4.1 2.3 0.0
assign ( resid 20 and name HN )( resid 20 and name HD1# ) 5.0 3.2 0.0
assign ( resid 20 and name HN )( resid 21 and name HN ) 3.3 1.5 0.0
assign ( resid 20 and name HA )( resid 20 and name HG12 ) 3.3 1.5 0.0
assign ( resid 20 and name HA )( resid 20 and name HG11 ) 3.3 1.5 0.0
assign ( resid 20 and name HA )( resid 23 and name HN ) 3.3 1.5 0.0
assign ( resid 20 and name HA )( resid 23 and name HB# ) 3.4 1.6 0.0
assign ( resid 20 and name HB )( resid 20 and name HG1# ) 2.6 0.8 0.0
assign ( resid 20 and name HB )( resid 21 and name HN ) 5.0 3.2 0.0
assign ( resid 20 and name HG2# )( resid 21 and name HN ) 3.3 1.5 0.0
assign ( resid 20 and name HG2# )( resid 24 and name HN ) 5.0 3.2 0.0
assign ( resid 20 and name HG2# )( resid 107 and name HA ) 5.0 3.2 0.0
assign ( resid 20 and name HD1# )( resid 106 and name HA ) 6.0 4.2 0.0
assign ( resid 20 and name HD1# )( resid 106 and name HB ) 6.0 4.2 0.0
assign ( resid 20 and name O )( resid 24 and name N ) 3.3 1.5 0.0
assign ( resid 20 and name O )( resid 24 and name HN ) 2.3 0.5 0.0
assign ( resid 21 and name HN )( resid 21 and name HB2 ) 5.0 3.2 0.0
assign ( resid 21 and name HN )( resid 21 and name HB1 ) 5.0 3.2 0.0
assign ( resid 21 and name HN )( resid 21 and name HD1# ) 3.3 1.5 0.0
assign ( resid 21 and name HN )( resid 21 and name HD2# ) 5.0 3.2 0.0
assign ( resid 21 and name HN )( resid 23 and name HN ) 5.0 3.2 0.0
assign ( resid 21 and name HA )( resid 21 and name HD1# ) 6.0 4.2 0.0
assign ( resid 21 and name HA )( resid 21 and name HD2# ) 3.5 1.7 0.0
assign ( resid 21 and name HA )( resid 24 and name HB# ) 3.4 1.6 0.0
assign ( resid 21 and name HA )( resid 26 and name HD# ) 5.0 3.2 0.0
assign ( resid 21 and name HB2 )( resid 28 and name HG2 ) 6.8 5.0 0.0
assign ( resid 21 and name HB2 )( resid 28 and name HG1 ) 6.8 5.0 0.0
assign ( resid 21 and name HB1 )( resid 28 and name HG2 ) 6.8 5.0 0.0
assign ( resid 21 and name HB1 )( resid 28 and name HG1 ) 6.8 5.0 0.0
assign ( resid 21 and name HB# )( resid 22 and name HN ) 5.9 4.1 0.0
assign ( resid 21 and name HB# )( resid 28 and name HG# ) 5.0 3.2 0.0
assign ( resid 21 and name HD1# )( resid 22 and name HN ) 5.0 3.2 0.0
assign ( resid 21 and name HD1# )( resid 28 and name HA ) 6.0 4.2 0.0
assign ( resid 21 and name HD1# )( resid 28 and name HB# ) 4.4 2.6 0.0
assign ( resid 21 and name HD1# )( resid 28 and name HG2 ) 4.3 2.5 0.0
assign ( resid 21 and name HD1# )( resid 28 and name HG1 ) 4.3 2.5 0.0
assign ( resid 21 and name HD2# )( resid 26 and name HB2 ) 6.0 4.2 0.0
assign ( resid 21 and name HD2# )( resid 26 and name HB1 ) 6.0 4.2 0.0
assign ( resid 21 and name HD2# )( resid 26 and name HB# ) 5.2 3.4 0.0
assign ( resid 22 and name HN )( resid 22 and name HB# ) 3.4 1.6 0.0
assign ( resid 22 and name HN )( resid 22 and name HG# ) 4.2 2.4 0.0
assign ( resid 22 and name HN )( resid 23 and name HN ) 3.3 1.5 0.0
assign ( resid 22 and name HA )( resid 22 and name HB# ) 2.6 0.8 0.0
assign ( resid 22 and name HA )( resid 22 and name HG2 ) 3.3 1.5 0.0
assign ( resid 22 and name HA )( resid 22 and name HG1 ) 3.3 1.5 0.0
assign ( resid 22 and name HB# )( resid 23 and name HN ) 3.8 2.0 0.0
assign ( resid 23 and name HN )( resid 23 and name HB# ) 3.4 1.6 0.0
assign ( resid 23 and name HN )( resid 23 and name HG# ) 4.2 2.4 0.0
assign ( resid 23 and name HN )( resid 24 and name HN ) 2.9 1.1 0.0
assign ( resid 23 and name HN )( resid 24 and name HA ) 5.0 3.2 0.0
assign ( resid 23 and name HA )( resid 23 and name HB# ) 2.6 0.8 0.0
assign ( resid 23 and name HA )( resid 23 and name HG# ) 3.4 1.6 0.0
assign ( resid 23 and name HB# )( resid 24 and name HN ) 3.4 1.6 0.0
assign ( resid 23 and name HG# )( resid 24 and name HN ) 3.8 2.0 0.0
assign ( resid 23 and name HG# )( resid 24 and name HA ) 4.2 2.4 0.0
assign ( resid 24 and name HN )( resid 24 and name HB# ) 3.3 1.5 0.0
assign ( resid 24 and name HA )( resid 24 and name HB# ) 2.6 0.8 0.0
assign ( resid 24 and name HB2 )( resid 25 and name HN ) 5.0 3.2 0.0
assign ( resid 24 and name HB2 )( resid 26 and name HE# ) 5.0 3.2 0.0
assign ( resid 24 and name HB1 )( resid 25 and name HN ) 5.0 3.2 0.0
assign ( resid 24 and name HB1 )( resid 26 and name HE# ) 5.0 3.2 0.0
assign ( resid 24 and name HB# )( resid 25 and name HN ) 4.1 2.3 0.0
assign ( resid 24 and name HB# )( resid 26 and name HD# ) 5.9 4.1 0.0
assign ( resid 24 and name HB# )( resid 26 and name HE# ) 4.1 2.3 0.0
assign ( resid 24 and name HB# )( resid 110 and name HD1# ) 6.9 5.1 0.0
assign ( resid 24 and name HG# )( resid 26 and name HD# ) 8.0 6.2 0.0
assign ( resid 24 and name HG# )( resid 26 and name HE# ) 5.9 4.1 0.0
assign ( resid 24 and name HG# )( resid 110 and name HD1# ) 4.4 2.6 0.0
assign ( resid 25 and name HN )( resid 25 and name HA1 ) 2.9 1.1 0.0
assign ( resid 25 and name HN )( resid 25 and name HA1 ) 2.9 1.1 0.0
assign ( resid 25 and name HN )( resid 25 and name HA# ) 2.6 0.8 0.0
assign ( resid 25 and name HN )( resid 26 and name HN ) 2.9 1.1 0.0
assign ( resid 25 and name HN )( resid 26 and name HD# ) 5.0 3.2 0.0
assign ( resid 26 and name HN )( resid 26 and name HB2 ) 5.0 3.2 0.0
assign ( resid 26 and name HN )( resid 26 and name HB1 ) 5.0 3.2 0.0
assign ( resid 26 and name HN )( resid 26 and name HB# ) 5.0 3.2 0.0
assign ( resid 26 and name HN )( resid 27 and name HN ) 5.0 3.2 0.0
assign ( resid 26 and name HB2 )( resid 27 and name HN ) 3.3 1.5 0.0
assign ( resid 26 and name HB1 )( resid 27 and name HN ) 3.3 1.5 0.0
assign ( resid 26 and name HD# )( resid 113 and name HG2# ) 5.0 3.2 0.0
assign ( resid 26 and name HE# )( resid 113 and name HG2# ) 5.0 3.2 0.0
assign ( resid 26 and name HE# )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 27 and name HN )( resid 27 and name HB2 ) 3.3 1.5 0.0
assign ( resid 27 and name HN )( resid 27 and name HB1 ) 3.3 1.5 0.0
assign ( resid 27 and name HN )( resid 27 and name HB# ) 3.7 1.9 0.0
assign ( resid 27 and name HA )( resid 28 and name HD2 ) 2.5 0.7 0.0
assign ( resid 27 and name HA )( resid 28 and name HD1 ) 2.5 0.7 0.0
assign ( resid 27 and name HA )( resid 28 and name HD# ) 3.2 1.4 0.0
assign ( resid 28 and name HA )( resid 29 and name HN ) 2.9 1.1 0.0
assign ( resid 28 and name HA )( resid 29 and name HA ) 5.0 3.2 0.0
assign ( resid 28 and name HB# )( resid 29 and name HN ) 4.0 2.2 0.0
assign ( resid 29 and name HN )( resid 29 and name HB2 ) 3.3 1.5 0.0
assign ( resid 29 and name HN )( resid 29 and name HB1 ) 3.3 1.5 0.0
assign ( resid 29 and name HA )( resid 29 and name HB# ) 2.6 0.8 0.0
assign ( resid 29 and name HA )( resid 30 and name HN ) 2.9 1.1 0.0
assign ( resid 29 and name HA )( resid 30 and name HG2# ) 6.0 4.2 0.0
assign ( resid 29 and name HB2 )( resid 30 and name HN ) 5.0 3.2 0.0
assign ( resid 29 and name HB2 )( resid 46 and name HE# ) 3.3 1.5 0.0
assign ( resid 29 and name HB1 )( resid 30 and name HN ) 5.0 3.2 0.0
assign ( resid 29 and name HB1 )( resid 46 and name HE# ) 3.3 1.5 0.0
assign ( resid 30 and name HN )( resid 30 and name HG2# ) 3.3 1.5 0.0
assign ( resid 30 and name HA )( resid 30 and name HB ) 2.5 0.7 0.0
assign ( resid 30 and name HA )( resid 31 and name HN ) 2.9 1.1 0.0
assign ( resid 30 and name HA )( resid 31 and name HB# ) 6.0 4.2 0.0
assign ( resid 30 and name HB )( resid 31 and name HN ) 3.3 1.5 0.0
assign ( resid 30 and name HB )( resid 31 and name HB# ) 6.5 4.7 0.0
assign ( resid 30 and name HG2# )( resid 31 and name HN ) 5.0 3.2 0.0
assign ( resid 31 and name HN )( resid 31 and name HB# ) 3.3 1.5 0.0
assign ( resid 31 and name HB# )( resid 32 and name HN ) 4.3 2.5 0.0
assign ( resid 31 and name HB# )( resid 36 and name HB# ) 5.2 3.4 0.0
assign ( resid 31 and name HB# )( resid 36 and name HG# ) 5.9 4.1 0.0
assign ( resid 31 and name HB# )( resid 37 and name HA ) 3.5 1.7 0.0
assign ( resid 32 and name HN )( resid 32 and name HB# ) 3.7 1.9 0.0
assign ( resid 32 and name HN )( resid 32 and name HG# ) 4.2 2.4 0.0
assign ( resid 32 and name HN )( resid 33 and name HN ) 5.0 3.2 0.0
assign ( resid 32 and name HA )( resid 32 and name HG2 ) 3.3 1.5 0.0
assign ( resid 32 and name HA )( resid 32 and name HG1 ) 3.3 1.5 0.0
assign ( resid 32 and name HB2 )( resid 33 and name HN ) 5.0 3.2 0.0
assign ( resid 32 and name HB1 )( resid 33 and name HN ) 5.0 3.2 0.0
assign ( resid 32 and name HB# )( resid 32 and name HG# ) 2.5 0.7 0.0
assign ( resid 32 and name HB# )( resid 33 and name HN ) 4.1 2.3 0.0
assign ( resid 32 and name HG# )( resid 33 and name HN ) 5.9 4.1 0.0
assign ( resid 32 and name HG# )( resid 36 and name HB# ) 4.2 2.5 0.0
assign ( resid 33 and name HN )( resid 33 and name HB ) 5.0 3.2 0.0
assign ( resid 33 and name HN )( resid 36 and name HN ) 5.0 3.2 0.0
assign ( resid 33 and name HN )( resid 37 and name HN ) 5.0 3.2 0.0
assign ( resid 33 and name HA )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 33 and name HB )( resid 34 and name HN ) 3.3 1.5 0.0
assign ( resid 33 and name HB )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 33 and name O )( resid 37 and name N ) 3.3 1.5 0.0
assign ( resid 33 and name O )( resid 37 and name HN ) 2.3 0.5 0.0
assign ( resid 34 and name HN )( resid 34 and name HG ) 5.0 3.2 0.0
assign ( resid 34 and name HN )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 34 and name HA )( resid 34 and name HD1# ) 6.0 4.2 0.0
assign ( resid 34 and name HA )( resid 34 and name HD2# ) 3.5 1.7 0.0
assign ( resid 34 and name HA )( resid 37 and name HN ) 3.3 1.5 0.0
assign ( resid 34 and name HA )( resid 37 and name HB# ) 3.5 1.7 0.0
assign ( resid 34 and name HB2 )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 34 and name HB1 )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 34 and name HB# )( resid 35 and name HN ) 5.9 4.1 0.0
assign ( resid 34 and name HB# )( resid 37 and name HN ) 5.9 4.1 0.0
assign ( resid 34 and name HG )( resid 35 and name HN ) 5.0 3.2 0.0
assign ( resid 34 and name HD1# )( resid 58 and name HN ) 5.0 3.2 0.0
assign ( resid 34 and name HD1# )( resid 58 and name HA1 ) 4.3 2.5 0.0
assign ( resid 34 and name HD1# )( resid 58 and name HA1 ) 4.3 2.5 0.0
assign ( resid 34 and name HD1# )( resid 58 and name HA# ) 4.2 2.4 0.0
assign ( resid 34 and name HD1# )( resid 60 and name HA1 ) 4.3 2.5 0.0
assign ( resid 34 and name HD1# )( resid 60 and name HA1 ) 4.3 2.5 0.0
assign ( resid 34 and name HD1# )( resid 63 and name HB# ) 5.2 3.4 0.0
assign ( resid 34 and name HD1# )( resid 63 and name HD# ) 5.0 3.2 0.0
assign ( resid 34 and name HD2# )( resid 37 and name HB# ) 5.4 3.6 0.0
assign ( resid 34 and name HD2# )( resid 51 and name HB# ) 5.2 3.4 0.0
assign ( resid 34 and name HD2# )( resid 51 and name HD1# ) 5.4 3.6 0.0
assign ( resid 34 and name HD2# )( resid 63 and name HB# ) 5.2 3.4 0.0
assign ( resid 34 and name HD2# )( resid 63 and name HD# ) 3.3 1.5 0.0
assign ( resid 34 and name HD2# )( resid 63 and name HE# ) 5.0 3.2 0.0
assign ( resid 35 and name HN )( resid 35 and name HB# ) 3.4 1.6 0.0
assign ( resid 35 and name HN )( resid 36 and name HN ) 3.3 1.5 0.0
assign ( resid 35 and name HA )( resid 35 and name HB2 ) 3.3 1.5 0.0
assign ( resid 35 and name HA )( resid 35 and name HB1 ) 3.3 1.5 0.0
assign ( resid 35 and name HA )( resid 35 and name HB# ) 3.3 1.5 0.0
assign ( resid 35 and name HA )( resid 35 and name HG# ) 3.7 1.9 0.0
assign ( resid 35 and name HA )( resid 35 and name HD2 ) 5.0 3.2 0.0
assign ( resid 35 and name HA )( resid 35 and name HD1 ) 5.0 3.2 0.0
assign ( resid 35 and name HA )( resid 38 and name HB# ) 4.2 2.4 0.0
assign ( resid 35 and name HB# )( resid 36 and name HN ) 4.2 2.4 0.0
assign ( resid 35 and name HG# )( resid 35 and name HD# ) 2.5 0.7 0.0
assign ( resid 35 and name O )( resid 39 and name N ) 3.3 1.5 0.0
assign ( resid 35 and name O )( resid 39 and name HN ) 2.3 0.5 0.0
assign ( resid 36 and name HN )( resid 36 and name HB# ) 3.4 1.6 0.0
assign ( resid 36 and name HN )( resid 36 and name HG# ) 5.9 4.1 0.0
assign ( resid 36 and name HA )( resid 36 and name HG# ) 3.4 1.6 0.0
assign ( resid 36 and name HA )( resid 37 and name HN ) 5.0 3.2 0.0
assign ( resid 36 and name HB# )( resid 37 and name HN ) 3.4 1.6 0.0
assign ( resid 36 and name O )( resid 40 and name N ) 3.3 1.5 0.0
assign ( resid 36 and name O )( resid 40 and name HN ) 2.3 0.5 0.0
assign ( resid 37 and name HN )( resid 37 and name HB# ) 3.3 1.5 0.0
assign ( resid 37 and name HN )( resid 38 and name HN ) 2.9 1.1 0.0
assign ( resid 37 and name HN )( resid 38 and name HB# ) 5.9 4.1 0.0
assign ( resid 37 and name HA )( resid 40 and name HN ) 3.3 1.5 0.0
assign ( resid 37 and name HA )( resid 40 and name HB# ) 3.4 1.6 0.0
assign ( resid 37 and name HB# )( resid 41 and name HD1# ) 4.6 2.8 0.0
assign ( resid 37 and name HB# )( resid 63 and name HE# ) 5.0 3.2 0.0
assign ( resid 37 and name HB# )( resid 63 and name HZ ) 3.3 1.5 0.0
assign ( resid 38 and name HN )( resid 38 and name HG# ) 5.9 4.1 0.0
assign ( resid 38 and name HN )( resid 39 and name HN ) 2.9 1.1 0.0
assign ( resid 38 and name HN )( resid 63 and name HZ ) 5.0 3.2 0.0
assign ( resid 38 and name HA )( resid 38 and name HB# ) 2.6 0.8 0.0
assign ( resid 38 and name HA )( resid 38 and name HG2 ) 3.3 1.5 0.0
assign ( resid 38 and name HA )( resid 38 and name HG1 ) 3.3 1.5 0.0
assign ( resid 38 and name HA )( resid 41 and name HN ) 3.3 1.5 0.0
assign ( resid 38 and name HA )( resid 41 and name HB ) 3.3 1.5 0.0
assign ( resid 38 and name HA )( resid 41 and name HG2# ) 5.0 3.2 0.0
assign ( resid 38 and name HA )( resid 41 and name HD1# ) 4.3 2.5 0.0
assign ( resid 38 and name HA )( resid 63 and name HZ ) 5.0 3.2 0.0
assign ( resid 38 and name HA )( resid 66 and name HE# ) 2.9 1.1 0.0
assign ( resid 38 and name HG2 )( resid 63 and name HE# ) 5.4 3.6 0.0
assign ( resid 38 and name HG2 )( resid 66 and name HE# ) 7.1 5.3 0.0
assign ( resid 38 and name HG2 )( resid 66 and name HZ ) 5.0 3.2 0.0
assign ( resid 38 and name HG1 )( resid 63 and name HE# ) 5.4 3.6 0.0
assign ( resid 38 and name HG1 )( resid 66 and name HE# ) 7.1 5.3 0.0
assign ( resid 38 and name HG1 )( resid 66 and name HZ ) 5.0 3.2 0.0
assign ( resid 38 and name HG# )( resid 39 and name HN ) 5.9 4.1 0.0
assign ( resid 38 and name HG# )( resid 63 and name HE# ) 4.2 2.4 0.0
assign ( resid 38 and name O )( resid 42 and name N ) 3.3 1.5 0.0
assign ( resid 38 and name O )( resid 42 and name HN ) 2.3 0.5 0.0
assign ( resid 39 and name HN )( resid 39 and name HB# ) 3.4 1.6 0.0
assign ( resid 39 and name HN )( resid 39 and name HG2 ) 5.0 3.2 0.0
assign ( resid 39 and name HN )( resid 39 and name HG1 ) 5.0 3.2 0.0
assign ( resid 39 and name HN )( resid 39 and name HG# ) 5.0 3.2 0.0
assign ( resid 39 and name HN )( resid 40 and name HN ) 2.9 1.1 0.0
assign ( resid 39 and name HN )( resid 41 and name HN ) 5.0 3.2 0.0
assign ( resid 39 and name HA )( resid 39 and name HB# ) 2.6 0.8 0.0
assign ( resid 39 and name HA )( resid 39 and name HG2 ) 3.3 1.5 0.0
assign ( resid 39 and name HA )( resid 39 and name HG1 ) 5.0 3.2 0.0
assign ( resid 39 and name HA )( resid 39 and name HG# ) 3.3 1.5 0.0
assign ( resid 39 and name HA )( resid 39 and name HD# ) 4.2 2.4 0.0
assign ( resid 39 and name HA )( resid 42 and name HN ) 5.0 3.2 0.0
assign ( resid 39 and name HA )( resid 42 and name HB# ) 3.4 1.6 0.0
assign ( resid 39 and name HB# )( resid 40 and name HN ) 3.4 1.6 0.0
assign ( resid 39 and name HG# )( resid 39 and name HE# ) 3.5 1.7 0.0
assign ( resid 39 and name HG# )( resid 40 and name HN ) 5.9 4.1 0.0
assign ( resid 39 and name HD# )( resid 40 and name HN ) 3.4 1.6 0.0
assign ( resid 39 and name HD# )( resid 40 and name HA ) 3.4 1.6 0.0
assign ( resid 40 and name HN )( resid 40 and name HG# ) 3.4 1.6 0.0
assign ( resid 40 and name HN )( resid 41 and name HN ) 2.9 1.1 0.0
assign ( resid 40 and name HA )( resid 40 and name HB# ) 2.6 0.8 0.0
assign ( resid 40 and name HA )( resid 40 and name HG# ) 3.7 1.9 0.0
assign ( resid 41 and name HN )( resid 41 and name HB ) 2.9 1.1 0.0
assign ( resid 41 and name HN )( resid 41 and name HG1# ) 3.4 1.6 0.0
assign ( resid 41 and name HN )( resid 41 and name HD1# ) 4.3 2.5 0.0
assign ( resid 41 and name HN )( resid 42 and name HN ) 2.9 1.1 0.0
assign ( resid 41 and name HN )( resid 43 and name HN ) 5.0 3.2 0.0
assign ( resid 41 and name HA )( resid 41 and name HG2# ) 3.3 1.5 0.0
assign ( resid 41 and name HA )( resid 41 and name HG12 ) 3.3 1.5 0.0
assign ( resid 41 and name HA )( resid 41 and name HG11 ) 3.3 1.5 0.0
assign ( resid 41 and name HA )( resid 44 and name HB# ) 5.9 4.1 0.0
assign ( resid 41 and name HB )( resid 42 and name HN ) 5.0 3.2 0.0
assign ( resid 41 and name HB )( resid 43 and name HN ) 5.0 3.2 0.0
assign ( resid 41 and name HG2# )( resid 42 and name HN ) 5.0 3.2 0.0
assign ( resid 41 and name HD1# )( resid 63 and name HZ ) 5.0 3.2 0.0
assign ( resid 42 and name HN )( resid 42 and name HB# ) 3.4 1.6 0.0
assign ( resid 42 and name HN )( resid 42 and name HG# ) 4.2 2.4 0.0
assign ( resid 42 and name HN )( resid 43 and name HN ) 2.9 1.1 0.0
assign ( resid 42 and name HN )( resid 44 and name HN ) 5.0 3.2 0.0
assign ( resid 42 and name HA )( resid 42 and name HB# ) 2.6 0.8 0.0
assign ( resid 42 and name HA )( resid 42 and name HG# ) 3.7 1.9 0.0
assign ( resid 42 and name HG# )( resid 43 and name HN ) 5.9 4.1 0.0
assign ( resid 43 and name HN )( resid 43 and name HA ) 2.9 1.1 0.0
assign ( resid 43 and name HN )( resid 43 and name HB# ) 3.4 1.6 0.0
assign ( resid 43 and name HN )( resid 43 and name HG2 ) 5.0 3.2 0.0
assign ( resid 43 and name HN )( resid 43 and name HG1 ) 5.0 3.2 0.0
assign ( resid 43 and name HN )( resid 43 and name HG# ) 4.1 2.3 0.0
assign ( resid 43 and name HN )( resid 44 and name HN ) 2.9 1.1 0.0
assign ( resid 43 and name HN )( resid 44 and name HD2# ) 6.0 4.2 0.0
assign ( resid 43 and name HA )( resid 43 and name HB# ) 2.6 0.8 0.0
assign ( resid 43 and name HA )( resid 43 and name HG2 ) 3.3 1.5 0.0
assign ( resid 43 and name HA )( resid 43 and name HG1 ) 3.3 1.5 0.0
assign ( resid 43 and name HA )( resid 43 and name HG# ) 2.8 1.0 0.0
assign ( resid 43 and name HB# )( resid 44 and name HN ) 3.4 1.6 0.0
assign ( resid 44 and name HN )( resid 44 and name HB2 ) 5.0 3.2 0.0
assign ( resid 44 and name HN )( resid 44 and name HB1 ) 5.0 3.2 0.0
assign ( resid 44 and name HN )( resid 44 and name HG ) 5.0 3.2 0.0
assign ( resid 44 and name HN )( resid 44 and name HD2# ) 4.3 2.5 0.0
assign ( resid 44 and name HN )( resid 45 and name HN ) 5.0 3.2 0.0
assign ( resid 44 and name HA )( resid 45 and name HN ) 2.9 1.1 0.0
assign ( resid 44 and name HB2 )( resid 45 and name HN ) 5.0 3.2 0.0
assign ( resid 44 and name HB1 )( resid 45 and name HN ) 5.0 3.2 0.0
assign ( resid 44 and name HB# )( resid 45 and name HN ) 4.1 2.3 0.0
assign ( resid 44 and name HB# )( resid 46 and name HE# ) 5.0 3.2 0.0
assign ( resid 44 and name HB# )( resid 46 and name HZ ) 5.0 3.2 0.0
assign ( resid 44 and name HD1# )( resid 45 and name HN ) 4.3 2.5 0.0
assign ( resid 44 and name HD2# )( resid 45 and name HN ) 5.0 3.2 0.0
assign ( resid 44 and name HD# )( resid 46 and name HE# ) 5.0 3.2 0.0
assign ( resid 45 and name HN )( resid 45 and name HB2 ) 2.9 1.1 0.0
assign ( resid 45 and name HN )( resid 45 and name HB1 ) 2.9 1.1 0.0
assign ( resid 45 and name HN )( resid 46 and name HN ) 5.0 3.2 0.0
assign ( resid 45 and name HA )( resid 45 and name HD# ) 3.3 1.5 0.0
assign ( resid 45 and name HA )( resid 46 and name HN ) 2.9 1.1 0.0
assign ( resid 45 and name HZ )( resid 73 and name HB2 ) 3.3 1.5 0.0
assign ( resid 45 and name HZ )( resid 73 and name HB1 ) 3.3 1.5 0.0
assign ( resid 46 and name HN )( resid 46 and name HB# ) 3.7 1.9 0.0
assign ( resid 46 and name HN )( resid 46 and name HD# ) 3.3 1.5 0.0
assign ( resid 46 and name HA )( resid 47 and name HD# ) 3.2 1.4 0.0
assign ( resid 46 and name HB2 )( resid 49 and name HG12 ) 6.8 5.0 0.0
assign ( resid 46 and name HB2 )( resid 49 and name HG11 ) 6.8 5.0 0.0
assign ( resid 46 and name HB2 )( resid 49 and name HD1# ) 6.0 4.2 0.0
assign ( resid 46 and name HB1 )( resid 49 and name HG12 ) 6.8 5.0 0.0
assign ( resid 46 and name HB1 )( resid 49 and name HG11 ) 6.8 5.0 0.0
assign ( resid 46 and name HB1 )( resid 49 and name HD1# ) 6.0 4.2 0.0
assign ( resid 46 and name HB# )( resid 48 and name HN ) 5.9 4.1 0.0
assign ( resid 46 and name HB# )( resid 49 and name HG1# ) 5.0 3.2 0.0
assign ( resid 46 and name HB# )( resid 49 and name HD1# ) 5.2 3.4 0.0
assign ( resid 46 and name HD# )( resid 49 and name HD1# ) 8.2 6.4 0.0
assign ( resid 47 and name HA )( resid 74 and name HA ) 3.3 1.5 0.0
assign ( resid 47 and name HA )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 47 and name HB2 )( resid 48 and name HG2# ) 5.0 3.2 0.0
assign ( resid 47 and name HB1 )( resid 48 and name HG2# ) 5.0 3.2 0.0
assign ( resid 47 and name HB# )( resid 48 and name HN ) 5.0 3.2 0.0
assign ( resid 47 and name HB# )( resid 48 and name HG2# ) 4.1 2.3 0.0
assign ( resid 47 and name HB# )( resid 117 and name HE# ) 5.9 4.1 0.0
assign ( resid 47 and name HB# )( resid 117 and name HZ ) 5.0 3.2 0.0
assign ( resid 47 and name HG2 )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 47 and name HG1 )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 47 and name HG# )( resid 48 and name HN ) 5.4 3.6 0.0
assign ( resid 47 and name HG# )( resid 117 and name HE# ) 4.1 2.3 0.0
assign ( resid 47 and name HG# )( resid 117 and name HZ ) 5.9 4.1 0.0
assign ( resid 47 and name HD# )( resid 48 and name HN ) 4.2 2.4 0.0
assign ( resid 47 and name HD# )( resid 48 and name HA ) 5.9 4.1 0.0
assign ( resid 47 and name HD# )( resid 117 and name HE# ) 5.9 4.1 0.0
assign ( resid 47 and name O )( resid 75 and name N ) 3.3 1.5 0.0
assign ( resid 47 and name O )( resid 75 and name HN ) 2.3 0.5 0.0
assign ( resid 48 and name HN )( resid 48 and name HB ) 3.3 1.5 0.0
assign ( resid 48 and name HN )( resid 48 and name HG1# ) 5.0 3.2 0.0
assign ( resid 48 and name HN )( resid 48 and name HG2# ) 3.3 1.5 0.0
assign ( resid 48 and name HN )( resid 49 and name HN ) 5.0 3.2 0.0
assign ( resid 48 and name HN )( resid 49 and name HG1# ) 5.9 4.1 0.0
assign ( resid 48 and name HN )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 48 and name HN )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 48 and name HA )( resid 49 and name HN ) 2.9 1.1 0.0
assign ( resid 48 and name HA )( resid 75 and name HN ) 3.3 1.5 0.0
assign ( resid 48 and name HA )( resid 75 and name HB ) 3.3 1.5 0.0
assign ( resid 48 and name HA )( resid 75 and name HG2# ) 4.3 2.5 0.0
assign ( resid 48 and name HG1# )( resid 49 and name HN ) 4.3 2.5 0.0
assign ( resid 48 and name HG1# )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 48 and name HG1# )( resid 75 and name HB ) 4.3 2.5 0.0
assign ( resid 48 and name HG1# )( resid 113 and name HD1# ) 7.1 5.3 0.0
assign ( resid 48 and name HG2# )( resid 49 and name HN ) 5.0 3.2 0.0
assign ( resid 48 and name HG2# )( resid 50 and name HG2# ) 7.1 5.3 0.0
assign ( resid 48 and name HG2# )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 48 and name HG2# )( resid 75 and name HB ) 3.5 1.7 0.0
assign ( resid 48 and name HG2# )( resid 75 and name HG2# ) 4.6 2.8 0.0
assign ( resid 48 and name HG2# )( resid 113 and name HG2# ) 7.1 5.3 0.0
assign ( resid 48 and name HG2# )( resid 116 and name HB# ) 4.6 2.8 0.0
assign ( resid 48 and name HG2# )( resid 117 and name HD# ) 5.0 3.2 0.0
assign ( resid 48 and name HG2# )( resid 117 and name HE# ) 3.3 1.5 0.0
assign ( resid 48 and name HG2# )( resid 117 and name HZ ) 5.0 3.2 0.0
assign ( resid 49 and name N )( resid 75 and name O ) 3.3 1.5 0.0
assign ( resid 49 and name HN )( resid 49 and name HB ) 3.3 1.5 0.0
assign ( resid 49 and name HN )( resid 49 and name HG1# ) 4.2 2.4 0.0
assign ( resid 49 and name HN )( resid 75 and name HN ) 3.3 1.5 0.0
assign ( resid 49 and name HN )( resid 75 and name HB ) 5.0 3.2 0.0
assign ( resid 49 and name HN )( resid 75 and name O ) 2.3 0.5 0.0
assign ( resid 49 and name HN )( resid 76 and name HA ) 3.3 1.5 0.0
assign ( resid 49 and name HN )( resid 77 and name HN ) 5.0 3.2 0.0
assign ( resid 49 and name HA )( resid 49 and name HD1# ) 4.3 2.5 0.0
assign ( resid 49 and name HA )( resid 50 and name HN ) 2.9 1.1 0.0
assign ( resid 49 and name HB )( resid 50 and name HN ) 5.0 3.2 0.0
assign ( resid 49 and name HB )( resid 76 and name HA ) 3.3 1.5 0.0
assign ( resid 49 and name HG1# )( resid 50 and name HN ) 5.9 4.1 0.0
assign ( resid 49 and name HG1# )( resid 76 and name HG2# ) 5.2 3.4 0.0
assign ( resid 49 and name HD1# )( resid 74 and name HB# ) 6.9 5.1 0.0
assign ( resid 49 and name O )( resid 77 and name N ) 3.3 1.5 0.0
assign ( resid 49 and name O )( resid 77 and name HN ) 2.3 0.5 0.0
assign ( resid 50 and name HN )( resid 50 and name HB ) 3.3 1.5 0.0
assign ( resid 50 and name HA )( resid 51 and name HN ) 2.9 1.1 0.0
assign ( resid 50 and name HA )( resid 77 and name HN ) 5.0 3.2 0.0
assign ( resid 50 and name HA )( resid 79 and name HG1# ) 5.9 4.1 0.0
assign ( resid 50 and name HA )( resid 79 and name HD1# ) 6.0 4.2 0.0
assign ( resid 50 and name HG2# )( resid 51 and name HN ) 5.0 3.2 0.0
assign ( resid 50 and name HG2# )( resid 77 and name HB ) 3.5 1.7 0.0
assign ( resid 51 and name HN )( resid 51 and name HB# ) 3.7 1.9 0.0
assign ( resid 51 and name HN )( resid 52 and name HN ) 5.0 3.2 0.0
assign ( resid 51 and name HN )( resid 77 and name HN ) 5.0 3.2 0.0
assign ( resid 51 and name HN )( resid 78 and name HA ) 3.3 1.5 0.0
assign ( resid 51 and name HN )( resid 78 and name HG# ) 5.9 4.1 0.0
assign ( resid 51 and name HN )( resid 79 and name HN ) 5.0 3.2 0.0
assign ( resid 51 and name HA )( resid 51 and name HD1# ) 4.3 2.5 0.0
assign ( resid 51 and name HA )( resid 52 and name HN ) 2.9 1.1 0.0
assign ( resid 51 and name HB2 )( resid 78 and name HG1# ) 6.1 4.3 0.0
assign ( resid 51 and name HB2 )( resid 78 and name HG2# ) 6.1 4.3 0.0
assign ( resid 51 and name HB1 )( resid 78 and name HG1# ) 6.1 4.3 0.0
assign ( resid 51 and name HB1 )( resid 78 and name HG2# ) 6.1 4.3 0.0
assign ( resid 51 and name HB# )( resid 52 and name HN ) 5.9 4.1 0.0
assign ( resid 51 and name HB# )( resid 52 and name HA ) 5.9 4.1 0.0
assign ( resid 51 and name HB# )( resid 78 and name HG# ) 5.0 3.2 0.0
assign ( resid 51 and name HB# )( resid 79 and name HN ) 5.9 4.1 0.0
assign ( resid 51 and name HG )( resid 53 and name HG# ) 5.1 3.3 0.0
assign ( resid 51 and name HD1# )( resid 52 and name HN ) 4.3 2.5 0.0
assign ( resid 51 and name HD1# )( resid 52 and name HA ) 6.0 4.2 0.0
assign ( resid 51 and name HD2# )( resid 53 and name HB ) 6.0 4.2 0.0
assign ( resid 52 and name HN )( resid 52 and name HB2 ) 3.3 1.5 0.0
assign ( resid 52 and name HN )( resid 52 and name HB1 ) 3.3 1.5 0.0
assign ( resid 52 and name HN )( resid 78 and name HA ) 5.0 3.2 0.0
assign ( resid 52 and name HA )( resid 79 and name HN ) 5.0 3.2 0.0
assign ( resid 52 and name HA )( resid 80 and name HG2# ) 4.3 2.5 0.0
assign ( resid 53 and name HA )( resid 56 and name HG# ) 3.4 1.6 0.0
assign ( resid 53 and name HB )( resid 87 and name HG2# ) 6.0 4.2 0.0
assign ( resid 53 and name HG1# )( resid 80 and name HB ) 4.3 2.5 0.0
assign ( resid 53 and name HG2# )( resid 80 and name HB ) 4.3 2.5 0.0
assign ( resid 53 and name HG# )( resid 87 and name HG2# ) 6.1 4.3 0.0
assign ( resid 54 and name HA )( resid 55 and name HN ) 5.0 3.2 0.0
assign ( resid 54 and name HA )( resid 56 and name HD# ) 5.9 4.1 0.0
assign ( resid 54 and name HB# )( resid 55 and name HN ) 5.9 4.1 0.0
assign ( resid 54 and name HE3 )( resid 55 and name HN ) 5.0 3.2 0.0
assign ( resid 54 and name HE1 )( resid 55 and name HN ) 5.0 3.2 0.0
assign ( resid 56 and name HB2 )( resid 57 and name HN ) 5.0 3.2 0.0
assign ( resid 56 and name HB1 )( resid 57 and name HN ) 5.0 3.2 0.0
assign ( resid 56 and name HB# )( resid 57 and name HN ) 4.0 2.2 0.0
assign ( resid 56 and name HG# )( resid 57 and name HN ) 4.2 2.4 0.0
assign ( resid 56 and name HD# )( resid 57 and name HN ) 5.3 3.5 0.0
assign ( resid 57 and name HN )( resid 58 and name HN ) 2.9 1.1 0.0
assign ( resid 57 and name HN )( resid 58 and name HA# ) 5.9 4.1 0.0
assign ( resid 57 and name HA )( resid 57 and name HB# ) 2.6 0.8 0.0
assign ( resid 59 and name HA )( resid 60 and name HN ) 2.9 1.1 0.0
assign ( resid 59 and name HA )( resid 60 and name HA# ) 5.9 4.1 0.0
assign ( resid 60 and name HN )( resid 61 and name HN ) 5.0 3.2 0.0
assign ( resid 60 and name HA1 )( resid 63 and name HB2 ) 5.0 3.2 0.0
assign ( resid 60 and name HA1 )( resid 63 and name HB1 ) 5.0 3.2 0.0
assign ( resid 60 and name HA1 )( resid 63 and name HB2 ) 5.0 3.2 0.0
assign ( resid 60 and name HA1 )( resid 63 and name HB1 ) 5.0 3.2 0.0
assign ( resid 60 and name HA# )( resid 61 and name HN ) 3.2 1.4 0.0
assign ( resid 60 and name HA# )( resid 63 and name HN ) 5.9 4.1 0.0
assign ( resid 60 and name HA# )( resid 63 and name HB# ) 4.1 2.3 0.0
assign ( resid 61 and name HN )( resid 61 and name HB ) 2.9 1.1 0.0
assign ( resid 61 and name HN )( resid 61 and name HG1# ) 4.3 2.5 0.0
assign ( resid 61 and name HN )( resid 61 and name HG2# ) 2.9 1.1 0.0
assign ( resid 61 and name HN )( resid 62 and name HN ) 2.9 1.1 0.0
assign ( resid 61 and name HN )( resid 63 and name HN ) 5.0 3.2 0.0
assign ( resid 61 and name HA )( resid 64 and name HN ) 5.0 3.2 0.0
assign ( resid 61 and name HA )( resid 64 and name HG1# ) 5.9 4.1 0.0
assign ( resid 61 and name HA )( resid 64 and name HD1# ) 3.5 1.7 0.0
assign ( resid 61 and name HB )( resid 62 and name HN ) 3.3 1.5 0.0
assign ( resid 61 and name HG1# )( resid 62 and name HN ) 4.3 2.5 0.0
assign ( resid 61 and name HG1# )( resid 63 and name HN ) 6.0 4.2 0.0
assign ( resid 61 and name HG1# )( resid 90 and name HB# ) 5.2 3.4 0.0
assign ( resid 61 and name HG1# )( resid 90 and name HD# ) 4.4 2.6 0.0
assign ( resid 61 and name HG1# )( resid 91 and name HA ) 4.3 2.5 0.0
assign ( resid 61 and name HG2# )( resid 62 and name HN ) 6.0 4.2 0.0
assign ( resid 61 and name HG2# )( resid 90 and name HG# ) 3.4 1.6 0.0
assign ( resid 62 and name HN )( resid 62 and name HB2 ) 3.3 1.5 0.0
assign ( resid 62 and name HN )( resid 62 and name HB1 ) 3.3 1.5 0.0
assign ( resid 62 and name HN )( resid 62 and name HB# ) 2.9 1.1 0.0
assign ( resid 62 and name HN )( resid 62 and name HD2# ) 4.2 2.4 0.0
assign ( resid 62 and name HN )( resid 63 and name HN ) 3.3 1.5 0.0
assign ( resid 62 and name HB2 )( resid 63 and name HN ) 5.0 3.2 0.0
assign ( resid 62 and name HB1 )( resid 63 and name HN ) 5.0 3.2 0.0
assign ( resid 63 and name HN )( resid 63 and name HA ) 2.9 1.1 0.0
assign ( resid 63 and name HN )( resid 63 and name HB# ) 3.3 1.5 0.0
assign ( resid 63 and name HA )( resid 66 and name HN ) 5.0 3.2 0.0
assign ( resid 63 and name HA )( resid 66 and name HB2 ) 5.0 3.2 0.0
assign ( resid 63 and name HA )( resid 66 and name HB1 ) 5.0 3.2 0.0
assign ( resid 63 and name HA )( resid 66 and name HB# ) 4.1 2.3 0.0
assign ( resid 63 and name HB# )( resid 64 and name HN ) 4.2 2.4 0.0
assign ( resid 63 and name HD# )( resid 67 and name HD1# ) 3.3 1.5 0.0
assign ( resid 63 and name HE# )( resid 67 and name HD1# ) 3.3 1.5 0.0
assign ( resid 63 and name HZ )( resid 66 and name HD# ) 5.0 3.2 0.0
assign ( resid 63 and name O )( resid 67 and name N ) 3.3 1.5 0.0
assign ( resid 63 and name O )( resid 67 and name HN ) 2.3 0.5 0.0
assign ( resid 64 and name HN )( resid 64 and name HB ) 3.3 1.5 0.0
assign ( resid 64 and name HN )( resid 64 and name HG1# ) 3.4 1.6 0.0
assign ( resid 64 and name HN )( resid 64 and name HD1# ) 3.3 1.5 0.0
assign ( resid 64 and name HN )( resid 65 and name HN ) 2.9 1.1 0.0
assign ( resid 64 and name HA )( resid 67 and name HB ) 3.3 1.5 0.0
assign ( resid 64 and name HA )( resid 67 and name HD1# ) 4.3 2.5 0.0
assign ( resid 64 and name HB )( resid 65 and name HN ) 3.3 1.5 0.0
assign ( resid 64 and name HG2# )( resid 65 and name HN ) 6.0 4.2 0.0
assign ( resid 64 and name HG2# )( resid 94 and name HA ) 6.0 4.2 0.0
assign ( resid 64 and name HG2# )( resid 94 and name HB# ) 4.4 2.6 0.0
assign ( resid 64 and name HG2# )( resid 95 and name HA# ) 6.9 5.1 0.0
assign ( resid 65 and name HN )( resid 65 and name HA ) 3.3 1.5 0.0
assign ( resid 65 and name HN )( resid 65 and name HB2 ) 3.3 1.5 0.0
assign ( resid 65 and name HN )( resid 65 and name HB1 ) 3.3 1.5 0.0
assign ( resid 65 and name HN )( resid 65 and name HB# ) 2.9 1.1 0.0
assign ( resid 65 and name HN )( resid 66 and name HN ) 3.3 1.5 0.0
assign ( resid 65 and name HA )( resid 68 and name HN ) 3.3 1.5 0.0
assign ( resid 65 and name HA )( resid 68 and name HB2 ) 5.0 3.2 0.0
assign ( resid 65 and name HA )( resid 68 and name HB1 ) 5.0 3.2 0.0
assign ( resid 65 and name HA )( resid 68 and name HB# ) 4.1 2.3 0.0
assign ( resid 65 and name HB# )( resid 66 and name HN ) 4.2 2.4 0.0
assign ( resid 65 and name O )( resid 69 and name N ) 3.3 1.5 0.0
assign ( resid 65 and name O )( resid 69 and name HN ) 2.3 0.5 0.0
assign ( resid 66 and name HN )( resid 66 and name HB2 ) 3.3 1.5 0.0
assign ( resid 66 and name HN )( resid 66 and name HB1 ) 3.3 1.5 0.0
assign ( resid 66 and name HN )( resid 66 and name HB# ) 2.9 1.1 0.0
assign ( resid 66 and name HN )( resid 67 and name HN ) 2.9 1.1 0.0
assign ( resid 66 and name HN )( resid 68 and name HN ) 5.0 3.2 0.0
assign ( resid 66 and name HN )( resid 70 and name HD2# ) 5.9 4.1 0.0
assign ( resid 66 and name HA )( resid 66 and name HB2 ) 2.9 1.1 0.0
assign ( resid 66 and name HA )( resid 66 and name HB1 ) 3.3 1.5 0.0
assign ( resid 66 and name HA )( resid 66 and name HB# ) 2.6 0.8 0.0
assign ( resid 66 and name HA )( resid 66 and name HD# ) 3.3 1.5 0.0
assign ( resid 66 and name HA )( resid 69 and name HB2 ) 2.5 0.7 0.0
assign ( resid 66 and name HA )( resid 69 and name HB1 ) 2.5 0.7 0.0
assign ( resid 66 and name HB# )( resid 67 and name HN ) 4.2 2.4 0.0
assign ( resid 66 and name HB# )( resid 68 and name HN ) 5.9 4.1 0.0
assign ( resid 66 and name O )( resid 70 and name N ) 3.3 1.5 0.0
assign ( resid 66 and name O )( resid 70 and name HN ) 2.3 0.5 0.0
assign ( resid 67 and name HN )( resid 67 and name HB ) 3.3 1.5 0.0
assign ( resid 67 and name HN )( resid 67 and name HG1# ) 4.2 2.4 0.0
assign ( resid 67 and name HN )( resid 67 and name HD1# ) 3.3 1.5 0.0
assign ( resid 67 and name HN )( resid 68 and name HN ) 3.3 1.5 0.0
assign ( resid 67 and name HN )( resid 70 and name HD2# ) 5.9 4.1 0.0
assign ( resid 67 and name HA )( resid 70 and name HB# ) 5.9 4.1 0.0
assign ( resid 67 and name HA )( resid 71 and name HN ) 5.0 3.2 0.0
assign ( resid 67 and name HB )( resid 68 and name HN ) 3.3 1.5 0.0
assign ( resid 67 and name HG2# )( resid 68 and name HN ) 4.3 2.5 0.0
assign ( resid 67 and name HG2# )( resid 68 and name HA ) 5.0 3.2 0.0
assign ( resid 67 and name HG2# )( resid 71 and name HN ) 6.0 4.2 0.0
assign ( resid 67 and name HG2# )( resid 71 and name HB2 ) 4.3 2.5 0.0
assign ( resid 67 and name HG2# )( resid 71 and name HB1 ) 4.3 2.5 0.0
assign ( resid 67 and name HG1# )( resid 68 and name HN ) 5.9 4.1 0.0
assign ( resid 67 and name O )( resid 71 and name N ) 3.3 1.5 0.0
assign ( resid 67 and name O )( resid 71 and name HN ) 2.3 0.5 0.0
assign ( resid 68 and name HN )( resid 68 and name HB# ) 3.4 1.6 0.0
assign ( resid 68 and name HN )( resid 68 and name HG2 ) 3.3 1.5 0.0
assign ( resid 68 and name HN )( resid 68 and name HG1 ) 3.3 1.5 0.0
assign ( resid 68 and name HN )( resid 68 and name HG# ) 2.8 1.0 0.0
assign ( resid 68 and name HN )( resid 68 and name HD# ) 5.9 4.1 0.0
assign ( resid 68 and name HN )( resid 69 and name HN ) 3.3 1.5 0.0
assign ( resid 68 and name HA )( resid 68 and name HG# ) 3.7 1.9 0.0
assign ( resid 68 and name HA )( resid 68 and name HD# ) 4.2 2.4 0.0
assign ( resid 68 and name HA )( resid 71 and name HB# ) 4.2 2.4 0.0
assign ( resid 68 and name HA )( resid 72 and name HA ) 2.5 0.7 0.0
assign ( resid 68 and name HA )( resid 72 and name HB# ) 5.9 4.1 0.0
assign ( resid 68 and name HB# )( resid 69 and name HN ) 5.9 4.1 0.0
assign ( resid 68 and name HG2 )( resid 95 and name HA1 ) 6.8 5.0 0.0
assign ( resid 68 and name HG2 )( resid 95 and name HA1 ) 6.8 5.0 0.0
assign ( resid 68 and name HG1 )( resid 95 and name HA1 ) 6.8 5.0 0.0
assign ( resid 68 and name HG1 )( resid 95 and name HA1 ) 6.8 5.0 0.0
assign ( resid 68 and name HG# )( resid 69 and name HN ) 5.9 4.1 0.0
assign ( resid 68 and name HG# )( resid 95 and name HA# ) 5.8 4.0 0.0
assign ( resid 69 and name HN )( resid 69 and name HB2 ) 2.9 1.1 0.0
assign ( resid 69 and name HN )( resid 69 and name HB1 ) 2.9 1.1 0.0
assign ( resid 69 and name HN )( resid 70 and name HN ) 2.9 1.1 0.0
assign ( resid 69 and name HA )( resid 69 and name HB# ) 2.6 0.8 0.0
assign ( resid 69 and name HA )( resid 69 and name HG2 ) 3.3 1.5 0.0
assign ( resid 69 and name HA )( resid 69 and name HG1 ) 3.3 1.5 0.0
assign ( resid 69 and name HA )( resid 70 and name HN ) 5.0 3.2 0.0
assign ( resid 69 and name HA )( resid 70 and name HD21 ) 5.0 3.2 0.0
assign ( resid 69 and name HA )( resid 70 and name HD22 ) 5.0 3.2 0.0
assign ( resid 69 and name HB# )( resid 70 and name HN ) 4.2 2.4 0.0
assign ( resid 69 and name HB# )( resid 70 and name HD2# ) 6.7 4.9 0.0
assign ( resid 70 and name HN )( resid 70 and name HB# ) 3.7 1.9 0.0
assign ( resid 70 and name HN )( resid 70 and name HD21 ) 3.3 1.5 0.0
assign ( resid 70 and name HN )( resid 70 and name HD22 ) 3.3 1.5 0.0
assign ( resid 70 and name HN )( resid 70 and name HD2# ) 4.2 2.4 0.0
assign ( resid 70 and name HN )( resid 71 and name HN ) 2.9 1.1 0.0
assign ( resid 70 and name HN )( resid 72 and name HD# ) 5.9 4.1 0.0
assign ( resid 70 and name HA )( resid 70 and name HB# ) 2.7 0.9 0.0
assign ( resid 70 and name HA )( resid 71 and name HB# ) 5.9 4.1 0.0
assign ( resid 70 and name HB2 )( resid 71 and name HN ) 5.0 3.2 0.0
assign ( resid 70 and name HB1 )( resid 71 and name HN ) 5.0 3.2 0.0
assign ( resid 70 and name HB# )( resid 71 and name HN ) 5.0 3.2 0.0
assign ( resid 71 and name HN )( resid 71 and name HB# ) 3.7 1.9 0.0
assign ( resid 71 and name HN )( resid 72 and name HG# ) 4.2 2.4 0.0
assign ( resid 71 and name HN )( resid 72 and name HD2 ) 5.0 3.2 0.0
assign ( resid 71 and name HN )( resid 72 and name HD1 ) 5.0 3.2 0.0
assign ( resid 71 and name HN )( resid 72 and name HD# ) 4.1 2.3 0.0
assign ( resid 71 and name HA )( resid 72 and name HD2 ) 3.3 1.5 0.0
assign ( resid 71 and name HA )( resid 72 and name HD1 ) 3.3 1.5 0.0
assign ( resid 72 and name HA )( resid 73 and name HN ) 3.3 1.5 0.0
assign ( resid 72 and name HG2 )( resid 73 and name HN ) 5.0 3.2 0.0
assign ( resid 72 and name HG1 )( resid 73 and name HN ) 5.0 3.2 0.0
assign ( resid 72 and name HG# )( resid 73 and name HN ) 4.2 2.4 0.0
assign ( resid 72 and name HD# )( resid 73 and name HN ) 4.2 2.4 0.0
assign ( resid 73 and name HN )( resid 73 and name HB2 ) 3.3 1.5 0.0
assign ( resid 73 and name HN )( resid 73 and name HB1 ) 3.3 1.5 0.0
assign ( resid 73 and name HN )( resid 73 and name HB# ) 2.9 1.1 0.0
assign ( resid 73 and name HN )( resid 74 and name HN ) 2.9 1.1 0.0
assign ( resid 73 and name HA )( resid 73 and name HB# ) 2.6 0.8 0.0
assign ( resid 73 and name HA )( resid 74 and name HN ) 3.3 1.5 0.0
assign ( resid 74 and name HN )( resid 74 and name HB2 ) 3.3 1.5 0.0
assign ( resid 74 and name HN )( resid 74 and name HB1 ) 3.3 1.5 0.0
assign ( resid 74 and name HN )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 74 and name HA )( resid 74 and name HB# ) 2.6 0.8 0.0
assign ( resid 74 and name HA )( resid 75 and name HN ) 2.9 1.1 0.0
assign ( resid 74 and name HB2 )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 74 and name HB1 )( resid 75 and name HN ) 5.0 3.2 0.0
assign ( resid 74 and name HB# )( resid 75 and name HN ) 4.1 2.3 0.0
assign ( resid 75 and name HN )( resid 75 and name HB ) 3.3 1.5 0.0
assign ( resid 75 and name HN )( resid 75 and name HG2# ) 4.3 2.5 0.0
assign ( resid 75 and name HA )( resid 76 and name HN ) 2.9 1.1 0.0
assign ( resid 75 and name HB )( resid 116 and name HB# ) 6.0 4.2 0.0
assign ( resid 75 and name HG1# )( resid 76 and name HN ) 2.9 1.1 0.0
assign ( resid 75 and name HG1# )( resid 77 and name HN ) 5.0 3.2 0.0
assign ( resid 75 and name HG1# )( resid 97 and name HN ) 5.0 3.2 0.0
assign ( resid 75 and name HG1# )( resid 97 and name HB2 ) 3.5 1.7 0.0
assign ( resid 75 and name HG1# )( resid 97 and name HB1 ) 3.5 1.7 0.0
assign ( resid 75 and name HG1# )( resid 97 and name HB# ) 3.4 1.6 0.0
assign ( resid 75 and name HG1# )( resid 97 and name HD# ) 5.7 3.9 0.0
assign ( resid 75 and name HG1# )( resid 116 and name HA ) 4.3 2.5 0.0
assign ( resid 75 and name HG1# )( resid 116 and name HB# ) 4.6 2.8 0.0
assign ( resid 75 and name HG2# )( resid 116 and name HB# ) 5.4 3.6 0.0
assign ( resid 75 and name HG2# )( resid 120 and name HB# ) 6.9 5.1 0.0
assign ( resid 75 and name HG2# )( resid 120 and name HD# ) 8.2 6.4 0.0
assign ( resid 76 and name HN )( resid 76 and name HB ) 3.3 1.5 0.0
assign ( resid 76 and name HN )( resid 76 and name HG2# ) 3.3 1.5 0.0
assign ( resid 76 and name HN )( resid 96 and name HA ) 5.0 3.2 0.0
assign ( resid 76 and name HN )( resid 97 and name HN ) 5.0 3.2 0.0
assign ( resid 76 and name HA )( resid 77 and name HN ) 2.9 1.1 0.0
assign ( resid 76 and name HB )( resid 96 and name HN ) 5.0 3.2 0.0
assign ( resid 76 and name HB )( resid 96 and name HA ) 2.5 0.7 0.0
assign ( resid 76 and name HB )( resid 96 and name HB# ) 4.3 2.5 0.0
assign ( resid 76 and name HG1# )( resid 77 and name HN ) 5.0 3.2 0.0
assign ( resid 76 and name HG1# )( resid 96 and name HA ) 5.0 3.2 0.0
assign ( resid 76 and name HG2# )( resid 96 and name HN ) 6.0 4.2 0.0
assign ( resid 77 and name HN )( resid 77 and name HB ) 3.3 1.5 0.0
assign ( resid 77 and name HA )( resid 77 and name HD1# ) 3.3 1.5 0.0
assign ( resid 77 and name HA )( resid 100 and name HN ) 5.0 3.2 0.0
assign ( resid 77 and name HA )( resid 100 and name HB# ) 5.9 4.1 0.0
assign ( resid 77 and name HG2# )( resid 100 and name HN ) 5.0 3.2 0.0
assign ( resid 77 and name HG2# )( resid 100 and name HB2 ) 4.3 2.5 0.0
assign ( resid 77 and name HG2# )( resid 100 and name HB1 ) 4.3 2.5 0.0
assign ( resid 77 and name HG2# )( resid 100 and name HD2# ) 7.1 5.3 0.0
assign ( resid 77 and name HD1# )( resid 97 and name HE# ) 5.0 3.2 0.0
assign ( resid 78 and name HA )( resid 79 and name HN ) 2.9 1.1 0.0
assign ( resid 78 and name HB )( resid 79 and name HN ) 5.0 3.2 0.0
assign ( resid 78 and name HB )( resid 96 and name HB# ) 4.3 2.5 0.0
assign ( resid 78 and name HB )( resid 99 and name HA ) 5.0 3.2 0.0
assign ( resid 78 and name HB )( resid 99 and name HD# ) 5.0 3.2 0.0
assign ( resid 78 and name HG# )( resid 79 and name HN ) 4.9 3.1 0.0
assign ( resid 78 and name HG# )( resid 96 and name HB# ) 6.1 4.3 0.0
assign ( resid 78 and name HG# )( resid 99 and name HA ) 7.6 5.8 0.0
assign ( resid 78 and name HG# )( resid 99 and name HE# ) 4.9 3.1 0.0
assign ( resid 79 and name HN )( resid 79 and name HG1# ) 5.9 4.1 0.0
assign ( resid 79 and name HA )( resid 79 and name HG12 ) 3.3 1.5 0.0
assign ( resid 79 and name HA )( resid 79 and name HG11 ) 3.3 1.5 0.0
assign ( resid 79 and name HA )( resid 80 and name HN ) 3.3 1.5 0.0
assign ( resid 79 and name HB )( resid 79 and name HG1# ) 2.6 0.8 0.0
assign ( resid 79 and name HG2# )( resid 80 and name HN ) 2.9 1.1 0.0
assign ( resid 79 and name HG2# )( resid 99 and name HB# ) 6.9 5.1 0.0
assign ( resid 79 and name HG2# )( resid 100 and name HB# ) 4.4 2.6 0.0
assign ( resid 79 and name HG2# )( resid 100 and name HG ) 4.3 2.5 0.0
assign ( resid 79 and name HG1# )( resid 80 and name HN ) 5.9 4.1 0.0
assign ( resid 79 and name HD1# )( resid 109 and name HB# ) 5.2 3.4 0.0
assign ( resid 79 and name HD1# )( resid 109 and name HE# ) 6.5 4.7 0.0
assign ( resid 80 and name HA )( resid 80 and name HG2# ) 3.3 1.5 0.0
assign ( resid 85 and name HA )( resid 88 and name HN ) 5.0 3.2 0.0
assign ( resid 85 and name HA )( resid 88 and name HB# ) 4.3 2.5 0.0
assign ( resid 86 and name HN )( resid 86 and name HB# ) 3.7 1.9 0.0
assign ( resid 86 and name HA )( resid 86 and name HB# ) 2.6 0.8 0.0
assign ( resid 86 and name HA )( resid 89 and name HB ) 5.0 3.2 0.0
assign ( resid 86 and name HA )( resid 89 and name HG1# ) 4.3 2.5 0.0
assign ( resid 86 and name HA )( resid 89 and name HG2# ) 4.3 2.5 0.0
assign ( resid 87 and name HN )( resid 87 and name HB ) 3.3 1.5 0.0
assign ( resid 87 and name HN )( resid 88 and name HN ) 3.3 1.5 0.0
assign ( resid 87 and name HA )( resid 87 and name HB ) 2.9 1.1 0.0
assign ( resid 87 and name HA )( resid 90 and name HN ) 3.3 1.5 0.0
assign ( resid 87 and name HA )( resid 90 and name HB2 ) 3.3 1.5 0.0
assign ( resid 87 and name HA )( resid 90 and name HB1 ) 3.3 1.5 0.0
assign ( resid 87 and name HA )( resid 90 and name HB# ) 2.9 1.1 0.0
assign ( resid 87 and name HA )( resid 90 and name HD# ) 4.2 2.4 0.0
assign ( resid 87 and name HB )( resid 88 and name HN ) 5.0 3.2 0.0
assign ( resid 87 and name HG2# )( resid 88 and name HN ) 5.0 3.2 0.0
assign ( resid 87 and name HG2# )( resid 88 and name HB# ) 7.1 5.3 0.0
assign ( resid 87 and name HG2# )( resid 99 and name HE# ) 3.3 1.5 0.0
assign ( resid 88 and name HN )( resid 88 and name HB# ) 3.3 1.5 0.0
assign ( resid 88 and name HN )( resid 89 and name HN ) 3.3 1.5 0.0
assign ( resid 88 and name HN )( resid 90 and name HB# ) 5.9 4.1 0.0
assign ( resid 88 and name HA )( resid 91 and name HB# ) 4.3 2.5 0.0
assign ( resid 88 and name HB# )( resid 89 and name HN ) 2.9 1.1 0.0
assign ( resid 88 and name HB# )( resid 99 and name HB# ) 6.9 5.1 0.0
assign ( resid 88 and name HB# )( resid 99 and name HD# ) 3.3 1.5 0.0
assign ( resid 88 and name HB# )( resid 99 and name HE# ) 5.0 3.2 0.0
assign ( resid 89 and name HN )( resid 89 and name HB ) 5.0 3.2 0.0
assign ( resid 89 and name HN )( resid 89 and name HG1# ) 3.3 1.5 0.0
assign ( resid 89 and name HN )( resid 89 and name HG2# ) 3.5 1.7 0.0
assign ( resid 89 and name HN )( resid 90 and name HN ) 2.9 1.1 0.0
assign ( resid 89 and name HA )( resid 92 and name HN ) 5.0 3.2 0.0
assign ( resid 89 and name HA )( resid 92 and name HB ) 5.0 3.2 0.0
assign ( resid 89 and name HA )( resid 92 and name HG2# ) 4.3 2.5 0.0
assign ( resid 89 and name HA )( resid 92 and name HG1# ) 5.9 4.1 0.0
assign ( resid 89 and name HB )( resid 90 and name HN ) 5.0 3.2 0.0
assign ( resid 89 and name HG1# )( resid 90 and name HN ) 6.0 4.2 0.0
assign ( resid 89 and name HG1# )( resid 92 and name HG1# ) 6.9 5.1 0.0
assign ( resid 89 and name HG1# )( resid 92 and name HD1# ) 4.6 2.8 0.0
assign ( resid 89 and name HG2# )( resid 90 and name HB# ) 5.9 4.1 0.0
assign ( resid 89 and name HG2# )( resid 92 and name HG1# ) 6.9 5.1 0.0
assign ( resid 89 and name HG2# )( resid 92 and name HD1# ) 7.1 5.3 0.0
assign ( resid 90 and name HN )( resid 91 and name HN ) 3.3 1.5 0.0
assign ( resid 90 and name HA )( resid 90 and name HB# ) 2.6 0.8 0.0
assign ( resid 90 and name HA )( resid 90 and name HG2 ) 3.3 1.5 0.0
assign ( resid 90 and name HA )( resid 90 and name HG1 ) 3.3 1.5 0.0
assign ( resid 90 and name HG# )( resid 90 and name HE# ) 3.6 1.8 0.0
assign ( resid 91 and name HA )( resid 94 and name HN ) 5.0 3.2 0.0
assign ( resid 91 and name HA )( resid 94 and name HB# ) 4.2 2.4 0.0
assign ( resid 91 and name HB# )( resid 92 and name HN ) 4.3 2.5 0.0
assign ( resid 91 and name HB# )( resid 96 and name HB# ) 5.4 3.6 0.0
assign ( resid 91 and name HB# )( resid 99 and name HE# ) 5.0 3.2 0.0
assign ( resid 92 and name HN )( resid 92 and name HG2# ) 4.3 2.5 0.0
assign ( resid 92 and name HN )( resid 92 and name HG12 ) 5.0 3.2 0.0
assign ( resid 92 and name HN )( resid 92 and name HG11 ) 5.0 3.2 0.0
assign ( resid 92 and name HN )( resid 92 and name HG1# ) 4.1 2.3 0.0
assign ( resid 92 and name HN )( resid 92 and name HD1# ) 6.0 4.2 0.0
assign ( resid 92 and name HN )( resid 93 and name HN ) 5.0 3.2 0.0
assign ( resid 92 and name HN )( resid 94 and name HN ) 5.0 3.2 0.0
assign ( resid 92 and name HA )( resid 96 and name HN ) 3.3 1.5 0.0
assign ( resid 92 and name HA )( resid 96 and name HB# ) 3.5 1.7 0.0
assign ( resid 92 and name HB )( resid 93 and name HN ) 5.0 3.2 0.0
assign ( resid 92 and name HB )( resid 97 and name HA ) 5.0 3.2 0.0
assign ( resid 92 and name HG2# )( resid 93 and name HN ) 5.0 3.2 0.0
assign ( resid 92 and name HG2# )( resid 96 and name HB# ) 5.4 3.6 0.0
assign ( resid 92 and name HG2# )( resid 98 and name HB# ) 5.9 4.1 0.0
assign ( resid 92 and name HD1# )( resid 98 and name HA ) 3.3 1.5 0.0
assign ( resid 92 and name HD1# )( resid 98 and name HB2 ) 5.0 3.2 0.0
assign ( resid 92 and name HD1# )( resid 98 and name HB1 ) 5.0 3.2 0.0
assign ( resid 92 and name HD1# )( resid 98 and name HB# ) 5.2 3.4 0.0
assign ( resid 92 and name HD1# )( resid 99 and name HB2 ) 6.0 4.2 0.0
assign ( resid 92 and name HD1# )( resid 99 and name HB1 ) 6.0 4.2 0.0
assign ( resid 93 and name HN )( resid 94 and name HN ) 3.3 1.5 0.0
assign ( resid 93 and name HA )( resid 95 and name HN ) 5.0 3.2 0.0
assign ( resid 94 and name HN )( resid 94 and name HB# ) 3.4 1.6 0.0
assign ( resid 94 and name HN )( resid 95 and name HN ) 3.3 1.5 0.0
assign ( resid 94 and name HA )( resid 94 and name HB# ) 2.6 0.8 0.0
assign ( resid 94 and name HB# )( resid 95 and name HN ) 5.9 4.1 0.0
assign ( resid 95 and name HN )( resid 96 and name HN ) 2.9 1.1 0.0
assign ( resid 95 and name HN )( resid 96 and name HB# ) 5.0 3.2 0.0
assign ( resid 96 and name HN )( resid 96 and name HB# ) 3.3 1.5 0.0
assign ( resid 96 and name HN )( resid 98 and name HN ) 5.0 3.2 0.0
assign ( resid 96 and name HA )( resid 97 and name HN ) 2.9 1.1 0.0
assign ( resid 96 and name HB# )( resid 97 and name HN ) 2.9 1.1 0.0
assign ( resid 96 and name HB# )( resid 98 and name HN ) 3.3 1.5 0.0
assign ( resid 97 and name HN )( resid 97 and name HB2 ) 3.3 1.5 0.0
assign ( resid 97 and name HN )( resid 97 and name HB1 ) 3.3 1.5 0.0
assign ( resid 97 and name HN )( resid 98 and name HN ) 3.3 1.5 0.0
assign ( resid 97 and name HA )( resid 97 and name HB# ) 2.7 0.9 0.0
assign ( resid 97 and name HA )( resid 97 and name HD# ) 3.3 1.5 0.0
assign ( resid 97 and name HA )( resid 98 and name HN ) 3.3 1.5 0.0
assign ( resid 97 and name HB2 )( resid 98 and name HN ) 5.0 3.2 0.0
assign ( resid 97 and name HB1 )( resid 98 and name HN ) 5.0 3.2 0.0
assign ( resid 97 and name HB# )( resid 98 and name HN ) 4.1 2.3 0.0
assign ( resid 97 and name HD# )( resid 98 and name HN ) 5.0 3.2 0.0
assign ( resid 97 and name HD# )( resid 98 and name HB# ) 5.9 4.1 0.0
assign ( resid 98 and name HN )( resid 98 and name HA ) 2.9 1.1 0.0
assign ( resid 98 and name HB# )( resid 98 and name HG# ) 2.5 0.7 0.0
assign ( resid 98 and name HG# )( resid 100 and name HD2# ) 6.9 5.1 0.0
assign ( resid 99 and name HA )( resid 100 and name HN ) 3.3 1.5 0.0
assign ( resid 100 and name HN )( resid 100 and name HD1# ) 5.0 3.2 0.0
assign ( resid 100 and name HN )( resid 100 and name HD2# ) 5.0 3.2 0.0
assign ( resid 100 and name HA )( resid 100 and name HG ) 5.0 3.2 0.0
assign ( resid 100 and name HA )( resid 100 and name HD1# ) 3.5 1.7 0.0
assign ( resid 100 and name HA )( resid 100 and name HD2# ) 5.0 3.2 0.0
assign ( resid 100 and name HA )( resid 101 and name HN ) 2.9 1.1 0.0
assign ( resid 100 and name HB# )( resid 100 and name HG ) 2.6 0.8 0.0
assign ( resid 100 and name HB# )( resid 101 and name HN ) 5.9 4.1 0.0
assign ( resid 100 and name HD1# )( resid 109 and name HN ) 6.0 4.2 0.0
assign ( resid 100 and name HD1# )( resid 109 and name HA ) 4.3 2.5 0.0
assign ( resid 100 and name HD2# )( resid 108 and name HG# ) 6.9 5.1 0.0
assign ( resid 100 and name HD2# )( resid 109 and name HA ) 4.3 2.5 0.0
assign ( resid 100 and name HD2# )( resid 109 and name HB# ) 6.9 5.1 0.0
assign ( resid 100 and name HD2# )( resid 109 and name HD# ) 5.0 3.2 0.0
assign ( resid 101 and name HN )( resid 101 and name HB# ) 3.7 1.9 0.0
assign ( resid 101 and name HN )( resid 101 and name HG# ) 4.2 2.4 0.0
assign ( resid 101 and name HA )( resid 101 and name HG# ) 3.7 1.9 0.0
assign ( resid 101 and name HB# )( resid 101 and name HG# ) 2.5 0.7 0.0
assign ( resid 102 and name HN )( resid 103 and name HD2 ) 3.3 1.5 0.0
assign ( resid 102 and name HN )( resid 103 and name HD1 ) 3.3 1.5 0.0
assign ( resid 103 and name HA )( resid 104 and name HN ) 3.3 1.5 0.0
assign ( resid 104 and name HA )( resid 104 and name HB# ) 2.7 0.9 0.0
assign ( resid 105 and name HA )( resid 105 and name HB# ) 2.6 0.8 0.0
assign ( resid 105 and name HB# )( resid 107 and name HN ) 5.9 4.1 0.0
assign ( resid 106 and name HN )( resid 107 and name HN ) 5.0 3.2 0.0
assign ( resid 106 and name HA )( resid 106 and name HB ) 2.9 1.1 0.0
assign ( resid 106 and name HA )( resid 109 and name HN ) 3.3 1.5 0.0
assign ( resid 106 and name HA )( resid 109 and name HB2 ) 3.3 1.5 0.0
assign ( resid 106 and name HA )( resid 109 and name HB1 ) 3.3 1.5 0.0
assign ( resid 106 and name HA )( resid 109 and name HB# ) 2.8 1.0 0.0
assign ( resid 106 and name HG2# )( resid 107 and name HN ) 5.0 3.2 0.0
assign ( resid 106 and name HG2# )( resid 107 and name HA ) 5.0 3.2 0.0
assign ( resid 106 and name HG2# )( resid 109 and name HN ) 6.0 4.2 0.0
assign ( resid 106 and name HG2# )( resid 109 and name HB# ) 6.9 5.1 0.0
assign ( resid 106 and name HG2# )( resid 109 and name HD# ) 5.0 3.2 0.0
assign ( resid 106 and name HG2# )( resid 110 and name HN ) 6.0 4.2 0.0
assign ( resid 106 and name HG2# )( resid 110 and name HG ) 6.0 4.2 0.0
assign ( resid 106 and name O )( resid 110 and name N ) 3.3 1.5 0.0
assign ( resid 106 and name O )( resid 110 and name HN ) 2.3 0.5 0.0
assign ( resid 107 and name HN )( resid 107 and name HB2 ) 2.9 1.1 0.0
assign ( resid 107 and name HN )( resid 107 and name HB1 ) 2.9 1.1 0.0
assign ( resid 107 and name HN )( resid 107 and name HG# ) 4.2 2.4 0.0
assign ( resid 107 and name HN )( resid 108 and name HN ) 3.3 1.5 0.0
assign ( resid 107 and name HA )( resid 107 and name HB# ) 2.6 0.8 0.0
assign ( resid 107 and name HA )( resid 107 and name HG# ) 3.4 1.6 0.0
assign ( resid 107 and name HA )( resid 110 and name HN ) 5.0 3.2 0.0
assign ( resid 107 and name HA )( resid 110 and name HB2 ) 5.0 3.2 0.0
assign ( resid 107 and name HA )( resid 110 and name HB1 ) 5.0 3.2 0.0
assign ( resid 107 and name HA )( resid 110 and name HB# ) 4.1 2.3 0.0
assign ( resid 107 and name HA )( resid 110 and name HD1# ) 4.3 2.5 0.0
assign ( resid 107 and name HB# )( resid 107 and name HG# ) 2.5 0.7 0.0
assign ( resid 107 and name HG# )( resid 108 and name HN ) 5.9 4.1 0.0
assign ( resid 107 and name HG# )( resid 111 and name HD# ) 6.8 5.0 0.0
assign ( resid 108 and name HN )( resid 108 and name HB# ) 3.4 1.6 0.0
assign ( resid 108 and name HN )( resid 108 and name HG# ) 5.9 4.1 0.0
assign ( resid 108 and name HN )( resid 109 and name HN ) 3.3 1.5 0.0
assign ( resid 108 and name HN )( resid 109 and name HB# ) 5.9 4.1 0.0
assign ( resid 108 and name HA )( resid 108 and name HG# ) 3.4 1.6 0.0
assign ( resid 108 and name HA )( resid 108 and name HD# ) 4.2 2.4 0.0
assign ( resid 108 and name HA )( resid 111 and name HD1# ) 6.0 4.2 0.0
assign ( resid 108 and name HA )( resid 111 and name HD2# ) 6.0 4.2 0.0
assign ( resid 108 and name HA )( resid 111 and name HD# ) 5.0 3.2 0.0
assign ( resid 108 and name HB# )( resid 109 and name HN ) 4.2 2.4 0.0
assign ( resid 108 and name HG# )( resid 109 and name HN ) 5.9 4.1 0.0
assign ( resid 109 and name HN )( resid 109 and name HB2 ) 3.3 1.5 0.0
assign ( resid 109 and name HN )( resid 109 and name HB1 ) 3.3 1.5 0.0
assign ( resid 109 and name HN )( resid 109 and name HB# ) 2.9 1.1 0.0
assign ( resid 109 and name HN )( resid 110 and name HN ) 3.3 1.5 0.0
assign ( resid 109 and name HA )( resid 109 and name HB# ) 2.7 0.9 0.0
assign ( resid 109 and name HA )( resid 109 and name HD# ) 3.3 1.5 0.0
assign ( resid 109 and name HA )( resid 112 and name HB ) 3.3 1.5 0.0
assign ( resid 109 and name HB# )( resid 110 and name HN ) 4.2 2.4 0.0
assign ( resid 109 and name HB# )( resid 111 and name HN ) 5.9 4.1 0.0
assign ( resid 109 and name HD# )( resid 110 and name HN ) 5.0 3.2 0.0
assign ( resid 109 and name HZ )( resid 113 and name HG1# ) 4.2 2.4 0.0
assign ( resid 109 and name O )( resid 113 and name N ) 3.3 1.5 0.0
assign ( resid 109 and name O )( resid 113 and name HN ) 2.3 0.5 0.0
assign ( resid 110 and name HN )( resid 110 and name HB2 ) 3.3 1.5 0.0
assign ( resid 110 and name HN )( resid 110 and name HB1 ) 3.3 1.5 0.0
assign ( resid 110 and name HN )( resid 110 and name HB# ) 2.9 1.1 0.0
assign ( resid 110 and name HN )( resid 110 and name HD1# ) 5.0 3.2 0.0
assign ( resid 110 and name HN )( resid 111 and name HN ) 3.3 1.5 0.0
assign ( resid 110 and name HA )( resid 110 and name HB# ) 2.6 0.8 0.0
assign ( resid 110 and name HA )( resid 110 and name HG ) 3.3 1.5 0.0
assign ( resid 110 and name HA )( resid 110 and name HD1# ) 4.3 2.5 0.0
assign ( resid 110 and name HA )( resid 110 and name HD2# ) 3.5 1.7 0.0
assign ( resid 110 and name HA )( resid 113 and name HN ) 5.0 3.2 0.0
assign ( resid 110 and name HA )( resid 113 and name HB ) 3.3 1.5 0.0
assign ( resid 110 and name HA )( resid 113 and name HG1# ) 5.9 4.1 0.0
assign ( resid 110 and name HB2 )( resid 111 and name HN ) 3.3 1.5 0.0
assign ( resid 110 and name HB1 )( resid 111 and name HN ) 3.3 1.5 0.0
assign ( resid 110 and name HB# )( resid 111 and name HN ) 4.2 2.4 0.0
assign ( resid 111 and name HN )( resid 111 and name HB# ) 3.3 1.5 0.0
assign ( resid 111 and name HN )( resid 111 and name HD# ) 5.9 4.1 0.0
assign ( resid 111 and name HN )( resid 112 and name HN ) 2.9 1.1 0.0
assign ( resid 111 and name HA )( resid 111 and name HB# ) 2.6 0.8 0.0
assign ( resid 111 and name HA )( resid 111 and name HG ) 2.5 0.7 0.0
assign ( resid 111 and name HA )( resid 111 and name HD1# ) 6.0 4.2 0.0
assign ( resid 111 and name HA )( resid 111 and name HD2# ) 6.0 4.2 0.0
assign ( resid 111 and name HA )( resid 113 and name HN ) 5.0 3.2 0.0
assign ( resid 111 and name HA )( resid 114 and name HB# ) 4.2 2.4 0.0
assign ( resid 111 and name HB# )( resid 112 and name HN ) 4.2 2.4 0.0
assign ( resid 111 and name HD# )( resid 112 and name HN ) 7.6 5.8 0.0
assign ( resid 112 and name HN )( resid 112 and name HB ) 2.9 1.1 0.0
assign ( resid 112 and name HA )( resid 115 and name HN ) 5.0 3.2 0.0
assign ( resid 112 and name HA )( resid 115 and name HB# ) 3.8 2.0 0.0
assign ( resid 112 and name HB )( resid 113 and name HN ) 3.3 1.5 0.0
assign ( resid 112 and name HG2# )( resid 113 and name HN ) 4.3 2.5 0.0
assign ( resid 112 and name HG2# )( resid 115 and name HB# ) 6.9 5.1 0.0
assign ( resid 113 and name HN )( resid 113 and name HB ) 2.9 1.1 0.0
assign ( resid 113 and name HN )( resid 113 and name HG12 ) 5.0 3.2 0.0
assign ( resid 113 and name HN )( resid 113 and name HG11 ) 5.0 3.2 0.0
assign ( resid 113 and name HN )( resid 113 and name HG1# ) 4.1 2.3 0.0
assign ( resid 113 and name HN )( resid 113 and name HD1# ) 5.0 3.2 0.0
assign ( resid 113 and name HN )( resid 114 and name HN ) 3.3 1.5 0.0
assign ( resid 113 and name HA )( resid 113 and name HG1# ) 3.4 1.6 0.0
assign ( resid 113 and name HA )( resid 113 and name HD1# ) 3.5 1.7 0.0
assign ( resid 113 and name HA )( resid 115 and name HN ) 5.0 3.2 0.0
assign ( resid 113 and name HA )( resid 116 and name HN ) 3.3 1.5 0.0
assign ( resid 113 and name HA )( resid 116 and name HB# ) 3.5 1.7 0.0
assign ( resid 113 and name HB )( resid 113 and name HG1# ) 2.6 0.8 0.0
assign ( resid 113 and name HB )( resid 114 and name HN ) 3.3 1.5 0.0
assign ( resid 113 and name HG2# )( resid 113 and name HG1# ) 3.5 1.7 0.0
assign ( resid 113 and name HG2# )( resid 114 and name HN ) 3.3 1.5 0.0
assign ( resid 113 and name HG2# )( resid 114 and name HA ) 6.0 4.2 0.0
assign ( resid 113 and name HG2# )( resid 117 and name HD# ) 5.0 3.2 0.0
assign ( resid 113 and name HG2# )( resid 117 and name HE# ) 5.0 3.2 0.0
assign ( resid 114 and name HN )( resid 114 and name HB# ) 3.4 1.6 0.0
assign ( resid 114 and name HN )( resid 114 and name HG# ) 5.9 4.1 0.0
assign ( resid 114 and name HN )( resid 115 and name HN ) 2.9 1.1 0.0
assign ( resid 114 and name HA )( resid 114 and name HB# ) 2.6 0.8 0.0
assign ( resid 114 and name HA )( resid 114 and name HG# ) 3.4 1.6 0.0
assign ( resid 114 and name HA )( resid 117 and name HN ) 5.0 3.2 0.0
assign ( resid 114 and name HA )( resid 117 and name HB2 ) 5.0 3.2 0.0
assign ( resid 114 and name HA )( resid 117 and name HB1 ) 5.0 3.2 0.0
assign ( resid 114 and name HA )( resid 117 and name HD# ) 5.0 3.2 0.0
assign ( resid 114 and name HB# )( resid 115 and name HN ) 5.9 4.1 0.0
assign ( resid 114 and name HG# )( resid 114 and name HE# ) 3.7 1.9 0.0
assign ( resid 114 and name HD# )( resid 115 and name HA ) 4.2 2.4 0.0
assign ( resid 114 and name HE# )( resid 116 and name HN ) 5.9 4.1 0.0
assign ( resid 115 and name HN )( resid 115 and name HA ) 2.9 1.1 0.0
assign ( resid 115 and name HN )( resid 115 and name HB# ) 3.5 1.7 0.0
assign ( resid 115 and name HA )( resid 115 and name HB# ) 2.6 0.8 0.0
assign ( resid 115 and name HA )( resid 118 and name HB# ) 5.9 4.1 0.0
assign ( resid 115 and name HA )( resid 118 and name HG# ) 5.9 4.1 0.0
assign ( resid 115 and name HB# )( resid 116 and name HN ) 3.8 2.0 0.0
assign ( resid 116 and name HN )( resid 116 and name HB# ) 2.9 1.1 0.0
assign ( resid 116 and name HN )( resid 117 and name HN ) 2.9 1.1 0.0
assign ( resid 116 and name HA )( resid 117 and name HN ) 5.0 3.2 0.0
assign ( resid 116 and name HA )( resid 119 and name HN ) 5.0 3.2 0.0
assign ( resid 116 and name HA )( resid 119 and name HB# ) 5.9 4.1 0.0
assign ( resid 116 and name HB# )( resid 117 and name HN ) 4.3 2.5 0.0
assign ( resid 116 and name HB# )( resid 118 and name HN ) 6.0 4.2 0.0
assign ( resid 117 and name HN )( resid 117 and name HB2 ) 5.0 3.2 0.0
assign ( resid 117 and name HN )( resid 117 and name HB1 ) 5.0 3.2 0.0
assign ( resid 117 and name HN )( resid 117 and name HB# ) 2.9 1.1 0.0
assign ( resid 117 and name HN )( resid 117 and name HD# ) 3.3 1.5 0.0
assign ( resid 117 and name HN )( resid 118 and name HN ) 2.9 1.1 0.0
assign ( resid 117 and name HA )( resid 117 and name HB# ) 2.7 0.9 0.0
assign ( resid 117 and name HA )( resid 117 and name HD# ) 3.3 1.5 0.0
assign ( resid 117 and name HA )( resid 120 and name HB# ) 5.0 3.2 0.0
assign ( resid 117 and name HB2 )( resid 118 and name HN ) 5.0 3.2 0.0
assign ( resid 117 and name HB1 )( resid 118 and name HN ) 5.0 3.2 0.0
assign ( resid 117 and name HB# )( resid 118 and name HN ) 4.1 2.3 0.0
assign ( resid 117 and name HB# )( resid 118 and name HB# ) 6.8 5.0 0.0
assign ( resid 117 and name HB# )( resid 118 and name HG# ) 6.8 5.0 0.0
assign ( resid 118 and name HN )( resid 118 and name HB# ) 3.4 1.6 0.0
assign ( resid 118 and name HN )( resid 118 and name HG# ) 4.2 2.4 0.0
assign ( resid 118 and name HA )( resid 118 and name HB# ) 2.6 0.8 0.0
assign ( resid 118 and name HA )( resid 118 and name HG# ) 3.4 1.6 0.0
assign ( resid 118 and name HA )( resid 121 and name HB# ) 5.9 4.1 0.0
assign ( resid 118 and name HB# )( resid 118 and name HG# ) 2.5 0.7 0.0
assign ( resid 119 and name HN )( resid 119 and name HB# ) 3.4 1.6 0.0
assign ( resid 119 and name HN )( resid 119 and name HG# ) 3.4 1.6 0.0
assign ( resid 119 and name HN )( resid 120 and name HN ) 3.3 1.5 0.0
assign ( resid 119 and name HN )( resid 121 and name HN ) 5.0 3.2 0.0
assign ( resid 119 and name HA )( resid 119 and name HB# ) 2.6 0.8 0.0
assign ( resid 119 and name HA )( resid 119 and name HG# ) 3.4 1.6 0.0
assign ( resid 119 and name HA )( resid 120 and name HN ) 3.3 1.5 0.0
assign ( resid 120 and name HN )( resid 120 and name HB2 ) 3.3 1.5 0.0
assign ( resid 120 and name HN )( resid 120 and name HB1 ) 3.3 1.5 0.0
assign ( resid 120 and name HN )( resid 120 and name HB# ) 5.0 3.2 0.0
assign ( resid 120 and name HN )( resid 121 and name HN ) 5.0 3.2 0.0
assign ( resid 120 and name HA )( resid 120 and name HB# ) 2.7 0.9 0.0
assign ( resid 120 and name HA )( resid 121 and name HN ) 3.3 1.5 0.0
assign ( resid 120 and name HB2 )( resid 121 and name HN ) 5.0 3.2 0.0
assign ( resid 120 and name HB1 )( resid 121 and name HN ) 5.0 3.2 0.0
assign ( resid 121 and name HN )( resid 121 and name HB# ) 3.7 1.9 0.0

assign(resid 3 and name C) (resid 4 and name N)
     (resid 4 and name CA) (resid 4 and name C) 1.0 -110.0 60.0 2

assign(resid 4 and name C) (resid 5 and name N)
     (resid 5 and name CA) (resid 5 and name C) 1.0 -110.0 60.0 2 

assign(resid 5 and name C) (resid 6 and name N)
     (resid 6 and name CA) (resid 6 and name C) 1.0 -110.0 60.0 2 

assign(resid 13 and name C) (resid 14 and name N)
     (resid 14 and name CA) (resid 14 and name C)  1.0 -60.0 30.0 2 

assign(resid 14 and name C) (resid 15 and name N)
     (resid 15 and name CA) (resid 15 and name C)  1.0 -60.0 30.0 2 

assign(resid 16 and name C) (resid 17 and name N)
     (resid 17 and name CA) (resid 17 and name C)  1.0 -60.0 30.0 2 

assign(resid 17 and name C) (resid 18 and name N)
     (resid 18 and name CA) (resid 18 and name C)  1.0 -60.0 30.0 2 

assign(resid 18 and name C) (resid 19 and name N)
     (resid 19 and name CA) (resid 19 and name C)  1.0 -60.0 30.0 2 

assign(resid 19 and name C) (resid 20 and name N)
     (resid 20 and name CA) (resid 20 and name C)  1.0 -60.0 30.0 2 

assign(resid 20 and name C) (resid 21 and name N)
     (resid 21 and name CA) (resid 21 and name C)  1.0 -60.0 30.0 2 

assign(resid 21 and name C) (resid 22 and name N)
     (resid 22 and name CA) (resid 22 and name C)  1.0 -60.0 30.0 2 

assign(resid 22 and name C) (resid 23 and name N)
     (resid 23 and name CA) (resid 23 and name C)  1.0 -60.0 30.0 2 

assign(resid 28 and name C) (resid 29 and name N)
     (resid 29 and name CA) (resid 29 and name C)  1.0 -110.0 60.0 2 

assign(resid 30 and name C) (resid 31 and name N)
     (resid 31 and name CA) (resid 31 and name C)  1.0 -110.0 60.0 2 

assign(resid 31 and name C) (resid 32 and name N)
     (resid 32 and name CA) (resid 32 and name C)  1.0 -110.0 60.0 2 

assign(resid 32 and name C) (resid 33 and name N)
     (resid 33 and name CA) (resid 33 and name C)  1.0 -110.0 60.0 2 

assign(resid 34 and name C) (resid 35 and name N)
     (resid 35 and name CA) (resid 35 and name C) 1.0 -60.0 30.0 2 

assign(resid 35 and name C) (resid 36 and name N)
     (resid 36 and name CA) (resid 36 and name C) 1.0 -60.0 30.0 2 

assign(resid 36 and name C) (resid 37 and name N)
     (resid 37 and name CA) (resid 37 and name C) 1.0 -60.0 30.0 2 

assign(resid 37 and name C) (resid 38 and name N)
     (resid 38 and name CA) (resid 38 and name C) 1.0 -60.0 30.0 2

assign(resid 38 and name C) (resid 39 and name N)
     (resid 39 and name CA) (resid 39 and name C) 1.0 -60.0 30.0 2 

assign(resid 39 and name C) (resid 40 and name N)
     (resid 40 and name CA) (resid 40 and name C) 1.0 -60.0 30.0 2 

assign(resid 43 and name C) (resid 44 and name N)
     (resid 44 and name CA) (resid 44 and name C) 1.0 -110.0 60.0 2 

assign(resid 48 and name C) (resid 49 and name N)
     (resid 49 and name CA) (resid 49 and name C) 1.0 -110.0 60.0 2 

assign(resid 49 and name C) (resid 50 and name N)
     (resid 50 and name CA) (resid 50 and name C) 1.0 -110.0 60.0 2 

assign(resid 50 and name C) (resid 51 and name N)
     (resid 51 and name CA) (resid 51 and name C) 1.0 -110.0 60.0 2 

assign(resid 53 and name C) (resid 54 and name N)
     (resid 54 and name CA) (resid 54 and name C) 1.0 -110.0 60.0 2 

assign(resid 56 and name C) (resid 57 and name N)
     (resid 57 and name CA) (resid 57 and name C) 1.0 -110.0 60.0 2 

assign(resid 61 and name C) (resid 62 and name N)
     (resid 62 and name CA) (resid 62 and name C) 1.0 -60.0 30.0 2 

assign(resid 62 and name C) (resid 63 and name N)
     (resid 63 and name CA) (resid 63 and name C)  1.0 -60.0 30.0 2

assign(resid 63 and name C) (resid 64 and name N)
     (resid 64 and name CA) (resid 64 and name C) 1.0 -60.0 30.0 2 

assign(resid 64 and name C) (resid 65 and name N)
     (resid 65 and name CA) (resid 65 and name C)  1.0 -60.0 30.0 2

assign(resid 65 and name C) (resid 66 and name N)
     (resid 66 and name CA) (resid 66 and name C) 1.0 -60.0 30.0 2 

assign(resid 66 and name C) (resid 67 and name N)
     (resid 67 and name CA) (resid 67 and name C) 1.0 -60.0 30.0 2 

assign(resid 67 and name C) (resid 68 and name N)
     (resid 68 and name CA) (resid 68 and name C) 1.0 -60.0 30.0 2 

assign(resid 68 and name C) (resid 69 and name N)
     (resid 69 and name CA) (resid 69 and name C) 1.0 -60.0 30.0 2 

assign(resid 69 and name C) (resid 70 and name N)
     (resid 70 and name CA) (resid 70 and name C) 1.0 -110.0 60.0 2 

assign(resid 72 and name C) (resid 73 and name N)
     (resid 73 and name CA) (resid 73 and name C) 1.0 -110.0 60.0 2 

assign(resid 74 and name C) (resid 75 and name N)
     (resid 75 and name CA) (resid 75 and name C) 1.0 -110.0 60.0 2 

assign(resid 75 and name C) (resid 76 and name N)
     (resid 76 and name CA) (resid 76 and name C) 1.0 -110.0 60.0 2 

assign(resid 86 and name C) (resid 87 and name N)
     (resid 87 and name CA) (resid 87 and name C) 1.0 -60.0 30.0 2 

assign(resid 87 and name C) (resid 88 and name N)
     (resid 88 and name CA) (resid 88 and name C) 1.0 -60.0 30.0 2 

assign(resid 88 and name C) (resid 89 and name N)
     (resid 89 and name CA) (resid 89 and name C) 1.0 -60.0 30.0 2 

assign(resid 90 and name C) (resid 91 and name N)
     (resid 91 and name CA) (resid 91 and name C) 1.0 -110.0 60.0 2 

assign(resid 91 and name C) (resid 92 and name N)
     (resid 92 and name CA) (resid 92 and name C) 1.0 -60.0 30.0 2 

assign(resid 95 and name C) (resid 96 and name N)
     (resid 96 and name CA) (resid 96 and name C) 1.0 -60.0 30.0 2 

assign(resid 99 and name C) (resid 100 and name N)
     (resid 100 and name CA) (resid 100 and name C) 1.0 -110.0 60.0 2 

assign(resid 100 and name C) (resid 101 and name N)
     (resid 101 and name CA) (resid 101 and name C) 1.0 -110.0 60.0 2 

assign(resid 106 and name C) (resid 107 and name N)
     (resid 107 and name CA) (resid 107 and name C) 1.0 -60.0 30.0 2 

assign(resid 108 and name C) (resid 109 and name N)
     (resid 109 and name CA) (resid 109 and name C) 1.0 -60.0 30.0 2 

assign(resid 109 and name C) (resid 110 and name N)
     (resid 110 and name CA) (resid 110 and name C) 1.0 -60.0 30.0 2 

assign(resid 110 and name C) (resid 111 and name N)
     (resid 111 and name CA) (resid 111 and name C) 1.0 -60.0 30.0 2 

assign(resid 111 and name C) (resid 112 and name N)
     (resid 112 and name CA) (resid 112 and name C) 1.0 -60.0 30.0 2 

assign(resid 112 and name C) (resid 113 and name N)
     (resid 113 and name CA) (resid 113 and name C) 1.0 -60.0 30.0 2 

assign(resid 113 and name C) (resid 114 and name N)
     (resid 114 and name CA) (resid 114 and name C) 1.0 -60.0 30.0 2 

assign(resid 114 and name C) (resid 115 and name N)
     (resid 115 and name CA) (resid 115 and name C) 1.0 -60.0 30.0 2 

assign(resid 115 and name C) (resid 116 and name N)
     (resid 116 and name CA) (resid 116 and name C) 1.0 -60.0 30.0 2 

assign(resid 119 and name C) (resid 120 and name N)
     (resid 120 and name CA) (resid 120 and name C) 1.0 -110.0 60.0 2

assign (resid 113 and name N) (resid 113 and name CA)
       (resid 113 and name CB) (resid 113 and name CG1) 1.0 -60 30.0 2

assign (resid 79 and name N) (resid 79 and name CA)
       (resid 79 and name CB) (resid 79 and name CG1) 1.0 -60 30.0 2

assign (resid 49 and name N) (resid 49 and name CA)
       (resid 49 and name CB) (resid 49 and name CG1) 1.0 -60 30.0 2

assign (resid 13 and name N) (resid 13 and name CA)
       (resid 13 and name CB) (resid 13 and name CG1) 1.0 -60 30.0 2

assign (resid 67 and name N) (resid 67 and name CA)
       (resid 67 and name CB) (resid 67 and name CG1) 1.0 -60 30.0 2

assign (resid 14 and name N) (resid 14 and name CA)
       (resid 14 and name CB) (resid 14 and name OG1) 1.0 60 30.0 2

assign (resid 87 and name N) (resid 87 and name CA)
       (resid 87 and name CB) (resid 87 and name OG1) 1.0 -180 30.0 2

assign (resid 6 and name N) (resid 6 and name CA)
       (resid 6 and name CB) (resid 6 and name CG1) 1.0 -180 30.0 2

assign (resid 48 and name N) (resid 48 and name CA)
       (resid 48 and name CB) (resid 48 and name CG1) 1.0 -180 30.0 2

assign (resid 61 and name N) (resid 61 and name CA)
       (resid 61 and name CB) (resid 61 and name CG1) 1.0 -180 30.0 2

assign (resid 76 and name N) (resid 76 and name CA)
       (resid 76 and name CB) (resid 76 and name CG1) 1.0 -180 30.0 2
 
assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13    and name N   )
       ( resid 13    and name HN  )  -0.6  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15    and name N   )
       ( resid 15    and name HN  )  -7.9  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29    and name N   )
       ( resid 29    and name HN  )  9.73  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30    and name N   )
       ( resid 30    and name HN  )  10.29  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33    and name N   )
       ( resid 33    and name HN  )  -7.91  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38    and name N   )
       ( resid 38    and name HN  )  -7.91  2.00


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 39    and name N   )
       ( resid 39    and name HN  )  -10.94  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40    and name N   )
       ( resid 40    and name HN  )  -9.11  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 41    and name N   )
       ( resid 41    and name HN  )  -10.34  5.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 42    and name N   )
       ( resid 42    and name HN  )  -6.69  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48    and name N   )
       ( resid 48    and name HN  )  10.94  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49    and name N   )
       ( resid 49    and name HN  )  7.91  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 50    and name N   )
       ( resid 50    and name HN  )  15.2  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51    and name N   )
       ( resid 51    and name HN  )  6.68  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66    and name N   )
       ( resid 66    and name HN  )  -11.55  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69    and name N   )
       ( resid 69    and name HN  )  -10.33  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70    and name N   )
       ( resid 70    and name HN  )  -8.51  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75    and name N   )
       ( resid 75    and name HN  )  11.55  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76    and name N   )
       ( resid 76    and name HN  )  5.48  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 87    and name N   )
       ( resid 87    and name HN  )  -4.26  2.00



assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 107    and name N   )
       ( resid 107    and name HN  )  -7.05  2.00


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 112    and name N   )
       ( resid 112    and name HN  )  -11.55  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 113    and name N   )
       ( resid 113    and name HN  )  -8.51  2.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 115    and name N   )
       ( resid 115    and name HN  )  -3.65  2.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1  -2.382  -1.483  17.469
    2   2H    MET   1          2HT       MET   1  -1.896  -0.707  18.920
    3   3H    MET   1          3HT       MET   1  -0.715  -1.278  17.813
    4    HA   MET   1           HA       MET   1  -2.713   0.751  17.107
    5   1HB   MET   1          2HB       MET   1  -0.776   1.028  19.066
    6   2HB   MET   1          1HB       MET   1   0.012   1.673  17.633
    7   1HG   MET   1          2HG       MET   1  -1.332   3.476  17.536
    8   2HG   MET   1          1HG       MET   1  -2.746   2.588  18.101
    9   1HE   MET   1          1HE       MET   1  -1.405   5.745  19.206
   10   2HE   MET   1          2HE       MET   1  -2.437   5.532  20.621
   11   3HE   MET   1          3HE       MET   1  -3.019   5.056  19.026
   12    H    LYS   2           H        LYS   2  -1.912  -1.430  15.526
   13    HA   LYS   2           HA       LYS   2  -0.168  -0.103  13.556
   14   1HB   LYS   2          2HB       LYS   2  -0.442  -3.056  14.130
   15   2HB   LYS   2          1HB       LYS   2   0.479  -2.378  12.794
   16   1HG   LYS   2          2HG       LYS   2   1.032  -1.737  15.679
   17   2HG   LYS   2          1HG       LYS   2   1.822  -3.046  14.797
   18   1HD   LYS   2          2HD       LYS   2   2.167  -0.947  13.092
   19   2HD   LYS   2          1HD       LYS   2   2.253  -0.146  14.662
   20   1HE   LYS   2          2HE       LYS   2   3.766  -2.657  14.460
   21   2HE   LYS   2          1HE       LYS   2   4.349  -1.351  13.429
   22   1HZ   LYS   2          1HZ       LYS   2   3.936  -1.190  16.366
   23   2HZ   LYS   2          2HZ       LYS   2   4.479   0.075  15.380
   24   3HZ   LYS   2          3HZ       LYS   2   5.430  -1.310  15.581
   25    H    ARG   3           H        ARG   3  -1.108   0.374  11.693
   26    HA   ARG   3           HA       ARG   3  -3.204  -1.340  10.621
   27   1HB   ARG   3          2HB       ARG   3  -3.685   1.628  10.776
   28   2HB   ARG   3          1HB       ARG   3  -4.832   0.354  10.382
   29   1HG   ARG   3          2HG       ARG   3  -5.443   0.932  12.527
   30   2HG   ARG   3          1HG       ARG   3  -4.393  -0.460  12.798
   31   1HD   ARG   3          2HD       ARG   3  -3.219   0.822  14.189
   32   2HD   ARG   3          1HD       ARG   3  -2.669   1.720  12.775
   33    HE   ARG   3           HE       ARG   3  -4.045   3.454  13.373
   34   1HH1  ARG   3          1HH1      ARG   3  -4.905   0.623  15.224
   35   2HH1  ARG   3          2HH1      ARG   3  -5.977   1.483  16.277
   36   1HH2  ARG   3          1HH2      ARG   3  -5.455   4.587  14.756
   37   2HH2  ARG   3          2HH2      ARG   3  -6.292   3.734  16.009
   38    H    VAL   4           H        VAL   4  -2.934  -1.619   8.506
   39    HA   VAL   4           HA       VAL   4  -1.442   0.421   6.990
   40    HB   VAL   4           HB       VAL   4  -1.198  -2.580   6.685
   41   1HG1  VAL   4          1HG1      VAL   4  -0.040  -0.289   5.132
   42   2HG1  VAL   4          2HG1      VAL   4  -0.895  -1.710   4.535
   43   3HG1  VAL   4          3HG1      VAL   4   0.742  -1.868   5.174
   44   1HG2  VAL   4          1HG2      VAL   4   0.815  -0.567   7.693
   45   2HG2  VAL   4          2HG2      VAL   4   1.077  -2.301   7.507
   46   3HG2  VAL   4          3HG2      VAL   4  -0.081  -1.705   8.696
   47    H    LEU   5           H        LEU   5  -1.867   0.287   4.587
   48    HA   LEU   5           HA       LEU   5  -4.622  -0.633   4.095
   49   1HB   LEU   5          2HB       LEU   5  -4.465   1.814   4.233
   50   2HB   LEU   5          1HB       LEU   5  -3.266   1.809   2.955
   51    HG   LEU   5           HG       LEU   5  -4.955   0.889   1.399
   52   1HD1  LEU   5          1HD1      LEU   5  -6.954   0.145   2.041
   53   2HD1  LEU   5          2HD1      LEU   5  -7.253   1.564   3.045
   54   3HD1  LEU   5          3HD1      LEU   5  -6.328   0.208   3.688
   55   1HD2  LEU   5          1HD2      LEU   5  -6.521   3.019   1.643
   56   2HD2  LEU   5          2HD2      LEU   5  -4.853   3.140   1.081
   57   3HD2  LEU   5          3HD2      LEU   5  -5.247   3.509   2.760
   58    H    VAL   6           H        VAL   6  -5.018  -1.820   2.331
   59    HA   VAL   6           HA       VAL   6  -2.800  -2.222   0.427
   60    HB   VAL   6           HB       VAL   6  -4.893  -4.291   1.085
   61   1HG1  VAL   6          1HG1      VAL   6  -3.922  -4.746  -1.013
   62   2HG1  VAL   6          2HG1      VAL   6  -3.093  -5.804   0.129
   63   3HG1  VAL   6          3HG1      VAL   6  -2.304  -4.333  -0.443
   64   1HG2  VAL   6          1HG2      VAL   6  -3.677  -5.139   2.794
   65   2HG2  VAL   6          2HG2      VAL   6  -3.137  -3.465   2.938
   66   3HG2  VAL   6          3HG2      VAL   6  -2.138  -4.643   2.089
   67    H    VAL   7           H        VAL   7  -3.221  -1.802  -1.644
   68    HA   VAL   7           HA       VAL   7  -6.041  -1.597  -2.484
   69    HB   VAL   7           HB       VAL   7  -3.780  -0.016  -3.706
   70   1HG1  VAL   7          1HG1      VAL   7  -6.022  -0.501  -4.895
   71   2HG1  VAL   7          2HG1      VAL   7  -5.405   1.150  -4.875
   72   3HG1  VAL   7          3HG1      VAL   7  -6.689   0.674  -3.763
   73   1HG2  VAL   7          1HG2      VAL   7  -5.759   1.022  -1.687
   74   2HG2  VAL   7          2HG2      VAL   7  -4.380   1.871  -2.386
   75   3HG2  VAL   7          3HG2      VAL   7  -4.117   0.526  -1.277
   76    H    ASP   8           H        ASP   8  -6.618  -2.943  -4.078
   77    HA   ASP   8           HA       ASP   8  -4.815  -3.652  -6.191
   78   1HB   ASP   8          2HB       ASP   8  -3.901  -5.207  -4.663
   79   2HB   ASP   8          1HB       ASP   8  -5.480  -5.647  -4.027
   80    H    ASP   9           H        ASP   9  -5.866  -4.567  -7.954
   81    HA   ASP   9           HA       ASP   9  -8.778  -4.390  -7.829
   82   1HB   ASP   9          2HB       ASP   9  -7.600  -3.058  -9.534
   83   2HB   ASP   9          1HB       ASP   9  -6.951  -4.537 -10.234
   84    H    GLU  10           H        GLU  10  -8.075  -6.639  -6.591
   85    HA   GLU  10           HA       GLU  10  -9.399  -8.633  -8.064
   86   1HB   GLU  10          2HB       GLU  10  -7.655 -10.224  -8.504
   87   2HB   GLU  10          1HB       GLU  10  -7.226  -8.703  -9.272
   88   1HG   GLU  10          2HG       GLU  10  -5.605  -8.226  -7.609
   89   2HG   GLU  10          1HG       GLU  10  -6.157  -9.560  -6.598
   90    H    GLU  11           H        GLU  11 -10.346  -9.935  -6.659
   91    HA   GLU  11           HA       GLU  11 -10.919 -10.955  -4.710
   92   1HB   GLU  11          2HB       GLU  11  -8.568 -11.962  -5.259
   93   2HB   GLU  11          1HB       GLU  11  -8.041 -11.006  -3.880
   94   1HG   GLU  11          2HG       GLU  11  -8.895 -12.451  -2.428
   95   2HG   GLU  11          1HG       GLU  11 -10.429 -12.533  -3.291
   96    H    SER  12           H        SER  12 -11.020 -10.703  -2.356
   97    HA   SER  12           HA       SER  12 -11.242  -8.004  -1.601
   98   1HB   SER  12          2HB       SER  12 -10.959  -9.966   0.590
   99   2HB   SER  12          1HB       SER  12 -12.248  -8.805   0.273
  100    HG   SER  12           HG       SER  12 -11.910 -11.411  -0.712
  101    H    ILE  13           H        ILE  13  -9.134 -10.420  -0.047
  102    HA   ILE  13           HA       ILE  13  -7.267  -8.272   0.638
  103    HB   ILE  13           HB       ILE  13  -7.042 -11.129   1.544
  104   1HG1  ILE  13          2HG1      ILE  13  -9.316 -10.266   2.086
  105   2HG1  ILE  13          1HG1      ILE  13  -8.344 -10.597   3.516
  106   1HG2  ILE  13          1HG2      ILE  13  -5.108 -10.145   2.202
  107   2HG2  ILE  13          2HG2      ILE  13  -6.117  -9.687   3.574
  108   3HG2  ILE  13          3HG2      ILE  13  -5.822  -8.533   2.273
  109   1HD1  ILE  13          1HD1      ILE  13  -7.926  -8.270   3.845
  110   2HD1  ILE  13          2HD1      ILE  13  -9.662  -8.502   3.633
  111   3HD1  ILE  13          3HD1      ILE  13  -8.687  -7.867   2.306
  112    H    THR  14           H        THR  14  -4.924  -8.779   0.495
  113    HA   THR  14           HA       THR  14  -4.342  -9.892  -2.125
  114    HB   THR  14           HB       THR  14  -2.070  -8.928  -1.736
  115    HG1  THR  14           1HG      THR  14  -1.730  -7.687   0.078
  116   1HG2  THR  14          1HG2      THR  14  -2.689  -6.578  -1.813
  117   2HG2  THR  14          2HG2      THR  14  -4.317  -6.983  -1.271
  118   3HG2  THR  14          3HG2      THR  14  -3.743  -7.549  -2.840
  119    H    SER  15           H        SER  15  -3.374 -11.782  -2.476
  120    HA   SER  15           HA       SER  15  -3.268 -13.805  -0.633
  121   1HB   SER  15          2HB       SER  15  -1.219 -13.893  -2.783
  122   2HB   SER  15          1HB       SER  15  -2.408 -15.103  -2.307
  123    HG   SER  15           HG       SER  15  -2.881 -14.141  -4.342
  124    H    SER  16           H        SER  16  -1.927 -14.527   0.879
  125    HA   SER  16           HA       SER  16  -0.065 -14.849   2.151
  126   1HB   SER  16          2HB       SER  16   1.429 -12.986   0.301
  127   2HB   SER  16          1HB       SER  16   2.116 -14.151   1.429
  128    HG   SER  16           HG       SER  16   0.413 -14.916  -0.697
  129    H    LEU  17           H        LEU  17  -1.413 -11.788   1.517
  130    HA   LEU  17           HA       LEU  17   0.128 -10.315   3.433
  131   1HB   LEU  17          2HB       LEU  17  -1.578  -9.663   1.385
  132   2HB   LEU  17          1HB       LEU  17  -2.574  -9.339   2.782
  133    HG   LEU  17           HG       LEU  17  -0.474  -7.741   1.619
  134   1HD1  LEU  17          1HD1      LEU  17  -2.446  -6.657   2.019
  135   2HD1  LEU  17          2HD1      LEU  17  -1.480  -6.139   3.401
  136   3HD1  LEU  17          3HD1      LEU  17  -2.679  -7.418   3.591
  137   1HD2  LEU  17          1HD2      LEU  17   0.366  -6.997   3.965
  138   2HD2  LEU  17          2HD2      LEU  17   1.130  -8.369   3.166
  139   3HD2  LEU  17          3HD2      LEU  17  -0.054  -8.641   4.444
  140    H    SER  18           H        SER  18  -3.234 -11.503   3.382
  141    HA   SER  18           HA       SER  18  -4.093 -10.781   5.862
  142   1HB   SER  18          2HB       SER  18  -5.158 -12.285   3.914
  143   2HB   SER  18          1HB       SER  18  -4.757 -13.564   5.060
  144    HG   SER  18           HG       SER  18  -6.025 -12.548   6.598
  145    H    ALA  19           H        ALA  19  -2.721 -14.017   5.221
  146    HA   ALA  19           HA       ALA  19  -2.497 -14.902   7.810
  147   1HB   ALA  19          1HB       ALA  19  -2.046 -16.247   5.776
  148   2HB   ALA  19          2HB       ALA  19  -0.829 -16.452   7.036
  149   3HB   ALA  19          3HB       ALA  19  -0.484 -15.442   5.632
  150    H    ILE  20           H        ILE  20  -0.240 -12.862   6.020
  151    HA   ILE  20           HA       ILE  20   1.819 -12.826   7.936
  152    HB   ILE  20           HB       ILE  20   1.067 -10.947   5.707
  153   1HG1  ILE  20          2HG1      ILE  20   3.486 -12.707   6.125
  154   2HG1  ILE  20          1HG1      ILE  20   2.055 -13.185   5.216
  155   1HG2  ILE  20          1HG2      ILE  20   2.932 -10.457   7.925
  156   2HG2  ILE  20          2HG2      ILE  20   2.150  -9.322   6.825
  157   3HG2  ILE  20          3HG2      ILE  20   3.598 -10.189   6.313
  158   1HD1  ILE  20          1HD1      ILE  20   4.324 -11.811   4.295
  159   2HD1  ILE  20          2HD1      ILE  20   2.980 -10.674   4.249
  160   3HD1  ILE  20          3HD1      ILE  20   2.858 -12.216   3.402
  161    H    LEU  21           H        LEU  21  -0.412 -10.117   7.202
  162    HA   LEU  21           HA       LEU  21   0.131  -8.574   9.413
  163   1HB   LEU  21          2HB       LEU  21  -2.581  -8.943   8.152
  164   2HB   LEU  21          1HB       LEU  21  -2.048  -7.561   9.093
  165    HG   LEU  21           HG       LEU  21  -0.294  -8.095   6.834
  166   1HD1  LEU  21          1HD1      LEU  21  -1.822  -8.570   5.296
  167   2HD1  LEU  21          2HD1      LEU  21  -2.383  -6.910   5.484
  168   3HD1  LEU  21          3HD1      LEU  21  -3.156  -8.211   6.389
  169   1HD2  LEU  21          1HD2      LEU  21  -1.618  -5.831   8.187
  170   2HD2  LEU  21          2HD2      LEU  21  -1.209  -5.606   6.486
  171   3HD2  LEU  21          3HD2      LEU  21   0.050  -6.018   7.650
  172    H    GLU  22           H        GLU  22  -1.837 -11.448   9.190
  173    HA   GLU  22           HA       GLU  22  -3.134 -11.182  11.703
  174   1HB   GLU  22          2HB       GLU  22  -3.574 -12.744   9.587
  175   2HB   GLU  22          1HB       GLU  22  -2.658 -13.877  10.573
  176   1HG   GLU  22          2HG       GLU  22  -4.292 -13.289  12.442
  177   2HG   GLU  22          1HG       GLU  22  -5.281 -12.563  11.175
  178    H    GLU  23           H        GLU  23  -0.036 -12.386  10.678
  179    HA   GLU  23           HA       GLU  23   0.487 -13.782  13.150
  180   1HB   GLU  23          2HB       GLU  23   1.537 -14.740  11.271
  181   2HB   GLU  23          1HB       GLU  23   2.087 -13.182  10.673
  182   1HG   GLU  23          2HG       GLU  23   3.979 -13.283  11.832
  183   2HG   GLU  23          1HG       GLU  23   3.157 -13.822  13.296
  184    H    GLU  24           H        GLU  24   1.220 -10.685  11.683
  185    HA   GLU  24           HA       GLU  24   3.053  -9.897  13.755
  186   1HB   GLU  24          2HB       GLU  24   1.834  -8.504  11.396
  187   2HB   GLU  24          1HB       GLU  24   2.748  -7.611  12.604
  188   1HG   GLU  24          2HG       GLU  24   3.792  -9.927  10.992
  189   2HG   GLU  24          1HG       GLU  24   4.110  -8.223  10.668
  190    H    GLY  25           H        GLY  25  -0.332  -9.360  12.977
  191   1HA   GLY  25          2HA       GLY  25  -1.997  -8.910  14.584
  192   2HA   GLY  25          1HA       GLY  25  -0.747  -8.356  15.685
  193    H    TYR  26           H        TYR  26  -1.590  -7.449  12.361
  194    HA   TYR  26           HA       TYR  26  -1.584  -4.635  13.197
  195   1HB   TYR  26          2HB       TYR  26  -1.096  -6.030  10.591
  196   2HB   TYR  26          1HB       TYR  26  -1.579  -4.344  10.599
  197    HD1  TYR  26           1HD      TYR  26   0.269  -3.124   9.972
  198    HD2  TYR  26           2HD      TYR  26   0.734  -6.210  12.860
  199    HE1  TYR  26           1HE      TYR  26   2.605  -2.443  10.306
  200    HE2  TYR  26           2HE      TYR  26   3.075  -5.539  13.204
  201    HH   TYR  26           HH       TYR  26   4.875  -4.230  11.583
  202    H    HIS  27           H        HIS  27  -2.982  -3.389  11.376
  203    HA   HIS  27           HA       HIS  27  -5.654  -4.603  11.277
  204   1HB   HIS  27          2HB       HIS  27  -4.971  -2.493  12.961
  205   2HB   HIS  27          1HB       HIS  27  -5.705  -1.695  11.576
  206    HD1  HIS  27           1HD      HIS  27  -6.957  -1.931  14.494
  207    HD2  HIS  27           2HD      HIS  27  -7.979  -4.215  11.177
  208    HE1  HIS  27           1HE      HIS  27  -9.292  -2.754  14.938
  209    HE2  HIS  27           2HE      HIS  27  -9.859  -4.196  12.952
  210    HA   PRO  28           HA       PRO  28  -4.352  -2.981   7.187
  211   1HB   PRO  28          2HB       PRO  28  -4.532  -5.252   5.785
  212   2HB   PRO  28          1HB       PRO  28  -3.134  -4.894   6.805
  213   1HG   PRO  28          2HG       PRO  28  -5.429  -6.723   7.308
  214   2HG   PRO  28          1HG       PRO  28  -3.727  -6.900   7.766
  215   1HD   PRO  28          2HD       PRO  28  -5.795  -6.019   9.431
  216   2HD   PRO  28          1HD       PRO  28  -4.060  -5.835   9.745
  217    H    ASP  29           H        ASP  29  -5.609  -2.244   5.587
  218    HA   ASP  29           HA       ASP  29  -8.359  -3.275   5.376
  219   1HB   ASP  29          2HB       ASP  29  -8.345  -1.067   6.480
  220   2HB   ASP  29          1HB       ASP  29  -7.464  -0.395   5.112
  221    H    THR  30           H        THR  30  -8.722  -4.114   3.420
  222    HA   THR  30           HA       THR  30  -6.925  -3.345   1.244
  223    HB   THR  30           HB       THR  30  -7.596  -5.412   0.155
  224    HG1  THR  30           1HG      THR  30  -9.679  -5.712   0.711
  225   1HG2  THR  30          1HG2      THR  30  -6.287  -6.733   1.381
  226   2HG2  THR  30          2HG2      THR  30  -7.280  -6.540   2.825
  227   3HG2  THR  30          3HG2      THR  30  -6.079  -5.317   2.412
  228    H    ALA  31           H        ALA  31  -7.592  -2.551  -0.669
  229    HA   ALA  31           HA       ALA  31 -10.426  -1.779  -0.863
  230   1HB   ALA  31          1HB       ALA  31  -9.815   0.220  -1.721
  231   2HB   ALA  31          2HB       ALA  31  -8.464  -0.462  -2.627
  232   3HB   ALA  31          3HB       ALA  31  -8.292  -0.129  -0.904
  233    H    LYS  32           H        LYS  32 -10.444  -1.120  -3.587
  234    HA   LYS  32           HA       LYS  32  -9.775  -3.650  -4.915
  235   1HB   LYS  32          2HB       LYS  32 -12.333  -2.416  -5.733
  236   2HB   LYS  32          1HB       LYS  32 -11.891  -4.111  -5.599
  237   1HG   LYS  32          2HG       LYS  32 -12.317  -4.150  -3.289
  238   2HG   LYS  32          1HG       LYS  32 -12.357  -2.390  -3.190
  239   1HD   LYS  32          2HD       LYS  32 -14.438  -2.276  -4.301
  240   2HD   LYS  32          1HD       LYS  32 -14.331  -3.955  -4.834
  241   1HE   LYS  32          2HE       LYS  32 -15.040  -4.773  -2.845
  242   2HE   LYS  32          1HE       LYS  32 -14.245  -3.501  -1.918
  243   1HZ   LYS  32          1HZ       LYS  32 -16.943  -3.637  -2.898
  244   2HZ   LYS  32          2HZ       LYS  32 -16.186  -2.165  -3.248
  245   3HZ   LYS  32          3HZ       LYS  32 -16.293  -2.701  -1.648
  246    H    THR  33           H        THR  33  -9.623  -0.311  -4.970
  247    HA   THR  33           HA       THR  33  -8.358  -0.254  -7.494
  248    HB   THR  33           HB       THR  33 -10.538   1.605  -7.844
  249    HG1  THR  33           1HG      THR  33 -11.967   0.303  -6.910
  250   1HG2  THR  33          1HG2      THR  33  -8.921   0.405  -9.528
  251   2HG2  THR  33          2HG2      THR  33 -10.550   0.890 -10.000
  252   3HG2  THR  33          3HG2      THR  33 -10.219  -0.788  -9.565
  253    H    LEU  34           H        LEU  34  -8.454   2.342  -8.186
  254    HA   LEU  34           HA       LEU  34  -7.078   3.595  -5.993
  255   1HB   LEU  34          2HB       LEU  34  -7.754   4.601  -8.761
  256   2HB   LEU  34          1HB       LEU  34  -6.751   5.462  -7.607
  257    HG   LEU  34           HG       LEU  34  -6.108   2.746  -8.759
  258   1HD1  LEU  34          1HD1      LEU  34  -4.166   4.440  -9.624
  259   2HD1  LEU  34          2HD1      LEU  34  -5.595   5.469  -9.709
  260   3HD1  LEU  34          3HD1      LEU  34  -5.561   3.934 -10.576
  261   1HD2  LEU  34          1HD2      LEU  34  -4.889   2.675  -6.862
  262   2HD2  LEU  34          2HD2      LEU  34  -4.917   4.424  -6.648
  263   3HD2  LEU  34          3HD2      LEU  34  -3.790   3.694  -7.791
  264    H    ARG  35           H        ARG  35 -10.228   3.759  -7.451
  265    HA   ARG  35           HA       ARG  35 -10.989   6.248  -6.257
  266   1HB   ARG  35          2HB       ARG  35 -12.029   4.801  -8.271
  267   2HB   ARG  35          1HB       ARG  35 -13.064   4.242  -6.964
  268   1HG   ARG  35          2HG       ARG  35 -12.645   7.167  -7.381
  269   2HG   ARG  35          1HG       ARG  35 -13.779   6.278  -8.399
  270   1HD   ARG  35          2HD       ARG  35 -13.927   5.953  -5.440
  271   2HD   ARG  35          1HD       ARG  35 -14.571   7.423  -6.170
  272    HE   ARG  35           HE       ARG  35 -15.658   5.382  -7.631
  273   1HH1  ARG  35          1HH1      ARG  35 -15.618   6.258  -4.254
  274   2HH1  ARG  35          2HH1      ARG  35 -17.164   5.552  -3.923
  275   1HH2  ARG  35          1HH2      ARG  35 -17.693   4.453  -7.199
  276   2HH2  ARG  35          2HH2      ARG  35 -18.344   4.529  -5.596
  277    H    GLU  36           H        GLU  36 -11.380   2.830  -5.475
  278    HA   GLU  36           HA       GLU  36 -12.984   3.212  -3.169
  279   1HB   GLU  36          2HB       GLU  36 -11.359   0.948  -4.270
  280   2HB   GLU  36          1HB       GLU  36 -11.958   0.848  -2.620
  281   1HG   GLU  36          2HG       GLU  36 -14.072   1.679  -4.360
  282   2HG   GLU  36          1HG       GLU  36 -13.310   0.221  -4.996
  283    H    ALA  37           H        ALA  37  -9.522   3.155  -3.759
  284    HA   ALA  37           HA       ALA  37  -8.785   3.068  -0.995
  285   1HB   ALA  37          1HB       ALA  37  -6.903   4.229  -2.965
  286   2HB   ALA  37          2HB       ALA  37  -7.420   2.565  -3.243
  287   3HB   ALA  37          3HB       ALA  37  -6.635   3.003  -1.725
  288    H    GLU  38           H        GLU  38  -8.796   5.665  -3.444
  289    HA   GLU  38           HA       GLU  38  -7.941   7.775  -1.931
  290   1HB   GLU  38          2HB       GLU  38 -10.010   7.629  -4.100
  291   2HB   GLU  38          1HB       GLU  38  -9.602   9.158  -3.334
  292   1HG   GLU  38          2HG       GLU  38  -7.318   8.969  -4.052
  293   2HG   GLU  38          1HG       GLU  38  -7.619   7.357  -4.700
  294    H    LYS  39           H        LYS  39 -11.234   6.468  -2.084
  295    HA   LYS  39           HA       LYS  39 -12.420   8.334  -0.352
  296   1HB   LYS  39          2HB       LYS  39 -13.698   6.748  -1.755
  297   2HB   LYS  39          1HB       LYS  39 -13.141   5.422  -0.743
  298   1HG   LYS  39          2HG       LYS  39 -14.497   7.654   0.636
  299   2HG   LYS  39          1HG       LYS  39 -15.494   6.637  -0.407
  300   1HD   LYS  39          2HD       LYS  39 -14.880   4.671   0.811
  301   2HD   LYS  39          1HD       LYS  39 -13.669   5.560   1.737
  302   1HE   LYS  39          2HE       LYS  39 -15.340   5.598   3.270
  303   2HE   LYS  39          1HE       LYS  39 -15.811   7.026   2.348
  304   1HZ   LYS  39          1HZ       LYS  39 -17.066   5.112   0.988
  305   2HZ   LYS  39          2HZ       LYS  39 -17.773   5.961   2.269
  306   3HZ   LYS  39          3HZ       LYS  39 -17.100   4.432   2.537
  307    H    LYS  40           H        LYS  40 -11.121   5.084   0.304
  308    HA   LYS  40           HA       LYS  40 -11.438   5.172   3.091
  309   1HB   LYS  40          2HB       LYS  40  -9.583   3.602   1.320
  310   2HB   LYS  40          1HB       LYS  40  -9.625   3.390   3.064
  311   1HG   LYS  40          2HG       LYS  40 -12.285   3.261   2.012
  312   2HG   LYS  40          1HG       LYS  40 -11.234   2.145   1.138
  313   1HD   LYS  40          2HD       LYS  40 -10.744   0.916   3.036
  314   2HD   LYS  40          1HD       LYS  40 -11.135   2.249   4.124
  315   1HE   LYS  40          2HE       LYS  40 -12.881   0.674   4.359
  316   2HE   LYS  40          1HE       LYS  40 -13.533   1.988   3.380
  317   1HZ   LYS  40          1HZ       LYS  40 -13.678  -0.620   2.741
  318   2HZ   LYS  40          2HZ       LYS  40 -12.319  -0.141   1.856
  319   3HZ   LYS  40          3HZ       LYS  40 -13.798   0.647   1.627
  320    H    ILE  41           H        ILE  41  -9.072   6.615   1.016
  321    HA   ILE  41           HA       ILE  41  -7.261   7.126   3.256
  322    HB   ILE  41           HB       ILE  41  -6.945   7.834   0.342
  323   1HG1  ILE  41          2HG1      ILE  41  -5.214   5.781   1.550
  324   2HG1  ILE  41          1HG1      ILE  41  -6.907   5.321   1.415
  325   1HG2  ILE  41          1HG2      ILE  41  -5.340   8.375   2.750
  326   2HG2  ILE  41          2HG2      ILE  41  -5.417   9.242   1.216
  327   3HG2  ILE  41          3HG2      ILE  41  -4.443   7.778   1.354
  328   1HD1  ILE  41          1HD1      ILE  41  -6.175   4.592  -0.595
  329   2HD1  ILE  41          2HD1      ILE  41  -4.893   5.799  -0.693
  330   3HD1  ILE  41          3HD1      ILE  41  -6.561   6.253  -1.043
  331    H    LYS  42           H        LYS  42  -9.827   8.648   1.615
  332    HA   LYS  42           HA       LYS  42  -8.940  11.350   2.005
  333   1HB   LYS  42          2HB       LYS  42 -11.003  10.064   0.574
  334   2HB   LYS  42          1HB       LYS  42 -11.765  11.202   1.674
  335   1HG   LYS  42          2HG       LYS  42  -9.493  11.994  -0.115
  336   2HG   LYS  42          1HG       LYS  42 -11.175  12.045  -0.644
  337   1HD   LYS  42          2HD       LYS  42 -11.732  13.717   0.871
  338   2HD   LYS  42          1HD       LYS  42 -10.346  13.373   1.908
  339   1HE   LYS  42          2HE       LYS  42  -8.892  14.553   0.587
  340   2HE   LYS  42          1HE       LYS  42  -9.839  14.289  -0.877
  341   1HZ   LYS  42          1HZ       LYS  42 -10.075  16.376   1.135
  342   2HZ   LYS  42          2HZ       LYS  42 -11.530  15.776   0.517
  343   3HZ   LYS  42          3HZ       LYS  42 -10.376  16.435  -0.529
  344    H    GLU  43           H        GLU  43 -10.030   9.032   4.115
  345    HA   GLU  43           HA       GLU  43 -10.814  11.087   6.047
  346   1HB   GLU  43          2HB       GLU  43 -12.256   8.446   5.799
  347   2HB   GLU  43          1HB       GLU  43 -12.665   9.788   6.859
  348   1HG   GLU  43          2HG       GLU  43 -13.508  11.071   5.124
  349   2HG   GLU  43          1HG       GLU  43 -12.643  10.151   3.893
  350    H    LEU  44           H        LEU  44 -10.018   7.649   5.618
  351    HA   LEU  44           HA       LEU  44  -9.094   7.361   8.316
  352   1HB   LEU  44          2HB       LEU  44  -9.755   5.645   6.175
  353   2HB   LEU  44          1HB       LEU  44  -8.076   5.323   6.565
  354    HG   LEU  44           HG       LEU  44  -9.574   3.819   7.769
  355   1HD1  LEU  44          1HD1      LEU  44  -7.567   4.187   8.909
  356   2HD1  LEU  44          2HD1      LEU  44  -8.816   4.448  10.126
  357   3HD1  LEU  44          3HD1      LEU  44  -8.023   5.828   9.367
  358   1HD2  LEU  44          1HD2      LEU  44 -11.579   4.968   8.030
  359   2HD2  LEU  44          2HD2      LEU  44 -10.787   6.391   8.708
  360   3HD2  LEU  44          3HD2      LEU  44 -10.921   4.916   9.666
  361    H    PHE  45           H        PHE  45  -7.239   8.142   9.036
  362    HA   PHE  45           HA       PHE  45  -5.154   9.004   7.272
  363   1HB   PHE  45          2HB       PHE  45  -5.784  10.062   9.508
  364   2HB   PHE  45          1HB       PHE  45  -4.941   8.716  10.269
  365    HD1  PHE  45           1HD      PHE  45  -4.406  11.370   7.708
  366    HD2  PHE  45           2HD      PHE  45  -2.701   8.936  10.755
  367    HE1  PHE  45           1HE      PHE  45  -2.277  12.582   7.480
  368    HE2  PHE  45           2HE      PHE  45  -0.570  10.145  10.534
  369    HZ   PHE  45           HZ       PHE  45  -0.355  11.971   8.895
  370    H    PHE  46           H        PHE  46  -5.145   6.665   6.393
  371    HA   PHE  46           HA       PHE  46  -3.987   4.563   7.802
  372   1HB   PHE  46          2HB       PHE  46  -4.240   5.244   4.905
  373   2HB   PHE  46          1HB       PHE  46  -3.204   3.899   5.375
  374    HD1  PHE  46           1HD      PHE  46  -6.461   4.832   4.488
  375    HD2  PHE  46           2HD      PHE  46  -4.311   2.184   7.033
  376    HE1  PHE  46           1HE      PHE  46  -8.432   3.365   4.622
  377    HE2  PHE  46           2HE      PHE  46  -6.278   0.711   7.170
  378    HZ   PHE  46           HZ       PHE  46  -8.342   1.302   5.963
  379    HA   PRO  47           HA       PRO  47   0.155   6.188   8.315
  380   1HB   PRO  47          2HB       PRO  47   0.891   3.500   9.184
  381   2HB   PRO  47          1HB       PRO  47   0.871   5.003  10.105
  382   1HG   PRO  47          2HG       PRO  47  -0.895   2.959  10.486
  383   2HG   PRO  47          1HG       PRO  47  -1.245   4.651  10.868
  384   1HD   PRO  47          2HD       PRO  47  -2.158   2.995   8.577
  385   2HD   PRO  47          1HD       PRO  47  -2.978   4.328   9.410
  386    H    VAL  48           H        VAL  48  -0.212   2.847   7.124
  387    HA   VAL  48           HA       VAL  48   1.917   3.399   5.166
  388    HB   VAL  48           HB       VAL  48   1.129   0.712   6.283
  389   1HG1  VAL  48          1HG1      VAL  48   2.918   1.585   4.145
  390   2HG1  VAL  48          2HG1      VAL  48   2.209   0.000   4.458
  391   3HG1  VAL  48          3HG1      VAL  48   3.671   0.494   5.310
  392   1HG2  VAL  48          1HG2      VAL  48   2.071   1.902   8.085
  393   2HG2  VAL  48          2HG2      VAL  48   3.322   2.608   7.063
  394   3HG2  VAL  48          3HG2      VAL  48   3.365   0.887   7.447
  395    H    ILE  49           H        ILE  49   1.391   3.316   3.089
  396    HA   ILE  49           HA       ILE  49  -1.150   2.017   2.343
  397    HB   ILE  49           HB       ILE  49   0.212   4.164   0.730
  398   1HG1  ILE  49          2HG1      ILE  49  -0.248   5.108   2.935
  399   2HG1  ILE  49          1HG1      ILE  49  -1.359   5.775   1.743
  400   1HG2  ILE  49          1HG2      ILE  49  -2.317   2.660   0.597
  401   2HG2  ILE  49          2HG2      ILE  49  -1.338   3.357  -0.694
  402   3HG2  ILE  49          3HG2      ILE  49  -2.426   4.384   0.239
  403   1HD1  ILE  49          1HD1      ILE  49  -2.306   5.116   4.007
  404   2HD1  ILE  49          2HD1      ILE  49  -2.113   3.448   3.470
  405   3HD1  ILE  49          3HD1      ILE  49  -3.162   4.546   2.574
  406    H    VAL  50           H        VAL  50  -1.072   0.349   0.985
  407    HA   VAL  50           HA       VAL  50   1.361  -0.031  -0.637
  408    HB   VAL  50           HB       VAL  50  -0.255  -2.196   0.719
  409   1HG1  VAL  50          1HG1      VAL  50   2.260  -3.090  -0.299
  410   2HG1  VAL  50          2HG1      VAL  50   1.354  -2.321  -1.601
  411   3HG1  VAL  50          3HG1      VAL  50   0.640  -3.656  -0.698
  412   1HG2  VAL  50          1HG2      VAL  50   2.461  -2.271   1.462
  413   2HG2  VAL  50          2HG2      VAL  50   1.071  -1.869   2.468
  414   3HG2  VAL  50          3HG2      VAL  50   1.939  -0.594   1.614
  415    H    LEU  51           H        LEU  51   0.750   0.453  -2.638
  416    HA   LEU  51           HA       LEU  51  -1.895  -0.324  -3.591
  417   1HB   LEU  51          2HB       LEU  51  -1.265   1.922  -4.113
  418   2HB   LEU  51          1HB       LEU  51   0.271   1.402  -4.778
  419    HG   LEU  51           HG       LEU  51  -1.357   0.073  -6.443
  420   1HD1  LEU  51          1HD1      LEU  51  -3.235   1.606  -7.033
  421   2HD1  LEU  51          2HD1      LEU  51  -2.938   2.459  -5.518
  422   3HD1  LEU  51          3HD1      LEU  51  -3.427   0.765  -5.495
  423   1HD2  LEU  51          1HD2      LEU  51   0.403   1.607  -7.113
  424   2HD2  LEU  51          2HD2      LEU  51  -0.618   2.983  -6.696
  425   3HD2  LEU  51          3HD2      LEU  51  -1.075   1.915  -8.023
  426    H    ASP  52           H        ASP  52  -2.284  -1.626  -5.320
  427    HA   ASP  52           HA       ASP  52  -0.050  -3.333  -6.186
  428   1HB   ASP  52          2HB       ASP  52  -2.163  -4.273  -4.916
  429   2HB   ASP  52          1HB       ASP  52  -2.919  -4.144  -6.501
  430    H    VAL  53           H        VAL  53  -0.774  -4.381  -8.469
  431    HA   VAL  53           HA       VAL  53  -2.069  -2.401 -10.148
  432    HB   VAL  53           HB       VAL  53  -0.252  -2.013 -11.636
  433   1HG1  VAL  53          1HG1      VAL  53  -0.307  -0.672  -9.571
  434   2HG1  VAL  53          2HG1      VAL  53   1.321  -0.849 -10.225
  435   3HG1  VAL  53          3HG1      VAL  53   0.823  -1.805  -8.830
  436   1HG2  VAL  53          1HG2      VAL  53   1.752  -3.135 -11.728
  437   2HG2  VAL  53          2HG2      VAL  53   0.691  -4.436 -11.199
  438   3HG2  VAL  53          3HG2      VAL  53   1.699  -3.591 -10.029
  439    H    TRP  54           H        TRP  54  -2.947  -4.925  -9.499
  440    HA   TRP  54           HA       TRP  54  -2.272  -7.052 -11.108
  441   1HB   TRP  54          2HB       TRP  54  -3.857  -7.383  -9.363
  442   2HB   TRP  54          1HB       TRP  54  -4.951  -6.176 -10.027
  443    HD1  TRP  54           HD       TRP  54  -6.912  -7.118 -11.375
  444    HE1  TRP  54           1HE      TRP  54  -7.454  -9.360 -12.519
  445    HE3  TRP  54           3HE      TRP  54  -2.450  -9.495 -10.648
  446    HZ2  TRP  54           2HZ      TRP  54  -6.158 -11.814 -13.043
  447    HZ3  TRP  54           3HZ      TRP  54  -2.180 -11.790 -11.500
  448    HH2  TRP  54           HH       TRP  54  -3.998 -12.924 -12.672
  449    H    MET  55           H        MET  55  -5.383  -5.618 -11.899
  450    HA   MET  55           HA       MET  55  -4.503  -4.906 -14.575
  451   1HB   MET  55          2HB       MET  55  -5.193  -7.421 -14.411
  452   2HB   MET  55          1HB       MET  55  -6.831  -6.784 -14.369
  453   1HG   MET  55          2HG       MET  55  -6.428  -5.643 -16.502
  454   2HG   MET  55          1HG       MET  55  -4.805  -6.328 -16.547
  455   1HE   MET  55          1HE       MET  55  -8.417  -6.662 -17.411
  456   2HE   MET  55          2HE       MET  55  -8.573  -7.635 -15.948
  457   3HE   MET  55          3HE       MET  55  -8.751  -8.390 -17.532
  458    HA   PRO  56           HA       PRO  56  -8.154  -2.521 -12.739
  459   1HB   PRO  56          2HB       PRO  56  -6.911  -0.260 -11.975
  460   2HB   PRO  56          1HB       PRO  56  -7.009  -1.675 -10.919
  461   1HG   PRO  56          2HG       PRO  56  -4.739  -0.746 -12.635
  462   2HG   PRO  56          1HG       PRO  56  -4.704  -1.366 -10.975
  463   1HD   PRO  56          2HD       PRO  56  -4.095  -2.884 -13.162
  464   2HD   PRO  56          1HD       PRO  56  -4.764  -3.554 -11.661
  465    H    ASP  57           H        ASP  57  -8.408   0.088 -13.252
  466    HA   ASP  57           HA       ASP  57  -7.415   0.645 -15.936
  467   1HB   ASP  57          2HB       ASP  57 -10.370   0.607 -15.286
  468   2HB   ASP  57          1HB       ASP  57  -9.652   1.093 -16.820
  469    H    GLY  58           H        GLY  58  -6.762   1.858 -13.489
  470   1HA   GLY  58          2HA       GLY  58  -7.791   4.564 -14.002
  471   2HA   GLY  58          1HA       GLY  58  -7.825   3.932 -12.363
  472    H    ASP  59           H        ASP  59  -5.185   2.996 -14.377
  473    HA   ASP  59           HA       ASP  59  -2.957   3.450 -14.309
  474   1HB   ASP  59          2HB       ASP  59  -3.695   6.203 -13.310
  475   2HB   ASP  59          1HB       ASP  59  -2.260   5.732 -14.215
  476    H    GLY  60           H        GLY  60  -1.499   5.133 -12.501
  477   1HA   GLY  60          2HA       GLY  60  -2.231   4.509  -9.806
  478   2HA   GLY  60          1HA       GLY  60  -0.978   3.437 -10.405
  479    H    VAL  61           H        VAL  61   0.402   5.328 -12.029
  480    HA   VAL  61           HA       VAL  61   2.188   6.421 -10.204
  481    HB   VAL  61           HB       VAL  61   1.682   7.396 -13.020
  482   1HG1  VAL  61          1HG1      VAL  61   4.328   7.361 -11.645
  483   2HG1  VAL  61          2HG1      VAL  61   3.192   8.675 -11.343
  484   3HG1  VAL  61          3HG1      VAL  61   3.769   8.368 -12.980
  485   1HG2  VAL  61          1HG2      VAL  61   3.871   5.501 -12.553
  486   2HG2  VAL  61          2HG2      VAL  61   2.708   5.589 -13.874
  487   3HG2  VAL  61          3HG2      VAL  61   2.258   4.823 -12.351
  488    H    ASN  62           H        ASN  62  -0.552   7.892 -11.888
  489    HA   ASN  62           HA       ASN  62  -0.129  10.516 -10.916
  490   1HB   ASN  62          2HB       ASN  62  -1.745  10.975 -12.394
  491   2HB   ASN  62          1HB       ASN  62  -1.851   9.256 -12.737
  492   1HD2  ASN  62          1HD2      ASN  62  -3.669   8.209 -12.257
  493   2HD2  ASN  62          2HD2      ASN  62  -5.004   8.879 -11.389
  494    H    PHE  63           H        PHE  63  -1.432   7.675  -9.501
  495    HA   PHE  63           HA       PHE  63  -3.045   9.022  -7.533
  496   1HB   PHE  63          2HB       PHE  63  -3.684   6.793  -8.265
  497   2HB   PHE  63          1HB       PHE  63  -2.134   6.145  -7.742
  498    HD1  PHE  63           1HD      PHE  63  -4.741   8.315  -6.181
  499    HD2  PHE  63           2HD      PHE  63  -2.327   4.822  -5.884
  500    HE1  PHE  63           1HE      PHE  63  -5.685   7.856  -3.957
  501    HE2  PHE  63           2HE      PHE  63  -3.270   4.357  -3.659
  502    HZ   PHE  63           HZ       PHE  63  -4.952   5.875  -2.694
  503    H    ILE  64           H        ILE  64   0.205   7.720  -7.732
  504    HA   ILE  64           HA       ILE  64   0.957   7.490  -5.109
  505    HB   ILE  64           HB       ILE  64   2.781   8.900  -7.036
  506   1HG1  ILE  64          2HG1      ILE  64   1.941   7.170  -8.422
  507   2HG1  ILE  64          1HG1      ILE  64   3.459   6.559  -7.786
  508   1HG2  ILE  64          1HG2      ILE  64   4.511   7.961  -5.822
  509   2HG2  ILE  64          2HG2      ILE  64   3.497   6.671  -5.177
  510   3HG2  ILE  64          3HG2      ILE  64   3.315   8.318  -4.576
  511   1HD1  ILE  64          1HD1      ILE  64   0.753   5.876  -6.672
  512   2HD1  ILE  64          2HD1      ILE  64   2.304   5.166  -6.222
  513   3HD1  ILE  64          3HD1      ILE  64   1.643   4.891  -7.834
  514    H    ASP  65           H        ASP  65   0.297  10.418  -6.881
  515    HA   ASP  65           HA       ASP  65   1.495  12.179  -4.967
  516   1HB   ASP  65          2HB       ASP  65   0.283  12.413  -7.551
  517   2HB   ASP  65          1HB       ASP  65  -0.498  13.555  -6.463
  518    H    PHE  66           H        PHE  66  -1.873  11.200  -5.689
  519    HA   PHE  66           HA       PHE  66  -3.216  12.771  -3.884
  520   1HB   PHE  66          2HB       PHE  66  -4.405  11.371  -5.444
  521   2HB   PHE  66          1HB       PHE  66  -3.734   9.912  -4.726
  522    HD1  PHE  66           1HD      PHE  66  -4.395   9.352  -2.337
  523    HD2  PHE  66           2HD      PHE  66  -6.427  12.248  -4.700
  524    HE1  PHE  66           1HE      PHE  66  -6.353   9.178  -0.860
  525    HE2  PHE  66           2HE      PHE  66  -8.391  12.078  -3.227
  526    HZ   PHE  66           HZ       PHE  66  -8.355  10.541  -1.303
  527    H    ILE  67           H        ILE  67  -1.556   9.697  -3.293
  528    HA   ILE  67           HA       ILE  67  -2.330   9.357  -0.618
  529    HB   ILE  67           HB       ILE  67   0.193   8.460  -2.026
  530   1HG1  ILE  67          2HG1      ILE  67  -1.303   6.233  -1.575
  531   2HG1  ILE  67          1HG1      ILE  67  -2.567   7.435  -1.818
  532   1HG2  ILE  67          1HG2      ILE  67   0.820   8.291   0.192
  533   2HG2  ILE  67          2HG2      ILE  67   0.106   6.706  -0.105
  534   3HG2  ILE  67          3HG2      ILE  67  -0.820   7.946   0.739
  535   1HD1  ILE  67          1HD1      ILE  67  -0.565   7.740  -3.831
  536   2HD1  ILE  67          2HD1      ILE  67  -2.275   7.346  -4.004
  537   3HD1  ILE  67          3HD1      ILE  67  -1.093   6.059  -3.761
  538    H    LYS  68           H        LYS  68   0.448  11.031  -2.053
  539    HA   LYS  68           HA       LYS  68   1.456  11.856   0.515
  540   1HB   LYS  68          2HB       LYS  68   3.275  12.754  -0.629
  541   2HB   LYS  68          1HB       LYS  68   2.810  11.386  -1.628
  542   1HG   LYS  68          2HG       LYS  68   2.666  12.730  -3.366
  543   2HG   LYS  68          1HG       LYS  68   1.366  13.612  -2.568
  544   1HD   LYS  68          2HD       LYS  68   2.797  15.236  -1.743
  545   2HD   LYS  68          1HD       LYS  68   4.215  14.193  -1.875
  546   1HE   LYS  68          2HE       LYS  68   4.589  14.766  -4.018
  547   2HE   LYS  68          1HE       LYS  68   2.872  14.766  -4.421
  548   1HZ   LYS  68          1HZ       LYS  68   3.221  16.971  -4.555
  549   2HZ   LYS  68          2HZ       LYS  68   4.569  16.951  -3.532
  550   3HZ   LYS  68          3HZ       LYS  68   3.010  16.922  -2.878
  551    H    GLU  69           H        GLU  69  -0.868  12.995  -1.692
  552    HA   GLU  69           HA       GLU  69  -0.685  15.777  -1.159
  553   1HB   GLU  69          2HB       GLU  69  -1.788  14.719  -3.159
  554   2HB   GLU  69          1HB       GLU  69  -3.110  14.263  -2.098
  555   1HG   GLU  69          2HG       GLU  69  -3.693  16.518  -1.694
  556   2HG   GLU  69          1HG       GLU  69  -2.208  17.104  -2.443
  557    H    ASN  70           H        ASN  70  -2.758  13.189   0.068
  558    HA   ASN  70           HA       ASN  70  -3.614  14.984   2.238
  559   1HB   ASN  70          2HB       ASN  70  -5.364  12.856   2.317
  560   2HB   ASN  70          1HB       ASN  70  -5.677  14.407   1.545
  561   1HD2  ASN  70          1HD2      ASN  70  -4.619  14.498  -0.743
  562   2HD2  ASN  70          2HD2      ASN  70  -4.952  13.139  -1.752
  563    H    SER  71           H        SER  71  -1.346  12.791   1.756
  564    HA   SER  71           HA       SER  71  -1.298  11.993   4.530
  565   1HB   SER  71          2HB       SER  71  -2.139  10.156   2.430
  566   2HB   SER  71          1HB       SER  71  -0.729   9.559   3.303
  567    HG   SER  71           HG       SER  71  -2.541   8.890   4.402
  568    HA   PRO  72           HA       PRO  72   2.812  12.731   2.449
  569   1HB   PRO  72          2HB       PRO  72   3.240  14.872   4.356
  570   2HB   PRO  72          1HB       PRO  72   3.194  14.957   2.594
  571   1HG   PRO  72          2HG       PRO  72   1.283  16.047   4.208
  572   2HG   PRO  72          1HG       PRO  72   0.972  15.497   2.553
  573   1HD   PRO  72          2HD       PRO  72   0.374  14.136   5.149
  574   2HD   PRO  72          1HD       PRO  72  -0.600  14.217   3.666
  575    H    ASP  73           H        ASP  73   1.645  12.223   5.602
  576    HA   ASP  73           HA       ASP  73   4.292  11.592   6.662
  577   1HB   ASP  73          2HB       ASP  73   2.662  12.975   7.995
  578   2HB   ASP  73          1HB       ASP  73   1.665  11.530   8.140
  579    H    SER  74           H        SER  74   1.760  10.062   5.114
  580    HA   SER  74           HA       SER  74   1.917   7.534   6.484
  581   1HB   SER  74          2HB       SER  74  -0.174   8.244   5.403
  582   2HB   SER  74          1HB       SER  74   0.637   8.253   3.837
  583    HG   SER  74           HG       SER  74  -0.634   6.279   4.701
  584    H    VAL  75           H        VAL  75   2.061   5.615   4.630
  585    HA   VAL  75           HA       VAL  75   4.682   6.031   3.349
  586    HB   VAL  75           HB       VAL  75   3.681   3.418   4.494
  587   1HG1  VAL  75          1HG1      VAL  75   6.178   4.278   3.091
  588   2HG1  VAL  75          2HG1      VAL  75   5.191   2.838   2.840
  589   3HG1  VAL  75          3HG1      VAL  75   6.230   2.959   4.260
  590   1HG2  VAL  75          1HG2      VAL  75   4.296   5.399   6.093
  591   2HG2  VAL  75          2HG2      VAL  75   5.951   4.962   5.664
  592   3HG2  VAL  75          3HG2      VAL  75   4.891   3.771   6.419
  593    H    VAL  76           H        VAL  76   5.109   4.751   1.479
  594    HA   VAL  76           HA       VAL  76   2.789   3.609   0.112
  595    HB   VAL  76           HB       VAL  76   4.480   5.396  -1.553
  596   1HG1  VAL  76          1HG1      VAL  76   2.404   3.825  -2.123
  597   2HG1  VAL  76          2HG1      VAL  76   2.742   5.316  -3.002
  598   3HG1  VAL  76          3HG1      VAL  76   1.530   5.304  -1.721
  599   1HG2  VAL  76          1HG2      VAL  76   2.249   6.457   0.177
  600   2HG2  VAL  76          2HG2      VAL  76   3.163   7.361  -1.031
  601   3HG2  VAL  76          3HG2      VAL  76   3.966   6.774   0.426
  602    H    ILE  77           H        ILE  77   3.782   1.598   0.309
  603    HA   ILE  77           HA       ILE  77   6.449   1.167  -0.698
  604    HB   ILE  77           HB       ILE  77   4.410  -0.942   0.002
  605   1HG1  ILE  77          2HG1      ILE  77   4.712   0.664   1.869
  606   2HG1  ILE  77          1HG1      ILE  77   5.319  -0.942   2.255
  607   1HG2  ILE  77          1HG2      ILE  77   6.151  -2.020  -1.070
  608   2HG2  ILE  77          2HG2      ILE  77   6.638  -2.119   0.622
  609   3HG2  ILE  77          3HG2      ILE  77   7.365  -0.910  -0.435
  610   1HD1  ILE  77          1HD1      ILE  77   7.530   0.325   1.229
  611   2HD1  ILE  77          2HD1      ILE  77   7.160   0.094   2.938
  612   3HD1  ILE  77          3HD1      ILE  77   6.712   1.599   2.134
  613    H    VAL  78           H        VAL  78   3.150   0.346  -1.733
  614    HA   VAL  78           HA       VAL  78   2.299  -0.342  -3.735
  615    HB   VAL  78           HB       VAL  78   4.687   1.155  -4.843
  616   1HG1  VAL  78          1HG1      VAL  78   2.070   0.435  -6.166
  617   2HG1  VAL  78          2HG1      VAL  78   3.617  -0.350  -6.477
  618   3HG1  VAL  78          3HG1      VAL  78   3.393   1.349  -6.889
  619   1HG2  VAL  78          1HG2      VAL  78   2.092   2.014  -3.720
  620   2HG2  VAL  78          2HG2      VAL  78   2.612   2.814  -5.204
  621   3HG2  VAL  78          3HG2      VAL  78   3.643   2.853  -3.774
  622    H    ILE  79           H        ILE  79   2.448  -2.527  -3.801
  623    HA   ILE  79           HA       ILE  79   4.828  -3.654  -5.117
  624    HB   ILE  79           HB       ILE  79   3.386  -5.152  -2.952
  625   1HG1  ILE  79          2HG1      ILE  79   5.892  -3.519  -2.552
  626   2HG1  ILE  79          1HG1      ILE  79   4.288  -2.976  -2.072
  627   1HG2  ILE  79          1HG2      ILE  79   5.499  -6.407  -2.861
  628   2HG2  ILE  79          2HG2      ILE  79   6.134  -5.404  -4.164
  629   3HG2  ILE  79          3HG2      ILE  79   4.754  -6.462  -4.459
  630   1HD1  ILE  79          1HD1      ILE  79   4.100  -4.636  -0.432
  631   2HD1  ILE  79          2HD1      ILE  79   5.740  -4.006  -0.277
  632   3HD1  ILE  79          3HD1      ILE  79   5.462  -5.549  -1.083
  633    H    THR  80           H        THR  80   4.488  -5.391  -6.474
  634    HA   THR  80           HA       THR  80   2.002  -6.756  -6.685
  635    HB   THR  80           HB       THR  80   2.640  -4.906  -8.986
  636    HG1  THR  80           1HG      THR  80   1.663  -3.430  -7.897
  637   1HG2  THR  80          1HG2      THR  80   0.277  -6.657  -8.374
  638   2HG2  THR  80          2HG2      THR  80   1.390  -6.784  -9.735
  639   3HG2  THR  80          3HG2      THR  80   0.290  -5.413  -9.622
  640    H    GLY  81           H        GLY  81   1.982  -8.275  -8.552
  641   1HA   GLY  81          2HA       GLY  81   4.744  -8.964  -9.348
  642   2HA   GLY  81          1HA       GLY  81   3.543 -10.171  -8.913
  643    H    HIS  82           H        HIS  82   2.911  -7.321 -10.870
  644    HA   HIS  82           HA       HIS  82   3.028  -8.789 -13.351
  645   1HB   HIS  82          2HB       HIS  82   0.483  -8.334 -11.927
  646   2HB   HIS  82          1HB       HIS  82   0.475  -7.893 -13.630
  647    HD1  HIS  82           1HD      HIS  82   1.810 -10.030 -15.075
  648    HD2  HIS  82           2HD      HIS  82  -0.436 -10.850 -11.676
  649    HE1  HIS  82           1HE      HIS  82   1.196 -12.463 -15.246
  650    HE2  HIS  82           2HE      HIS  82  -0.242 -12.911 -13.225
  651    H    GLY  83           H        GLY  83   4.280  -7.282 -14.317
  652   1HA   GLY  83          2HA       GLY  83   3.243  -5.054 -15.533
  653   2HA   GLY  83          1HA       GLY  83   3.851  -4.468 -13.992
  654    H    SER  84           H        SER  84   5.917  -3.873 -13.898
  655    HA   SER  84           HA       SER  84   8.035  -5.181 -15.214
  656   1HB   SER  84          2HB       SER  84   7.006  -4.150 -17.220
  657   2HB   SER  84          1HB       SER  84   7.208  -2.560 -16.484
  658    HG   SER  84           HG       SER  84   9.202  -4.364 -17.355
  659    H    VAL  85           H        VAL  85  10.091  -4.223 -14.774
  660    HA   VAL  85           HA       VAL  85  10.304  -3.022 -12.266
  661    HB   VAL  85           HB       VAL  85  12.131  -4.295 -13.302
  662   1HG1  VAL  85          1HG1      VAL  85  12.238  -1.945 -15.173
  663   2HG1  VAL  85          2HG1      VAL  85  12.073  -3.656 -15.568
  664   3HG1  VAL  85          3HG1      VAL  85  13.603  -3.039 -14.944
  665   1HG2  VAL  85          1HG2      VAL  85  13.438  -1.683 -12.929
  666   2HG2  VAL  85          2HG2      VAL  85  13.707  -3.218 -12.102
  667   3HG2  VAL  85          3HG2      VAL  85  12.358  -2.185 -11.628
  668    H    ASP  86           H        ASP  86   9.889  -1.615 -15.412
  669    HA   ASP  86           HA       ASP  86  10.824   0.993 -14.791
  670   1HB   ASP  86          2HB       ASP  86   8.815   0.174 -16.902
  671   2HB   ASP  86          1HB       ASP  86   9.733   1.677 -16.858
  672    H    THR  87           H        THR  87   8.050  -0.693 -13.808
  673    HA   THR  87           HA       THR  87   6.360   1.644 -13.561
  674    HB   THR  87           HB       THR  87   5.666  -0.888 -13.886
  675    HG1  THR  87           1HG      THR  87   4.232   0.767 -12.091
  676   1HG2  THR  87          1HG2      THR  87   6.745  -1.497 -11.634
  677   2HG2  THR  87          2HG2      THR  87   5.135  -2.119 -11.996
  678   3HG2  THR  87          3HG2      THR  87   5.325  -0.735 -10.919
  679    H    ALA  88           H        ALA  88   8.463  -0.311 -11.569
  680    HA   ALA  88           HA       ALA  88   7.781   0.673  -9.040
  681   1HB   ALA  88          1HB       ALA  88  10.205   0.082  -8.494
  682   2HB   ALA  88          2HB       ALA  88  10.337  -0.426 -10.176
  683   3HB   ALA  88          3HB       ALA  88   9.182  -1.218  -9.105
  684    H    VAL  89           H        VAL  89  10.438   1.643 -11.175
  685    HA   VAL  89           HA       VAL  89  11.274   3.864  -9.708
  686    HB   VAL  89           HB       VAL  89  12.440   4.594 -11.707
  687   1HG1  VAL  89          1HG1      VAL  89  12.955   2.346 -10.398
  688   2HG1  VAL  89          2HG1      VAL  89  13.902   2.848 -11.799
  689   3HG1  VAL  89          3HG1      VAL  89  12.626   1.644 -11.983
  690   1HG2  VAL  89          1HG2      VAL  89  11.996   2.914 -13.751
  691   2HG2  VAL  89          2HG2      VAL  89  11.161   4.457 -13.573
  692   3HG2  VAL  89          3HG2      VAL  89  10.375   2.966 -13.057
  693    H    LYS  90           H        LYS  90   8.563   3.438 -11.824
  694    HA   LYS  90           HA       LYS  90   8.114   6.299 -12.114
  695   1HB   LYS  90          2HB       LYS  90   7.676   4.631 -13.959
  696   2HB   LYS  90          1HB       LYS  90   6.321   4.046 -13.006
  697   1HG   LYS  90          2HG       LYS  90   5.432   6.411 -13.054
  698   2HG   LYS  90          1HG       LYS  90   6.669   6.749 -14.264
  699   1HD   LYS  90          2HD       LYS  90   4.841   4.414 -14.629
  700   2HD   LYS  90          1HD       LYS  90   4.268   6.040 -15.006
  701   1HE   LYS  90          2HE       LYS  90   6.702   6.013 -16.232
  702   2HE   LYS  90          1HE       LYS  90   6.190   4.336 -16.422
  703   1HZ   LYS  90          1HZ       LYS  90   5.492   6.286 -18.088
  704   2HZ   LYS  90          2HZ       LYS  90   4.181   6.344 -17.021
  705   3HZ   LYS  90          3HZ       LYS  90   4.551   4.904 -17.830
  706    H    ALA  91           H        ALA  91   8.117   5.400  -9.462
  707    HA   ALA  91           HA       ALA  91   5.649   6.439  -8.538
  708   1HB   ALA  91          1HB       ALA  91   4.461   4.625  -7.899
  709   2HB   ALA  91          2HB       ALA  91   5.903   3.674  -7.539
  710   3HB   ALA  91          3HB       ALA  91   5.356   3.850  -9.206
  711    H    ILE  92           H        ILE  92   8.465   4.442  -7.772
  712    HA   ILE  92           HA       ILE  92   8.535   5.143  -5.017
  713    HB   ILE  92           HB       ILE  92  10.558   3.962  -4.857
  714   1HG1  ILE  92          2HG1      ILE  92  10.861   4.245  -7.855
  715   2HG1  ILE  92          1HG1      ILE  92  11.810   5.090  -6.637
  716   1HG2  ILE  92          1HG2      ILE  92  10.053   2.025  -6.685
  717   2HG2  ILE  92          2HG2      ILE  92   8.504   2.862  -6.645
  718   3HG2  ILE  92          3HG2      ILE  92   9.189   2.207  -5.160
  719   1HD1  ILE  92          1HD1      ILE  92  12.871   3.093  -5.952
  720   2HD1  ILE  92          2HD1      ILE  92  12.919   3.116  -7.715
  721   3HD1  ILE  92          3HD1      ILE  92  11.748   2.097  -6.879
  722    H    LYS  93           H        LYS  93   9.794   6.581  -7.916
  723    HA   LYS  93           HA       LYS  93  11.497   8.409  -6.412
  724   1HB   LYS  93          2HB       LYS  93  11.191   7.660  -9.271
  725   2HB   LYS  93          1HB       LYS  93  11.727   9.299  -8.930
  726   1HG   LYS  93          2HG       LYS  93  13.774   8.428  -8.878
  727   2HG   LYS  93          1HG       LYS  93  13.327   7.820  -7.283
  728   1HD   LYS  93          2HD       LYS  93  12.489   5.745  -8.395
  729   2HD   LYS  93          1HD       LYS  93  13.153   6.354  -9.912
  730   1HE   LYS  93          2HE       LYS  93  14.947   6.254  -7.547
  731   2HE   LYS  93          1HE       LYS  93  14.522   4.728  -8.323
  732   1HZ   LYS  93          1HZ       LYS  93  16.589   6.011  -9.122
  733   2HZ   LYS  93          2HZ       LYS  93  15.484   6.994  -9.942
  734   3HZ   LYS  93          3HZ       LYS  93  15.554   5.336 -10.277
  735    H    LYS  94           H        LYS  94   8.442   8.368  -6.416
  736    HA   LYS  94           HA       LYS  94   8.085  11.208  -7.083
  737   1HB   LYS  94          2HB       LYS  94   6.854   9.288  -8.443
  738   2HB   LYS  94          1HB       LYS  94   5.728   9.414  -7.098
  739   1HG   LYS  94          2HG       LYS  94   4.894  10.843  -8.760
  740   2HG   LYS  94          1HG       LYS  94   5.659  11.901  -7.572
  741   1HD   LYS  94          2HD       LYS  94   7.718  11.329  -9.304
  742   2HD   LYS  94          1HD       LYS  94   6.321  11.440 -10.377
  743   1HE   LYS  94          2HE       LYS  94   5.977  13.655  -9.926
  744   2HE   LYS  94          1HE       LYS  94   6.659  13.541  -8.304
  745   1HZ   LYS  94          1HZ       LYS  94   8.354  14.618  -9.301
  746   2HZ   LYS  94          2HZ       LYS  94   7.988  14.035 -10.846
  747   3HZ   LYS  94          3HZ       LYS  94   8.821  13.054  -9.749
  748    H    GLY  95           H        GLY  95   8.311   9.082  -4.585
  749   1HA   GLY  95          2HA       GLY  95   7.972  10.388  -2.422
  750   2HA   GLY  95          1HA       GLY  95   6.308  10.516  -2.965
  751    H    ALA  96           H        ALA  96   7.693   7.512  -3.789
  752    HA   ALA  96           HA       ALA  96   6.082   6.233  -1.733
  753   1HB   ALA  96          1HB       ALA  96   5.770   4.585  -3.200
  754   2HB   ALA  96          2HB       ALA  96   7.502   4.410  -3.487
  755   3HB   ALA  96          3HB       ALA  96   6.576   5.614  -4.382
  756    H    TYR  97           H        TYR  97   7.347   3.843  -1.358
  757    HA   TYR  97           HA       TYR  97   9.812   4.641   0.046
  758   1HB   TYR  97          2HB       TYR  97   7.742   3.979   1.404
  759   2HB   TYR  97          1HB       TYR  97   8.049   2.339   0.842
  760    HD1  TYR  97           1HD      TYR  97   9.272   0.975   2.231
  761    HD2  TYR  97           2HD      TYR  97   9.933   5.174   2.393
  762    HE1  TYR  97           1HE      TYR  97  10.878   0.645   4.065
  763    HE2  TYR  97           2HE      TYR  97  11.541   4.856   4.226
  764    HH   TYR  97           HH       TYR  97  12.719   1.754   5.122
  765    H    GLU  98           H        GLU  98   9.497   3.591  -2.686
  766    HA   GLU  98           HA       GLU  98  10.799   2.308  -4.055
  767   1HB   GLU  98          2HB       GLU  98  12.735   1.419  -3.301
  768   2HB   GLU  98          1HB       GLU  98  12.338   2.322  -1.851
  769   1HG   GLU  98          2HG       GLU  98  12.766   0.346  -0.865
  770   2HG   GLU  98          1HG       GLU  98  11.087   0.020  -1.285
  771    H    PHE  99           H        PHE  99  10.404   0.464  -5.177
  772    HA   PHE  99           HA       PHE  99   8.063  -0.984  -4.524
  773   1HB   PHE  99          2HB       PHE  99   9.846  -0.724  -6.766
  774   2HB   PHE  99          1HB       PHE  99   9.490  -2.423  -6.489
  775    HD1  PHE  99           1HD      PHE  99   7.905  -3.147  -7.984
  776    HD2  PHE  99           2HD      PHE  99   7.454   0.689  -6.195
  777    HE1  PHE  99           1HE      PHE  99   5.747  -2.869  -9.134
  778    HE2  PHE  99           2HE      PHE  99   5.296   0.974  -7.343
  779    HZ   PHE  99           HZ       PHE  99   4.440  -0.806  -8.813
  780    H    LEU 100           H        LEU 100   7.780  -2.814  -3.422
  781    HA   LEU 100           HA       LEU 100   9.939  -4.018  -2.015
  782   1HB   LEU 100          2HB       LEU 100   7.429  -3.791  -1.381
  783   2HB   LEU 100          1HB       LEU 100   7.223  -5.250  -2.330
  784    HG   LEU 100           HG       LEU 100   7.401  -5.940  -0.081
  785   1HD1  LEU 100          1HD1      LEU 100   8.856  -7.076  -1.878
  786   2HD1  LEU 100          2HD1      LEU 100   9.130  -7.467  -0.181
  787   3HD1  LEU 100          3HD1      LEU 100  10.209  -6.347  -1.011
  788   1HD2  LEU 100          1HD2      LEU 100   9.774  -4.099   0.079
  789   2HD2  LEU 100          2HD2      LEU 100   9.398  -5.310   1.306
  790   3HD2  LEU 100          3HD2      LEU 100   8.261  -4.002   0.980
  791    H    GLU 101           H        GLU 101  11.402  -5.180  -3.116
  792    HA   GLU 101           HA       GLU 101  10.705  -6.719  -5.439
  793   1HB   GLU 101          2HB       GLU 101  13.180  -5.980  -4.009
  794   2HB   GLU 101          1HB       GLU 101  13.226  -7.531  -4.836
  795   1HG   GLU 101          2HG       GLU 101  12.820  -6.543  -6.932
  796   2HG   GLU 101          1HG       GLU 101  12.347  -5.010  -6.203
  797    H    LYS 102           H        LYS 102   9.049  -7.951  -4.123
  798    HA   LYS 102           HA       LYS 102   9.876 -10.592  -3.784
  799   1HB   LYS 102          2HB       LYS 102  10.190  -8.916  -1.422
  800   2HB   LYS 102          1HB       LYS 102   9.134 -10.290  -1.122
  801   1HG   LYS 102          2HG       LYS 102  11.382 -11.235  -2.562
  802   2HG   LYS 102          1HG       LYS 102  11.969 -10.214  -1.248
  803   1HD   LYS 102          2HD       LYS 102  11.772 -12.534  -0.526
  804   2HD   LYS 102          1HD       LYS 102  10.635 -11.508   0.348
  805   1HE   LYS 102          2HE       LYS 102   9.638 -12.743  -2.141
  806   2HE   LYS 102          1HE       LYS 102   9.957 -13.843  -0.801
  807   1HZ   LYS 102          1HZ       LYS 102   7.968 -13.265  -0.041
  808   2HZ   LYS 102          2HZ       LYS 102   7.814 -11.997  -1.148
  809   3HZ   LYS 102          3HZ       LYS 102   8.605 -11.741   0.324
  810    HA   PRO 103           HA       PRO 103   5.284  -9.569  -3.937
  811   1HB   PRO 103          2HB       PRO 103   4.800 -10.360  -6.471
  812   2HB   PRO 103          1HB       PRO 103   5.351  -8.726  -6.082
  813   1HG   PRO 103          2HG       PRO 103   6.927 -11.070  -7.078
  814   2HG   PRO 103          1HG       PRO 103   7.009  -9.372  -7.582
  815   1HD   PRO 103          2HD       PRO 103   8.787 -10.494  -5.856
  816   2HD   PRO 103          1HD       PRO 103   8.338  -8.778  -5.803
  817    H    PHE 104           H        PHE 104   3.503 -11.163  -4.618
  818    HA   PHE 104           HA       PHE 104   2.516 -13.191  -4.326
  819   1HB   PHE 104          2HB       PHE 104   5.161 -14.307  -5.278
  820   2HB   PHE 104          1HB       PHE 104   3.606 -15.133  -5.295
  821    HD1  PHE 104           1HD      PHE 104   5.746 -12.721  -6.958
  822    HD2  PHE 104           2HD      PHE 104   1.865 -14.464  -6.885
  823    HE1  PHE 104           1HE      PHE 104   5.324 -11.865  -9.226
  824    HE2  PHE 104           2HE      PHE 104   1.435 -13.613  -9.153
  825    HZ   PHE 104           HZ       PHE 104   3.166 -12.312 -10.326
  826    H    SER 105           H        SER 105   3.740 -12.026  -2.056
  827    HA   SER 105           HA       SER 105   3.573 -14.031  -0.182
  828   1HB   SER 105          2HB       SER 105   6.185 -14.017   0.376
  829   2HB   SER 105          1HB       SER 105   5.467 -15.210  -0.706
  830    HG   SER 105           HG       SER 105   6.582 -14.397  -2.283
  831    H    VAL 106           H        VAL 106   4.993 -10.994  -1.122
  832    HA   VAL 106           HA       VAL 106   5.621  -9.130   0.045
  833    HB   VAL 106           HB       VAL 106   3.859  -8.062   1.168
  834   1HG1  VAL 106          1HG1      VAL 106   2.839 -10.005  -0.877
  835   2HG1  VAL 106          2HG1      VAL 106   3.256  -8.303  -1.081
  836   3HG1  VAL 106          3HG1      VAL 106   1.813  -8.755  -0.174
  837   1HG2  VAL 106          1HG2      VAL 106   1.796  -9.603   1.801
  838   2HG2  VAL 106          2HG2      VAL 106   3.112  -9.287   2.931
  839   3HG2  VAL 106          3HG2      VAL 106   3.075 -10.792   2.016
  840    H    GLU 107           H        GLU 107   6.675 -11.631   1.174
  841    HA   GLU 107           HA       GLU 107   6.591 -11.553   3.993
  842   1HB   GLU 107          2HB       GLU 107   7.508 -13.360   2.298
  843   2HB   GLU 107          1HB       GLU 107   9.026 -12.518   2.574
  844   1HG   GLU 107          2HG       GLU 107   8.346 -12.827   5.096
  845   2HG   GLU 107          1HG       GLU 107   7.395 -14.155   4.434
  846    H    ARG 108           H        ARG 108   8.882 -10.235   1.623
  847    HA   ARG 108           HA       ARG 108  10.596  -9.006   3.503
  848   1HB   ARG 108          2HB       ARG 108  10.366  -9.152   0.647
  849   2HB   ARG 108          1HB       ARG 108  10.592  -7.471   1.112
  850   1HG   ARG 108          2HG       ARG 108  12.372  -9.482   2.361
  851   2HG   ARG 108          1HG       ARG 108  12.627  -9.101   0.657
  852   1HD   ARG 108          2HD       ARG 108  13.742  -7.283   1.271
  853   2HD   ARG 108          1HD       ARG 108  12.257  -6.644   1.973
  854    HE   ARG 108           HE       ARG 108  13.054  -7.155   4.064
  855   1HH1  ARG 108          1HH1      ARG 108  15.043  -8.726   1.664
  856   2HH1  ARG 108          2HH1      ARG 108  16.259  -9.200   2.802
  857   1HH2  ARG 108          1HH2      ARG 108  14.653  -7.778   5.561
  858   2HH2  ARG 108          2HH2      ARG 108  16.038  -8.662   5.014
  859    H    PHE 109           H        PHE 109   7.622  -8.055   1.931
  860    HA   PHE 109           HA       PHE 109   7.582  -5.326   2.518
  861   1HB   PHE 109          2HB       PHE 109   5.901  -6.174   1.052
  862   2HB   PHE 109          1HB       PHE 109   5.378  -7.373   2.223
  863    HD1  PHE 109           1HD      PHE 109   5.946  -3.709   2.554
  864    HD2  PHE 109           2HD      PHE 109   3.175  -6.934   2.727
  865    HE1  PHE 109           1HE      PHE 109   4.206  -2.164   3.352
  866    HE2  PHE 109           2HE      PHE 109   1.429  -5.394   3.524
  867    HZ   PHE 109           HZ       PHE 109   1.943  -3.008   3.838
  868    H    LEU 110           H        LEU 110   6.857  -8.152   4.445
  869    HA   LEU 110           HA       LEU 110   5.612  -6.996   6.649
  870   1HB   LEU 110          2HB       LEU 110   6.281  -9.485   5.979
  871   2HB   LEU 110          1HB       LEU 110   7.561  -9.161   7.130
  872    HG   LEU 110           HG       LEU 110   4.654  -8.768   7.799
  873   1HD1  LEU 110          1HD1      LEU 110   4.637 -10.941   8.799
  874   2HD1  LEU 110          2HD1      LEU 110   6.332 -11.197   8.383
  875   3HD1  LEU 110          3HD1      LEU 110   5.117 -11.109   7.110
  876   1HD2  LEU 110          1HD2      LEU 110   7.219  -8.512   9.206
  877   2HD2  LEU 110          2HD2      LEU 110   5.967  -9.385  10.089
  878   3HD2  LEU 110          3HD2      LEU 110   5.666  -7.741   9.525
  879    H    LEU 111           H        LEU 111   9.067  -7.694   6.180
  880    HA   LEU 111           HA       LEU 111   9.976  -6.571   8.574
  881   1HB   LEU 111          2HB       LEU 111  11.363  -6.909   5.922
  882   2HB   LEU 111          1HB       LEU 111  12.178  -6.399   7.388
  883    HG   LEU 111           HG       LEU 111  10.967  -8.695   8.230
  884   1HD1  LEU 111          1HD1      LEU 111  10.560  -8.844   5.550
  885   2HD1  LEU 111          2HD1      LEU 111  10.692 -10.235   6.625
  886   3HD1  LEU 111          3HD1      LEU 111  12.100  -9.687   5.715
  887   1HD2  LEU 111          1HD2      LEU 111  13.136  -8.578   8.857
  888   2HD2  LEU 111          2HD2      LEU 111  13.666  -7.931   7.304
  889   3HD2  LEU 111          3HD2      LEU 111  13.353  -9.658   7.480
  890    H    THR 112           H        THR 112   9.557  -5.115   5.370
  891    HA   THR 112           HA       THR 112  10.692  -2.613   6.004
  892    HB   THR 112           HB       THR 112   8.602  -3.313   3.933
  893    HG1  THR 112           1HG      THR 112  11.405  -3.030   3.640
  894   1HG2  THR 112          1HG2      THR 112   8.711  -1.271   3.063
  895   2HG2  THR 112          2HG2      THR 112  10.451  -1.148   3.330
  896   3HG2  THR 112          3HG2      THR 112   9.329  -0.781   4.641
  897    H    ILE 113           H        ILE 113   7.397  -3.854   6.199
  898    HA   ILE 113           HA       ILE 113   5.899  -1.639   6.657
  899    HB   ILE 113           HB       ILE 113   5.753  -4.426   7.649
  900   1HG1  ILE 113          2HG1      ILE 113   4.808  -3.779   5.492
  901   2HG1  ILE 113          1HG1      ILE 113   3.539  -4.308   6.591
  902   1HG2  ILE 113          1HG2      ILE 113   5.193  -3.373   9.700
  903   2HG2  ILE 113          2HG2      ILE 113   3.681  -3.890   8.954
  904   3HG2  ILE 113          3HG2      ILE 113   4.164  -2.194   8.888
  905   1HD1  ILE 113          1HD1      ILE 113   3.580  -1.626   7.046
  906   2HD1  ILE 113          2HD1      ILE 113   2.493  -2.453   5.931
  907   3HD1  ILE 113          3HD1      ILE 113   3.977  -1.713   5.330
  908    H    LYS 114           H        LYS 114   7.680  -3.393   9.206
  909    HA   LYS 114           HA       LYS 114   7.030  -1.877  11.385
  910   1HB   LYS 114          2HB       LYS 114   8.598  -3.928  11.169
  911   2HB   LYS 114          1HB       LYS 114   9.869  -2.732  10.963
  912   1HG   LYS 114          2HG       LYS 114   8.006  -2.647  13.307
  913   2HG   LYS 114          1HG       LYS 114   9.454  -3.656  13.306
  914   1HD   LYS 114          2HD       LYS 114   9.373  -0.667  12.894
  915   2HD   LYS 114          1HD       LYS 114   9.884  -1.498  14.364
  916   1HE   LYS 114          2HE       LYS 114  11.498  -2.705  12.606
  917   2HE   LYS 114          1HE       LYS 114  11.289  -1.163  11.778
  918   1HZ   LYS 114          1HZ       LYS 114  12.232  -0.003  13.543
  919   2HZ   LYS 114          2HZ       LYS 114  13.205  -1.383  13.420
  920   3HZ   LYS 114          3HZ       LYS 114  12.032  -1.280  14.634
  921    H    HIS 115           H        HIS 115   9.837  -1.330   9.272
  922    HA   HIS 115           HA       HIS 115  10.614   1.106  10.405
  923   1HB   HIS 115          2HB       HIS 115  11.878  -0.415   8.761
  924   2HB   HIS 115          1HB       HIS 115  11.009   0.454   7.501
  925    HD1  HIS 115           1HD      HIS 115  11.201   3.315   8.600
  926    HD2  HIS 115           2HD      HIS 115  14.375   0.633   8.526
  927    HE1  HIS 115           1HE      HIS 115  13.278   4.731   8.657
  928    HE2  HIS 115           2HE      HIS 115  15.186   3.084   8.687
  929    H    ALA 116           H        ALA 116   8.215   0.356   7.960
  930    HA   ALA 116           HA       ALA 116   7.849   2.913   6.882
  931   1HB   ALA 116          1HB       ALA 116   5.336   1.793   6.810
  932   2HB   ALA 116          2HB       ALA 116   6.398   0.388   6.892
  933   3HB   ALA 116          3HB       ALA 116   6.602   1.571   5.603
  934    H    PHE 117           H        PHE 117   6.487   1.400   9.764
  935    HA   PHE 117           HA       PHE 117   4.743   3.602  10.349
  936   1HB   PHE 117          2HB       PHE 117   5.533   1.085  11.776
  937   2HB   PHE 117          1HB       PHE 117   4.646   2.343  12.630
  938    HD1  PHE 117           1HD      PHE 117   2.333   2.616  12.327
  939    HD2  PHE 117           2HD      PHE 117   4.516   0.041   9.740
  940    HE1  PHE 117           1HE      PHE 117   0.223   1.755  11.414
  941    HE2  PHE 117           2HE      PHE 117   2.411  -0.824   8.820
  942    HZ   PHE 117           HZ       PHE 117   0.261   0.027   9.657
  943    H    GLU 118           H        GLU 118   8.061   3.050  10.770
  944    HA   GLU 118           HA       GLU 118   8.628   4.221  13.219
  945   1HB   GLU 118          2HB       GLU 118  10.171   3.084  11.464
  946   2HB   GLU 118          1HB       GLU 118  10.374   4.718  10.845
  947   1HG   GLU 118          2HG       GLU 118  10.816   5.111  13.485
  948   2HG   GLU 118          1HG       GLU 118  11.427   3.469  13.279
  949    H    GLU 119           H        GLU 119   7.744   5.700  10.182
  950    HA   GLU 119           HA       GLU 119   8.511   8.351  10.930
  951   1HB   GLU 119          2HB       GLU 119   6.743   7.307   8.727
  952   2HB   GLU 119          1HB       GLU 119   7.128   9.009   8.936
  953   1HG   GLU 119          2HG       GLU 119   9.104   6.798   8.421
  954   2HG   GLU 119          1HG       GLU 119   8.537   7.984   7.246
  955    H    TYR 120           H        TYR 120   6.038   6.390  11.973
  956    HA   TYR 120           HA       TYR 120   4.566   8.702  12.991
  957   1HB   TYR 120          2HB       TYR 120   3.434   7.761  10.919
  958   2HB   TYR 120          1HB       TYR 120   3.126   6.304  11.859
  959    HD1  TYR 120           1HD      TYR 120   0.864   6.214  12.331
  960    HD2  TYR 120           2HD      TYR 120   2.895   9.929  12.740
  961    HE1  TYR 120           1HE      TYR 120  -1.185   7.228  13.235
  962    HE2  TYR 120           2HE      TYR 120   0.852  10.953  13.647
  963    HH   TYR 120           HH       TYR 120  -2.195   9.414  13.503
  964    H    SER 121           H        SER 121   6.458   6.644  14.062
  965    HA   SER 121           HA       SER 121   6.739   5.375  15.927
  966   1HB   SER 121          2HB       SER 121   5.871   7.411  17.015
  967   2HB   SER 121          1HB       SER 121   4.227   6.798  16.839
  968    HG   SER 121           HG       SER 121   5.792   6.386  18.849
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1   0.689   5.150  12.537
    2   2H    MET   1          2HT       MET   1   1.683   6.105  13.558
    3   3H    MET   1          3HT       MET   1   0.092   5.689  14.050
    4    HA   MET   1           HA       MET   1   2.473   3.999  13.842
    5   1HB   MET   1          2HB       MET   1   1.690   5.371  15.906
    6   2HB   MET   1          1HB       MET   1   0.430   4.153  16.043
    7   1HG   MET   1          2HG       MET   1   2.363   2.457  15.976
    8   2HG   MET   1          1HG       MET   1   3.387   3.843  16.347
    9   1HE   MET   1          1HE       MET   1   3.430   1.391  18.164
   10   2HE   MET   1          2HE       MET   1   1.750   0.920  17.906
   11   3HE   MET   1          3HE       MET   1   2.310   1.341  19.525
   12    H    LYS   2           H        LYS   2   2.244   2.022  13.046
   13    HA   LYS   2           HA       LYS   2   1.336   0.069  12.321
   14   1HB   LYS   2          2HB       LYS   2  -0.844   0.555  14.346
   15   2HB   LYS   2          1HB       LYS   2  -0.310  -0.989  13.698
   16   1HG   LYS   2          2HG       LYS   2   1.275   0.837  15.489
   17   2HG   LYS   2          1HG       LYS   2   0.512  -0.687  15.949
   18   1HD   LYS   2          2HD       LYS   2   1.958  -1.869  14.344
   19   2HD   LYS   2          1HD       LYS   2   2.740  -0.339  13.943
   20   1HE   LYS   2          2HE       LYS   2   4.081  -1.601  15.532
   21   2HE   LYS   2          1HE       LYS   2   3.482  -0.113  16.264
   22   1HZ   LYS   2          1HZ       LYS   2   1.999  -2.638  16.599
   23   2HZ   LYS   2          2HZ       LYS   2   1.992  -1.261  17.581
   24   3HZ   LYS   2          3HZ       LYS   2   3.331  -2.296  17.584
   25    H    ARG   3           H        ARG   3  -1.177  -0.847  11.901
   26    HA   ARG   3           HA       ARG   3  -2.956  -0.771  10.498
   27   1HB   ARG   3          2HB       ARG   3  -2.779   2.187  11.088
   28   2HB   ARG   3          1HB       ARG   3  -4.087   1.441  10.183
   29   1HG   ARG   3          2HG       ARG   3  -5.066   1.424  12.212
   30   2HG   ARG   3          1HG       ARG   3  -4.168  -0.086  12.369
   31   1HD   ARG   3          2HD       ARG   3  -2.758   0.760  13.907
   32   2HD   ARG   3          1HD       ARG   3  -2.678   2.334  13.116
   33    HE   ARG   3           HE       ARG   3  -5.158   2.334  14.157
   34   1HH1  ARG   3          1HH1      ARG   3  -2.038   1.608  15.542
   35   2HH1  ARG   3          2HH1      ARG   3  -2.484   2.127  17.133
   36   1HH2  ARG   3          1HH2      ARG   3  -5.745   3.018  16.247
   37   2HH2  ARG   3          2HH2      ARG   3  -4.589   2.927  17.533
   38    H    VAL   4           H        VAL   4  -2.416  -1.389   8.503
   39    HA   VAL   4           HA       VAL   4  -1.188   0.616   6.721
   40    HB   VAL   4           HB       VAL   4  -0.767  -2.367   6.503
   41   1HG1  VAL   4          1HG1      VAL   4   1.295  -1.298   5.208
   42   2HG1  VAL   4          2HG1      VAL   4   0.139   0.015   4.988
   43   3HG1  VAL   4          3HG1      VAL   4  -0.253  -1.608   4.421
   44   1HG2  VAL   4          1HG2      VAL   4   1.159  -0.335   7.625
   45   2HG2  VAL   4          2HG2      VAL   4   1.408  -2.075   7.484
   46   3HG2  VAL   4          3HG2      VAL   4   0.198  -1.444   8.602
   47    H    LEU   5           H        LEU   5  -1.708   0.333   4.421
   48    HA   LEU   5           HA       LEU   5  -4.380  -0.850   4.054
   49   1HB   LEU   5          2HB       LEU   5  -4.381   1.595   3.904
   50   2HB   LEU   5          1HB       LEU   5  -3.155   1.525   2.651
   51    HG   LEU   5           HG       LEU   5  -4.804   0.229   1.245
   52   1HD1  LEU   5          1HD1      LEU   5  -7.224   0.727   1.961
   53   2HD1  LEU   5          2HD1      LEU   5  -6.545   0.935   3.574
   54   3HD1  LEU   5          3HD1      LEU   5  -6.374  -0.608   2.739
   55   1HD2  LEU   5          1HD2      LEU   5  -5.078   3.080   2.047
   56   2HD2  LEU   5          2HD2      LEU   5  -6.299   2.387   0.980
   57   3HD2  LEU   5          3HD2      LEU   5  -4.602   2.380   0.500
   58    H    VAL   6           H        VAL   6  -4.696  -2.262   2.422
   59    HA   VAL   6           HA       VAL   6  -2.403  -2.763   0.630
   60    HB   VAL   6           HB       VAL   6  -4.442  -4.819   1.465
   61   1HG1  VAL   6          1HG1      VAL   6  -3.424  -5.428  -0.580
   62   2HG1  VAL   6          2HG1      VAL   6  -2.603  -6.360   0.671
   63   3HG1  VAL   6          3HG1      VAL   6  -1.828  -4.934  -0.017
   64   1HG2  VAL   6          1HG2      VAL   6  -3.055  -5.576   3.161
   65   2HG2  VAL   6          2HG2      VAL   6  -2.922  -3.826   3.316
   66   3HG2  VAL   6          3HG2      VAL   6  -1.642  -4.739   2.519
   67    H    VAL   7           H        VAL   7  -3.156  -1.418  -1.028
   68    HA   VAL   7           HA       VAL   7  -5.793  -1.812  -2.147
   69    HB   VAL   7           HB       VAL   7  -3.476  -0.201  -3.248
   70   1HG1  VAL   7          1HG1      VAL   7  -5.287  -0.857  -4.861
   71   2HG1  VAL   7          2HG1      VAL   7  -5.049   0.880  -4.662
   72   3HG1  VAL   7          3HG1      VAL   7  -6.407   0.081  -3.872
   73   1HG2  VAL   7          1HG2      VAL   7  -5.750   0.580  -1.434
   74   2HG2  VAL   7          2HG2      VAL   7  -4.756   1.743  -2.312
   75   3HG2  VAL   7          3HG2      VAL   7  -4.020   0.685  -1.107
   76    H    ASP   8           H        ASP   8  -6.140  -3.667  -3.224
   77    HA   ASP   8           HA       ASP   8  -4.327  -4.330  -5.418
   78   1HB   ASP   8          2HB       ASP   8  -3.580  -5.707  -3.529
   79   2HB   ASP   8          1HB       ASP   8  -5.213  -6.333  -3.329
   80    H    ASP   9           H        ASP   9  -5.297  -5.212  -7.177
   81    HA   ASP   9           HA       ASP   9  -8.067  -4.851  -7.520
   82   1HB   ASP   9          2HB       ASP   9  -6.439  -4.717  -9.363
   83   2HB   ASP   9          1HB       ASP   9  -6.141  -6.442  -9.224
   84    H    GLU  10           H        GLU  10  -6.333  -7.942  -7.918
   85    HA   GLU  10           HA       GLU  10  -8.749  -9.404  -7.326
   86   1HB   GLU  10          2HB       GLU  10  -6.130  -9.989  -8.482
   87   2HB   GLU  10          1HB       GLU  10  -6.703 -11.262  -7.413
   88   1HG   GLU  10          2HG       GLU  10  -8.807 -10.371  -9.164
   89   2HG   GLU  10          1HG       GLU  10  -7.383 -10.858 -10.081
   90    H    GLU  11           H        GLU  11  -8.077 -11.564  -5.927
   91    HA   GLU  11           HA       GLU  11  -7.213 -10.485  -3.324
   92   1HB   GLU  11          2HB       GLU  11  -9.003 -12.878  -3.694
   93   2HB   GLU  11          1HB       GLU  11  -8.743 -11.930  -2.236
   94   1HG   GLU  11          2HG       GLU  11 -10.653 -10.922  -2.764
   95   2HG   GLU  11          1HG       GLU  11  -9.704 -10.055  -3.971
   96    H    SER  12           H        SER  12  -5.033 -11.073  -4.271
   97    HA   SER  12           HA       SER  12  -4.462 -13.937  -3.911
   98   1HB   SER  12          2HB       SER  12  -2.305 -13.374  -5.128
   99   2HB   SER  12          1HB       SER  12  -3.778 -13.252  -6.089
  100    HG   SER  12           HG       SER  12  -1.969 -11.375  -5.632
  101    H    ILE  13           H        ILE  13  -3.140 -10.708  -3.220
  102    HA   ILE  13           HA       ILE  13  -1.283 -11.765  -1.278
  103    HB   ILE  13           HB       ILE  13  -1.979  -8.889  -1.887
  104   1HG1  ILE  13          2HG1      ILE  13  -1.077 -10.120  -3.840
  105   2HG1  ILE  13          1HG1      ILE  13   0.022  -8.866  -3.273
  106   1HG2  ILE  13          1HG2      ILE  13   0.097 -10.188  -0.173
  107   2HG2  ILE  13          2HG2      ILE  13  -0.954  -8.818   0.185
  108   3HG2  ILE  13          3HG2      ILE  13   0.410  -8.619  -0.915
  109   1HD1  ILE  13          1HD1      ILE  13   0.287 -11.762  -2.524
  110   2HD1  ILE  13          2HD1      ILE  13   1.457 -10.467  -2.272
  111   3HD1  ILE  13          3HD1      ILE  13   1.099 -11.026  -3.905
  112    H    THR  14           H        THR  14  -4.284  -9.893  -1.252
  113    HA   THR  14           HA       THR  14  -4.411  -9.284   1.456
  114    HB   THR  14           HB       THR  14  -6.864  -9.134   1.123
  115    HG1  THR  14           1HG      THR  14  -6.238 -10.301  -1.382
  116   1HG2  THR  14          1HG2      THR  14  -5.542  -7.242   0.403
  117   2HG2  THR  14          2HG2      THR  14  -6.895  -7.506  -0.697
  118   3HG2  THR  14          3HG2      THR  14  -5.269  -8.004  -1.164
  119    H    SER  15           H        SER  15  -4.802 -12.327  -0.124
  120    HA   SER  15           HA       SER  15  -6.379 -13.598   1.872
  121   1HB   SER  15          2HB       SER  15  -4.883 -14.433  -0.542
  122   2HB   SER  15          1HB       SER  15  -5.115 -15.675   0.689
  123    HG   SER  15           HG       SER  15  -7.247 -14.074  -0.251
  124    H    SER  16           H        SER  16  -2.886 -13.431   1.258
  125    HA   SER  16           HA       SER  16  -2.411 -14.871   3.770
  126   1HB   SER  16          2HB       SER  16  -0.061 -15.048   2.963
  127   2HB   SER  16          1HB       SER  16  -1.225 -15.782   1.861
  128    HG   SER  16           HG       SER  16   0.421 -14.383   0.890
  129    H    LEU  17           H        LEU  17  -1.217 -11.992   2.038
  130    HA   LEU  17           HA       LEU  17   0.369 -10.880   3.974
  131   1HB   LEU  17          2HB       LEU  17   0.208  -9.932   1.768
  132   2HB   LEU  17          1HB       LEU  17  -1.474  -9.515   2.015
  133    HG   LEU  17           HG       LEU  17   0.447  -7.708   2.178
  134   1HD1  LEU  17          1HD1      LEU  17  -1.718  -6.948   2.364
  135   2HD1  LEU  17          2HD1      LEU  17  -1.046  -6.549   3.944
  136   3HD1  LEU  17          3HD1      LEU  17  -2.073  -7.971   3.756
  137   1HD2  LEU  17          1HD2      LEU  17   1.523  -7.461   4.166
  138   2HD2  LEU  17          2HD2      LEU  17   1.361  -9.216   4.172
  139   3HD2  LEU  17          3HD2      LEU  17   0.231  -8.224   5.091
  140    H    SER  18           H        SER  18  -3.135 -10.316   3.585
  141    HA   SER  18           HA       SER  18  -3.546  -8.600   5.706
  142   1HB   SER  18          2HB       SER  18  -5.393 -10.826   4.810
  143   2HB   SER  18          1HB       SER  18  -5.862  -9.415   5.758
  144    HG   SER  18           HG       SER  18  -5.944  -8.289   3.991
  145    H    ALA  19           H        ALA  19  -3.515 -12.151   5.755
  146    HA   ALA  19           HA       ALA  19  -4.118 -12.498   8.467
  147   1HB   ALA  19          1HB       ALA  19  -4.263 -14.390   7.068
  148   2HB   ALA  19          2HB       ALA  19  -2.923 -14.715   8.167
  149   3HB   ALA  19          3HB       ALA  19  -2.600 -14.203   6.511
  150    H    ILE  20           H        ILE  20  -1.034 -12.041   6.805
  151    HA   ILE  20           HA       ILE  20   0.709 -12.514   8.925
  152    HB   ILE  20           HB       ILE  20   0.877 -10.832   6.450
  153   1HG1  ILE  20          2HG1      ILE  20   2.571 -13.117   7.460
  154   2HG1  ILE  20          1HG1      ILE  20   1.176 -13.301   6.401
  155   1HG2  ILE  20          1HG2      ILE  20   2.910 -10.853   8.669
  156   2HG2  ILE  20          2HG2      ILE  20   2.086  -9.459   7.971
  157   3HG2  ILE  20          3HG2      ILE  20   3.268 -10.353   7.017
  158   1HD1  ILE  20          1HD1      ILE  20   3.896 -12.335   5.810
  159   2HD1  ILE  20          2HD1      ILE  20   2.570 -11.522   4.977
  160   3HD1  ILE  20          3HD1      ILE  20   2.775 -13.267   4.817
  161    H    LEU  21           H        LEU  21  -0.469  -9.342   7.799
  162    HA   LEU  21           HA       LEU  21   0.529  -7.718   9.761
  163   1HB   LEU  21          2HB       LEU  21  -2.253  -7.503   8.628
  164   2HB   LEU  21          1HB       LEU  21  -1.275  -6.200   9.277
  165    HG   LEU  21           HG       LEU  21   0.066  -7.595   7.108
  166   1HD1  LEU  21          1HD1      LEU  21  -1.595  -7.807   5.662
  167   2HD1  LEU  21          2HD1      LEU  21  -1.787  -6.055   5.691
  168   3HD1  LEU  21          3HD1      LEU  21  -2.734  -7.066   6.780
  169   1HD2  LEU  21          1HD2      LEU  21  -0.488  -4.838   8.028
  170   2HD2  LEU  21          2HD2      LEU  21  -0.106  -5.064   6.320
  171   3HD2  LEU  21          3HD2      LEU  21   1.033  -5.597   7.556
  172    H    GLU  22           H        GLU  22  -2.372  -9.729   9.896
  173    HA   GLU  22           HA       GLU  22  -3.341  -8.826  12.376
  174   1HB   GLU  22          2HB       GLU  22  -3.788 -11.200  10.663
  175   2HB   GLU  22          1HB       GLU  22  -4.292 -11.311  12.343
  176   1HG   GLU  22          2HG       GLU  22  -6.189 -10.359  11.712
  177   2HG   GLU  22          1HG       GLU  22  -5.270  -8.864  11.538
  178    H    GLU  23           H        GLU  23  -0.809 -11.064  11.533
  179    HA   GLU  23           HA       GLU  23  -0.647 -12.232  14.161
  180   1HB   GLU  23          2HB       GLU  23   0.046 -13.664  12.422
  181   2HB   GLU  23          1HB       GLU  23   1.010 -12.410  11.656
  182   1HG   GLU  23          2HG       GLU  23   2.814 -12.913  12.849
  183   2HG   GLU  23          1HG       GLU  23   1.899 -13.023  14.352
  184    H    GLU  24           H        GLU  24   0.910  -9.669  12.354
  185    HA   GLU  24           HA       GLU  24   2.970  -9.211  14.288
  186   1HB   GLU  24          2HB       GLU  24   2.000  -7.677  11.895
  187   2HB   GLU  24          1HB       GLU  24   3.255  -7.051  12.955
  188   1HG   GLU  24          2HG       GLU  24   3.343  -9.544  11.281
  189   2HG   GLU  24          1HG       GLU  24   4.312  -8.084  11.097
  190    H    GLY  25           H        GLY  25  -0.295  -8.153  13.860
  191   1HA   GLY  25          2HA       GLY  25  -1.510  -7.237  15.702
  192   2HA   GLY  25          1HA       GLY  25  -0.019  -6.501  16.262
  193    H    TYR  26           H        TYR  26  -0.962  -6.380  12.916
  194    HA   TYR  26           HA       TYR  26  -1.224  -3.470  13.136
  195   1HB   TYR  26          2HB       TYR  26  -0.688  -5.316  10.815
  196   2HB   TYR  26          1HB       TYR  26  -1.075  -3.616  10.588
  197    HD1  TYR  26           1HD      TYR  26   0.437  -1.943  11.940
  198    HD2  TYR  26           2HD      TYR  26   1.522  -5.949  11.015
  199    HE1  TYR  26           1HE      TYR  26   2.805  -1.362  12.240
  200    HE2  TYR  26           2HE      TYR  26   3.895  -5.382  11.311
  201    HH   TYR  26           HH       TYR  26   5.370  -3.623  11.465
  202    H    HIS  27           H        HIS  27  -2.718  -2.721  11.100
  203    HA   HIS  27           HA       HIS  27  -5.252  -4.197  11.246
  204   1HB   HIS  27          2HB       HIS  27  -4.976  -2.032  12.768
  205   2HB   HIS  27          1HB       HIS  27  -5.351  -1.214  11.255
  206    HD1  HIS  27           1HD      HIS  27  -6.925  -2.795  14.103
  207    HD2  HIS  27           2HD      HIS  27  -7.921  -2.135  10.124
  208    HE1  HIS  27           1HE      HIS  27  -9.417  -3.101  13.974
  209    HE2  HIS  27           2HE      HIS  27  -9.987  -2.775  11.542
  210    HA   PRO  28           HA       PRO  28  -4.321  -3.186   6.891
  211   1HB   PRO  28          2HB       PRO  28  -5.131  -5.519   5.836
  212   2HB   PRO  28          1HB       PRO  28  -3.548  -5.322   6.594
  213   1HG   PRO  28          2HG       PRO  28  -6.024  -6.579   7.680
  214   2HG   PRO  28          1HG       PRO  28  -4.338  -7.078   7.874
  215   1HD   PRO  28          2HD       PRO  28  -5.791  -5.677   9.759
  216   2HD   PRO  28          1HD       PRO  28  -4.020  -5.703   9.664
  217    H    ASP  29           H        ASP  29  -5.653  -2.142   5.616
  218    HA   ASP  29           HA       ASP  29  -8.527  -2.615   5.919
  219   1HB   ASP  29          2HB       ASP  29  -7.167  -0.257   6.199
  220   2HB   ASP  29          1HB       ASP  29  -7.827  -0.138   4.571
  221    H    THR  30           H        THR  30  -6.257  -3.537   3.976
  222    HA   THR  30           HA       THR  30  -6.043  -3.453   1.580
  223    HB   THR  30           HB       THR  30  -6.745  -5.622   0.981
  224    HG1  THR  30           1HG      THR  30  -8.390  -6.696   2.010
  225   1HG2  THR  30          1HG2      THR  30  -5.587  -6.787   2.488
  226   2HG2  THR  30          2HG2      THR  30  -6.630  -6.288   3.820
  227   3HG2  THR  30          3HG2      THR  30  -5.332  -5.228   3.272
  228    H    ALA  31           H        ALA  31  -6.768  -2.466  -0.124
  229    HA   ALA  31           HA       ALA  31  -9.645  -1.939  -0.375
  230   1HB   ALA  31          1HB       ALA  31  -9.154   0.062  -1.287
  231   2HB   ALA  31          2HB       ALA  31  -7.785  -0.570  -2.200
  232   3HB   ALA  31          3HB       ALA  31  -7.599  -0.180  -0.491
  233    H    LYS  32           H        LYS  32  -9.715  -1.353  -3.097
  234    HA   LYS  32           HA       LYS  32  -9.246  -4.001  -4.294
  235   1HB   LYS  32          2HB       LYS  32 -11.547  -3.838  -4.269
  236   2HB   LYS  32          1HB       LYS  32 -11.531  -2.090  -4.440
  237   1HG   LYS  32          2HG       LYS  32 -10.823  -2.379  -6.789
  238   2HG   LYS  32          1HG       LYS  32 -11.007  -4.120  -6.591
  239   1HD   LYS  32          2HD       LYS  32 -13.404  -3.275  -5.684
  240   2HD   LYS  32          1HD       LYS  32 -13.053  -2.012  -6.865
  241   1HE   LYS  32          2HE       LYS  32 -12.550  -3.875  -8.504
  242   2HE   LYS  32          1HE       LYS  32 -13.247  -4.980  -7.321
  243   1HZ   LYS  32          1HZ       LYS  32 -14.557  -3.003  -9.016
  244   2HZ   LYS  32          2HZ       LYS  32 -15.186  -3.199  -7.458
  245   3HZ   LYS  32          3HZ       LYS  32 -15.100  -4.523  -8.505
  246    H    THR  33           H        THR  33  -9.226  -0.521  -4.860
  247    HA   THR  33           HA       THR  33  -7.064  -0.803  -6.735
  248    HB   THR  33           HB       THR  33  -8.368   0.526  -8.511
  249    HG1  THR  33           1HG      THR  33 -10.411   0.811  -8.202
  250   1HG2  THR  33          1HG2      THR  33  -7.869  -2.091  -8.382
  251   2HG2  THR  33          2HG2      THR  33  -8.778  -1.342  -9.695
  252   3HG2  THR  33          3HG2      THR  33  -9.631  -2.131  -8.369
  253    H    LEU  34           H        LEU  34  -6.930   1.616  -7.866
  254    HA   LEU  34           HA       LEU  34  -6.199   3.292  -5.716
  255   1HB   LEU  34          2HB       LEU  34  -6.578   3.985  -8.629
  256   2HB   LEU  34          1HB       LEU  34  -5.734   4.970  -7.447
  257    HG   LEU  34           HG       LEU  34  -4.864   2.172  -8.144
  258   1HD1  LEU  34          1HD1      LEU  34  -3.448   4.553  -9.218
  259   2HD1  LEU  34          2HD1      LEU  34  -4.912   4.005 -10.036
  260   3HD1  LEU  34          3HD1      LEU  34  -3.543   2.909  -9.850
  261   1HD2  LEU  34          1HD2      LEU  34  -4.159   3.817  -6.061
  262   2HD2  LEU  34          2HD2      LEU  34  -2.897   4.132  -7.252
  263   3HD2  LEU  34          3HD2      LEU  34  -3.192   2.485  -6.694
  264    H    ARG  35           H        ARG  35  -8.937   3.369  -7.977
  265    HA   ARG  35           HA       ARG  35 -10.104   5.740  -7.003
  266   1HB   ARG  35          2HB       ARG  35 -10.989   3.441  -8.653
  267   2HB   ARG  35          1HB       ARG  35 -12.265   4.356  -7.861
  268   1HG   ARG  35          2HG       ARG  35 -11.242   6.428  -8.874
  269   2HG   ARG  35          1HG       ARG  35 -10.236   5.348  -9.841
  270   1HD   ARG  35          2HD       ARG  35 -12.358   4.255 -10.631
  271   2HD   ARG  35          1HD       ARG  35 -13.240   5.559  -9.838
  272    HE   ARG  35           HE       ARG  35 -11.224   6.471 -11.675
  273   1HH1  ARG  35          1HH1      ARG  35 -14.541   5.432 -11.347
  274   2HH1  ARG  35          2HH1      ARG  35 -15.072   6.261 -12.771
  275   1HH2  ARG  35          1HH2      ARG  35 -11.922   7.562 -13.548
  276   2HH2  ARG  35          2HH2      ARG  35 -13.586   7.471 -14.021
  277    H    GLU  36           H        GLU  36 -10.680   2.330  -6.206
  278    HA   GLU  36           HA       GLU  36 -12.602   2.834  -4.185
  279   1HB   GLU  36          2HB       GLU  36 -12.014   0.622  -5.460
  280   2HB   GLU  36          1HB       GLU  36 -10.836   0.405  -4.174
  281   1HG   GLU  36          2HG       GLU  36 -12.573  -0.705  -3.247
  282   2HG   GLU  36          1HG       GLU  36 -12.950   0.915  -2.661
  283    H    ALA  37           H        ALA  37  -9.113   2.669  -4.255
  284    HA   ALA  37           HA       ALA  37  -8.721   2.540  -1.438
  285   1HB   ALA  37          1HB       ALA  37  -6.388   3.178  -1.974
  286   2HB   ALA  37          2HB       ALA  37  -6.871   3.428  -3.651
  287   3HB   ALA  37          3HB       ALA  37  -6.969   1.819  -2.935
  288    H    GLU  38           H        GLU  38  -9.256   5.116  -3.730
  289    HA   GLU  38           HA       GLU  38  -8.375   7.248  -2.068
  290   1HB   GLU  38          2HB       GLU  38 -10.230   7.142  -4.439
  291   2HB   GLU  38          1HB       GLU  38  -9.840   8.640  -3.606
  292   1HG   GLU  38          2HG       GLU  38  -7.649   8.627  -4.322
  293   2HG   GLU  38          1HG       GLU  38  -7.649   6.889  -4.620
  294    H    LYS  39           H        LYS  39 -11.506   5.731  -2.702
  295    HA   LYS  39           HA       LYS  39 -13.073   7.408  -1.087
  296   1HB   LYS  39          2HB       LYS  39 -14.110   5.904  -2.668
  297   2HB   LYS  39          1HB       LYS  39 -13.426   4.505  -1.853
  298   1HG   LYS  39          2HG       LYS  39 -15.242   6.338  -0.357
  299   2HG   LYS  39          1HG       LYS  39 -15.914   5.151  -1.478
  300   1HD   LYS  39          2HD       LYS  39 -14.176   3.601  -0.115
  301   2HD   LYS  39          1HD       LYS  39 -14.607   4.767   1.138
  302   1HE   LYS  39          2HE       LYS  39 -16.595   3.205  -0.504
  303   2HE   LYS  39          1HE       LYS  39 -16.049   2.740   1.106
  304   1HZ   LYS  39          1HZ       LYS  39 -18.198   3.993   1.010
  305   2HZ   LYS  39          2HZ       LYS  39 -17.318   5.355   0.531
  306   3HZ   LYS  39          3HZ       LYS  39 -17.032   4.652   2.043
  307    H    LYS  40           H        LYS  40 -11.119   4.573  -0.361
  308    HA   LYS  40           HA       LYS  40 -12.030   4.315   2.340
  309   1HB   LYS  40          2HB       LYS  40  -9.614   3.206   0.910
  310   2HB   LYS  40          1HB       LYS  40 -10.038   2.808   2.570
  311   1HG   LYS  40          2HG       LYS  40 -12.241   1.978   1.705
  312   2HG   LYS  40          1HG       LYS  40 -11.593   2.178   0.076
  313   1HD   LYS  40          2HD       LYS  40 -10.547   0.220   0.216
  314   2HD   LYS  40          1HD       LYS  40  -9.695   0.748   1.669
  315   1HE   LYS  40          2HE       LYS  40 -10.920  -0.614   2.924
  316   2HE   LYS  40          1HE       LYS  40 -12.406   0.129   2.336
  317   1HZ   LYS  40          1HZ       LYS  40 -12.488  -2.170   1.817
  318   2HZ   LYS  40          2HZ       LYS  40 -10.942  -2.150   1.130
  319   3HZ   LYS  40          3HZ       LYS  40 -12.219  -1.350   0.361
  320    H    ILE  41           H        ILE  41  -9.201   5.761   0.774
  321    HA   ILE  41           HA       ILE  41  -7.974   6.576   3.225
  322    HB   ILE  41           HB       ILE  41  -7.475   7.610   0.430
  323   1HG1  ILE  41          2HG1      ILE  41  -5.663   5.665   1.771
  324   2HG1  ILE  41          1HG1      ILE  41  -7.178   5.047   1.122
  325   1HG2  ILE  41          1HG2      ILE  41  -6.230   8.122   3.053
  326   2HG2  ILE  41          2HG2      ILE  41  -6.323   9.144   1.620
  327   3HG2  ILE  41          3HG2      ILE  41  -5.122   7.855   1.706
  328   1HD1  ILE  41          1HD1      ILE  41  -6.525   6.155  -1.058
  329   2HD1  ILE  41          2HD1      ILE  41  -5.581   4.748  -0.567
  330   3HD1  ILE  41          3HD1      ILE  41  -4.925   6.371  -0.348
  331    H    LYS  42           H        LYS  42 -10.398   7.912   1.145
  332    HA   LYS  42           HA       LYS  42 -10.199  10.621   1.576
  333   1HB   LYS  42          2HB       LYS  42 -11.892   9.228   0.186
  334   2HB   LYS  42          1HB       LYS  42 -12.869   9.276   1.647
  335   1HG   LYS  42          2HG       LYS  42 -12.444  11.839   1.518
  336   2HG   LYS  42          1HG       LYS  42 -12.073  11.496  -0.173
  337   1HD   LYS  42          2HD       LYS  42 -14.604  10.534   1.130
  338   2HD   LYS  42          1HD       LYS  42 -14.482  12.135   0.398
  339   1HE   LYS  42          2HE       LYS  42 -13.585  10.835  -1.665
  340   2HE   LYS  42          1HE       LYS  42 -14.344   9.441  -0.897
  341   1HZ   LYS  42          1HZ       LYS  42 -16.375  11.033  -0.763
  342   2HZ   LYS  42          2HZ       LYS  42 -16.031  10.225  -2.209
  343   3HZ   LYS  42          3HZ       LYS  42 -15.593  11.849  -2.024
  344    H    GLU  43           H        GLU  43 -11.135   8.144   3.812
  345    HA   GLU  43           HA       GLU  43 -11.658  10.212   5.833
  346   1HB   GLU  43          2HB       GLU  43 -12.960   7.494   5.632
  347   2HB   GLU  43          1HB       GLU  43 -13.220   8.657   6.926
  348   1HG   GLU  43          2HG       GLU  43 -14.406  10.107   5.557
  349   2HG   GLU  43          1HG       GLU  43 -13.765   9.389   4.079
  350    H    LEU  44           H        LEU  44 -10.878   6.742   5.569
  351    HA   LEU  44           HA       LEU  44  -9.633   6.543   8.076
  352   1HB   LEU  44          2HB       LEU  44 -10.101   4.858   5.809
  353   2HB   LEU  44          1HB       LEU  44  -8.433   4.671   6.317
  354    HG   LEU  44           HG       LEU  44  -9.904   3.011   7.363
  355   1HD1  LEU  44          1HD1      LEU  44  -7.939   3.586   8.579
  356   2HD1  LEU  44          2HD1      LEU  44  -9.266   3.481   9.735
  357   3HD1  LEU  44          3HD1      LEU  44  -8.684   5.057   9.203
  358   1HD2  LEU  44          1HD2      LEU  44 -11.982   4.150   7.485
  359   2HD2  LEU  44          2HD2      LEU  44 -11.290   5.447   8.459
  360   3HD2  LEU  44          3HD2      LEU  44 -11.478   3.833   9.145
  361    H    PHE  45           H        PHE  45  -7.752   7.282   8.787
  362    HA   PHE  45           HA       PHE  45  -5.873   8.467   6.919
  363   1HB   PHE  45          2HB       PHE  45  -6.469   9.677   8.977
  364   2HB   PHE  45          1HB       PHE  45  -5.827   8.353   9.943
  365    HD1  PHE  45           1HD      PHE  45  -4.649  10.440   7.077
  366    HD2  PHE  45           2HD      PHE  45  -3.794   8.772  10.897
  367    HE1  PHE  45           1HE      PHE  45  -2.427  11.496   7.036
  368    HE2  PHE  45           2HE      PHE  45  -1.570   9.825  10.864
  369    HZ   PHE  45           HZ       PHE  45  -0.884  11.189   8.931
  370    H    PHE  46           H        PHE  46  -5.215   6.449   5.933
  371    HA   PHE  46           HA       PHE  46  -3.893   4.437   7.468
  372   1HB   PHE  46          2HB       PHE  46  -3.877   4.972   4.491
  373   2HB   PHE  46          1HB       PHE  46  -3.213   3.533   5.257
  374    HD1  PHE  46           1HD      PHE  46  -5.792   4.481   3.353
  375    HD2  PHE  46           2HD      PHE  46  -5.126   2.656   7.138
  376    HE1  PHE  46           1HE      PHE  46  -7.999   3.402   3.215
  377    HE2  PHE  46           2HE      PHE  46  -7.333   1.572   7.008
  378    HZ   PHE  46           HZ       PHE  46  -8.773   1.947   5.046
  379    HA   PRO  47           HA       PRO  47  -0.044   6.776   7.696
  380   1HB   PRO  47          2HB       PRO  47   1.272   5.058   9.303
  381   2HB   PRO  47          1HB       PRO  47   0.005   6.128   9.918
  382   1HG   PRO  47          2HG       PRO  47  -0.166   3.235   9.156
  383   2HG   PRO  47          1HG       PRO  47  -0.819   4.046  10.591
  384   1HD   PRO  47          2HD       PRO  47  -2.341   3.457   8.427
  385   2HD   PRO  47          1HD       PRO  47  -2.639   4.879   9.446
  386    H    VAL  48           H        VAL  48  -0.613   3.609   6.496
  387    HA   VAL  48           HA       VAL  48   1.723   3.789   4.785
  388    HB   VAL  48           HB       VAL  48   1.151   1.206   6.211
  389   1HG1  VAL  48          1HG1      VAL  48   2.591   1.569   4.024
  390   2HG1  VAL  48          2HG1      VAL  48   3.082   0.429   5.276
  391   3HG1  VAL  48          3HG1      VAL  48   3.822   2.028   5.202
  392   1HG2  VAL  48          1HG2      VAL  48   1.614   2.794   7.937
  393   2HG2  VAL  48          2HG2      VAL  48   3.001   3.421   7.047
  394   3HG2  VAL  48          3HG2      VAL  48   3.041   1.783   7.703
  395    H    ILE  49           H        ILE  49   1.260   3.128   2.774
  396    HA   ILE  49           HA       ILE  49  -1.209   1.599   2.322
  397    HB   ILE  49           HB       ILE  49   0.005   3.461   0.293
  398   1HG1  ILE  49          2HG1      ILE  49  -0.497   4.754   2.349
  399   2HG1  ILE  49          1HG1      ILE  49  -1.535   5.205   1.001
  400   1HG2  ILE  49          1HG2      ILE  49  -2.466   1.865   0.553
  401   2HG2  ILE  49          2HG2      ILE  49  -1.518   2.271  -0.879
  402   3HG2  ILE  49          3HG2      ILE  49  -2.628   3.457  -0.191
  403   1HD1  ILE  49          1HD1      ILE  49  -2.204   3.808   3.530
  404   2HD1  ILE  49          2HD1      ILE  49  -3.140   3.427   2.086
  405   3HD1  ILE  49          3HD1      ILE  49  -3.067   5.087   2.676
  406    H    VAL  50           H        VAL  50  -1.180   0.234   0.361
  407    HA   VAL  50           HA       VAL  50   1.453  -0.438  -0.669
  408    HB   VAL  50           HB       VAL  50  -0.272  -2.512   0.692
  409   1HG1  VAL  50          1HG1      VAL  50   2.453  -2.820  -0.566
  410   2HG1  VAL  50          2HG1      VAL  50   0.940  -3.305  -1.332
  411   3HG1  VAL  50          3HG1      VAL  50   1.466  -4.089   0.159
  412   1HG2  VAL  50          1HG2      VAL  50   1.613  -2.689   2.265
  413   2HG2  VAL  50          2HG2      VAL  50   0.862  -1.094   2.297
  414   3HG2  VAL  50          3HG2      VAL  50   2.395  -1.330   1.458
  415    H    LEU  51           H        LEU  51   0.877   0.096  -2.682
  416    HA   LEU  51           HA       LEU  51  -1.591  -0.788  -3.868
  417   1HB   LEU  51          2HB       LEU  51  -0.692   1.359  -4.502
  418   2HB   LEU  51          1HB       LEU  51   0.808   0.621  -5.027
  419    HG   LEU  51           HG       LEU  51  -0.387  -0.522  -6.847
  420   1HD1  LEU  51          1HD1      LEU  51  -2.560  -0.870  -6.168
  421   2HD1  LEU  51          2HD1      LEU  51  -2.749   0.480  -7.286
  422   3HD1  LEU  51          3HD1      LEU  51  -2.743   0.769  -5.546
  423   1HD2  LEU  51          1HD2      LEU  51   0.431   2.039  -6.785
  424   2HD2  LEU  51          2HD2      LEU  51  -1.264   2.270  -7.211
  425   3HD2  LEU  51          3HD2      LEU  51  -0.230   1.260  -8.222
  426    H    ASP  52           H        ASP  52  -1.951  -2.537  -5.037
  427    HA   ASP  52           HA       ASP  52   0.342  -4.198  -5.852
  428   1HB   ASP  52          2HB       ASP  52  -1.973  -4.831  -4.274
  429   2HB   ASP  52          1HB       ASP  52  -2.014  -5.775  -5.759
  430    H    VAL  53           H        VAL  53   0.503  -3.272  -7.900
  431    HA   VAL  53           HA       VAL  53  -1.684  -2.876  -9.642
  432    HB   VAL  53           HB       VAL  53   0.004  -2.601 -11.413
  433   1HG1  VAL  53          1HG1      VAL  53  -0.475  -0.693 -10.054
  434   2HG1  VAL  53          2HG1      VAL  53   1.267  -0.742 -10.333
  435   3HG1  VAL  53          3HG1      VAL  53   0.607  -1.264  -8.782
  436   1HG2  VAL  53          1HG2      VAL  53   2.133  -3.317 -11.284
  437   2HG2  VAL  53          2HG2      VAL  53   1.501  -4.402 -10.048
  438   3HG2  VAL  53          3HG2      VAL  53   2.282  -2.892  -9.580
  439    H    TRP  54           H        TRP  54  -2.593  -5.133  -9.105
  440    HA   TRP  54           HA       TRP  54  -1.411  -7.391 -10.379
  441   1HB   TRP  54          2HB       TRP  54  -2.915  -7.749  -8.525
  442   2HB   TRP  54          1HB       TRP  54  -4.218  -6.905  -9.355
  443    HD1  TRP  54           HD       TRP  54  -5.890  -8.425 -10.567
  444    HE1  TRP  54           1HE      TRP  54  -5.898 -10.864 -11.394
  445    HE3  TRP  54           3HE      TRP  54  -1.049  -9.661  -9.494
  446    HZ2  TRP  54           2HZ      TRP  54  -4.091 -13.026 -11.565
  447    HZ3  TRP  54           3HZ      TRP  54  -0.266 -11.935 -10.018
  448    HH2  TRP  54           HH       TRP  54  -1.757 -13.582 -11.032
  449    H    MET  55           H        MET  55  -4.747  -6.743 -11.210
  450    HA   MET  55           HA       MET  55  -3.953  -6.154 -13.969
  451   1HB   MET  55          2HB       MET  55  -4.714  -8.647 -13.288
  452   2HB   MET  55          1HB       MET  55  -6.286  -7.940 -13.635
  453   1HG   MET  55          2HG       MET  55  -4.858  -7.107 -15.781
  454   2HG   MET  55          1HG       MET  55  -4.092  -8.657 -15.441
  455   1HE   MET  55          1HE       MET  55  -4.649 -10.409 -16.851
  456   2HE   MET  55          2HE       MET  55  -6.256 -11.094 -17.090
  457   3HE   MET  55          3HE       MET  55  -5.542 -11.064 -15.478
  458    HA   PRO  56           HA       PRO  56  -7.882  -3.873 -12.521
  459   1HB   PRO  56          2HB       PRO  56  -7.049  -1.768 -11.099
  460   2HB   PRO  56          1HB       PRO  56  -7.293  -3.345 -10.342
  461   1HG   PRO  56          2HG       PRO  56  -4.755  -2.029 -11.207
  462   2HG   PRO  56          1HG       PRO  56  -5.083  -2.970  -9.744
  463   1HD   PRO  56          2HD       PRO  56  -3.836  -3.959 -12.003
  464   2HD   PRO  56          1HD       PRO  56  -4.673  -4.944 -10.789
  465    H    ASP  57           H        ASP  57  -8.040  -1.171 -12.632
  466    HA   ASP  57           HA       ASP  57  -6.710  -0.498 -15.174
  467   1HB   ASP  57          2HB       ASP  57  -9.163  -0.827 -15.361
  468   2HB   ASP  57          1HB       ASP  57  -9.401   0.470 -14.194
  469    H    GLY  58           H        GLY  58  -5.761   0.007 -12.423
  470   1HA   GLY  58          2HA       GLY  58  -6.111   2.857 -12.020
  471   2HA   GLY  58          1HA       GLY  58  -5.142   1.773 -11.033
  472    H    ASP  59           H        ASP  59  -2.981   1.583 -11.417
  473    HA   ASP  59           HA       ASP  59  -0.913   2.195 -12.141
  474   1HB   ASP  59          2HB       ASP  59  -2.500   1.888 -14.643
  475   2HB   ASP  59          1HB       ASP  59  -0.919   2.654 -14.773
  476    H    GLY  60           H        GLY  60  -2.262   4.234 -10.951
  477   1HA   GLY  60          2HA       GLY  60  -1.948   6.583 -12.674
  478   2HA   GLY  60          1HA       GLY  60  -2.762   6.548 -11.118
  479    H    VAL  61           H        VAL  61   0.135   7.206 -12.770
  480    HA   VAL  61           HA       VAL  61   2.040   6.941 -10.738
  481    HB   VAL  61           HB       VAL  61   1.984   8.983 -12.967
  482   1HG1  VAL  61          1HG1      VAL  61   4.208   7.903 -11.258
  483   2HG1  VAL  61          2HG1      VAL  61   3.643   9.570 -11.369
  484   3HG1  VAL  61          3HG1      VAL  61   4.465   8.825 -12.740
  485   1HG2  VAL  61          1HG2      VAL  61   3.519   6.442 -13.143
  486   2HG2  VAL  61          2HG2      VAL  61   2.821   7.432 -14.424
  487   3HG2  VAL  61          3HG2      VAL  61   1.783   6.396 -13.445
  488    H    ASN  62           H        ASN  62  -0.127   9.596 -11.594
  489    HA   ASN  62           HA       ASN  62   0.923  11.466  -9.745
  490   1HB   ASN  62          2HB       ASN  62  -1.098  11.424 -11.733
  491   2HB   ASN  62          1HB       ASN  62  -1.858  11.961 -10.239
  492   1HD2  ASN  62          1HD2      ASN  62   1.349  12.451 -11.679
  493   2HD2  ASN  62          2HD2      ASN  62   1.305  14.177 -11.606
  494    H    PHE  63           H        PHE  63  -0.932   8.664  -9.272
  495    HA   PHE  63           HA       PHE  63  -2.659   9.331  -7.213
  496   1HB   PHE  63          2HB       PHE  63  -2.576   7.110  -8.309
  497   2HB   PHE  63          1HB       PHE  63  -1.075   6.765  -7.452
  498    HD1  PHE  63           1HD      PHE  63  -4.424   8.129  -6.530
  499    HD2  PHE  63           2HD      PHE  63  -1.346   5.310  -5.699
  500    HE1  PHE  63           1HE      PHE  63  -5.712   7.297  -4.610
  501    HE2  PHE  63           2HE      PHE  63  -2.632   4.470  -3.776
  502    HZ   PHE  63           HZ       PHE  63  -4.820   5.466  -3.231
  503    H    ILE  64           H        ILE  64   0.801   8.628  -7.077
  504    HA   ILE  64           HA       ILE  64   1.206   8.384  -4.366
  505    HB   ILE  64           HB       ILE  64   3.007   9.912  -6.250
  506   1HG1  ILE  64          2HG1      ILE  64   3.712   7.139  -5.710
  507   2HG1  ILE  64          1HG1      ILE  64   2.142   7.277  -6.493
  508   1HG2  ILE  64          1HG2      ILE  64   4.567   9.929  -4.650
  509   2HG2  ILE  64          2HG2      ILE  64   4.218   8.270  -4.165
  510   3HG2  ILE  64          3HG2      ILE  64   3.241   9.596  -3.536
  511   1HD1  ILE  64          1HD1      ILE  64   4.809   7.690  -7.563
  512   2HD1  ILE  64          2HD1      ILE  64   3.688   8.992  -7.959
  513   3HD1  ILE  64          3HD1      ILE  64   3.295   7.327  -8.391
  514    H    ASP  65           H        ASP  65   0.459  11.257  -6.200
  515    HA   ASP  65           HA       ASP  65   1.144  13.098  -4.111
  516   1HB   ASP  65          2HB       ASP  65   0.772  13.405  -6.766
  517   2HB   ASP  65          1HB       ASP  65  -0.812  13.913  -6.189
  518    H    PHE  66           H        PHE  66  -1.746  11.398  -5.137
  519    HA   PHE  66           HA       PHE  66  -3.653  12.839  -3.673
  520   1HB   PHE  66          2HB       PHE  66  -4.426  11.272  -5.304
  521   2HB   PHE  66          1HB       PHE  66  -3.538   9.950  -4.556
  522    HD1  PHE  66           1HD      PHE  66  -4.435   8.747  -2.700
  523    HD2  PHE  66           2HD      PHE  66  -6.479  12.130  -4.275
  524    HE1  PHE  66           1HE      PHE  66  -6.436   8.136  -1.405
  525    HE2  PHE  66           2HE      PHE  66  -8.484  11.528  -2.982
  526    HZ   PHE  66           HZ       PHE  66  -8.464   9.528  -1.545
  527    H    ILE  67           H        ILE  67  -1.721   9.993  -2.802
  528    HA   ILE  67           HA       ILE  67  -2.741   9.605  -0.229
  529    HB   ILE  67           HB       ILE  67   0.005   9.010  -1.343
  530   1HG1  ILE  67          2HG1      ILE  67  -1.067   6.618  -1.056
  531   2HG1  ILE  67          1HG1      ILE  67  -2.580   7.516  -1.115
  532   1HG2  ILE  67          1HG2      ILE  67   0.359   9.096   0.981
  533   2HG2  ILE  67          2HG2      ILE  67   0.111   7.388   0.619
  534   3HG2  ILE  67          3HG2      ILE  67  -1.194   8.337   1.330
  535   1HD1  ILE  67          1HD1      ILE  67  -0.740   8.261  -3.237
  536   2HD1  ILE  67          2HD1      ILE  67  -2.439   7.795  -3.314
  537   3HD1  ILE  67          3HD1      ILE  67  -1.187   6.555  -3.266
  538    H    LYS  68           H        LYS  68  -0.049  11.622  -1.371
  539    HA   LYS  68           HA       LYS  68   0.577  12.567   1.271
  540   1HB   LYS  68          2HB       LYS  68   1.439  13.548  -1.457
  541   2HB   LYS  68          1HB       LYS  68   2.073  14.158   0.066
  542   1HG   LYS  68          2HG       LYS  68   2.244  11.273  -0.088
  543   2HG   LYS  68          1HG       LYS  68   3.078  12.057  -1.430
  544   1HD   LYS  68          2HD       LYS  68   3.911  13.595   0.628
  545   2HD   LYS  68          1HD       LYS  68   3.705  12.048   1.450
  546   1HE   LYS  68          2HE       LYS  68   5.141  10.974  -0.217
  547   2HE   LYS  68          1HE       LYS  68   5.343  12.521  -1.039
  548   1HZ   LYS  68          1HZ       LYS  68   6.488  13.396   0.839
  549   2HZ   LYS  68          2HZ       LYS  68   7.201  11.908   0.463
  550   3HZ   LYS  68          3HZ       LYS  68   6.143  12.032   1.777
  551    H    GLU  69           H        GLU  69  -1.614  13.461  -1.235
  552    HA   GLU  69           HA       GLU  69  -1.953  16.192  -0.622
  553   1HB   GLU  69          2HB       GLU  69  -2.753  14.979  -2.694
  554   2HB   GLU  69          1HB       GLU  69  -4.067  14.345  -1.715
  555   1HG   GLU  69          2HG       GLU  69  -4.977  16.501  -1.374
  556   2HG   GLU  69          1HG       GLU  69  -3.541  17.283  -2.031
  557    H    ASN  70           H        ASN  70  -3.305  13.246   0.683
  558    HA   ASN  70           HA       ASN  70  -4.597  14.834   2.798
  559   1HB   ASN  70          2HB       ASN  70  -5.815  12.228   1.998
  560   2HB   ASN  70          1HB       ASN  70  -6.577  13.655   2.690
  561   1HD2  ASN  70          1HD2      ASN  70  -4.927  12.568  -0.249
  562   2HD2  ASN  70          2HD2      ASN  70  -5.920  13.458  -1.345
  563    H    SER  71           H        SER  71  -2.016  13.212   2.438
  564    HA   SER  71           HA       SER  71  -1.926  12.165   5.072
  565   1HB   SER  71          2HB       SER  71  -3.101  10.389   3.403
  566   2HB   SER  71          1HB       SER  71  -1.410   9.951   3.172
  567    HG   SER  71           HG       SER  71  -2.777   9.004   5.016
  568    HA   PRO  72           HA       PRO  72   2.140  13.156   3.137
  569   1HB   PRO  72          2HB       PRO  72   2.578  15.232   5.031
  570   2HB   PRO  72          1HB       PRO  72   2.202  15.406   3.318
  571   1HG   PRO  72          2HG       PRO  72   0.537  16.149   5.418
  572   2HG   PRO  72          1HG       PRO  72   0.027  15.894   3.741
  573   1HD   PRO  72          2HD       PRO  72  -0.200  14.071   6.095
  574   2HD   PRO  72          1HD       PRO  72  -1.322  14.314   4.737
  575    H    ASP  73           H        ASP  73   1.051  12.193   6.176
  576    HA   ASP  73           HA       ASP  73   3.785  11.765   7.163
  577   1HB   ASP  73          2HB       ASP  73   1.872  12.968   8.512
  578   2HB   ASP  73          1HB       ASP  73   1.399  11.314   8.885
  579    H    SER  74           H        SER  74   1.896  10.138   5.262
  580    HA   SER  74           HA       SER  74   1.884   7.597   6.685
  581   1HB   SER  74          2HB       SER  74   0.866   7.199   4.111
  582   2HB   SER  74          1HB       SER  74  -0.062   7.437   5.585
  583    HG   SER  74           HG       SER  74   0.671   9.328   3.634
  584    H    VAL  75           H        VAL  75   2.096   5.926   4.374
  585    HA   VAL  75           HA       VAL  75   4.690   6.499   3.204
  586    HB   VAL  75           HB       VAL  75   4.297   3.913   4.709
  587   1HG1  VAL  75          1HG1      VAL  75   6.394   5.073   2.928
  588   2HG1  VAL  75          2HG1      VAL  75   5.782   3.421   3.021
  589   3HG1  VAL  75          3HG1      VAL  75   6.900   4.019   4.247
  590   1HG2  VAL  75          1HG2      VAL  75   4.507   5.770   6.277
  591   2HG2  VAL  75          2HG2      VAL  75   5.960   6.325   5.446
  592   3HG2  VAL  75          3HG2      VAL  75   5.962   4.773   6.287
  593    H    VAL  76           H        VAL  76   4.875   5.721   1.212
  594    HA   VAL  76           HA       VAL  76   2.777   3.864   0.290
  595    HB   VAL  76           HB       VAL  76   4.265   5.869  -1.404
  596   1HG1  VAL  76          1HG1      VAL  76   3.490   4.456  -2.983
  597   2HG1  VAL  76          2HG1      VAL  76   1.984   5.335  -2.722
  598   3HG1  VAL  76          3HG1      VAL  76   2.248   3.784  -1.925
  599   1HG2  VAL  76          1HG2      VAL  76   1.416   6.317  -0.900
  600   2HG2  VAL  76          2HG2      VAL  76   2.757   7.462  -0.932
  601   3HG2  VAL  76          3HG2      VAL  76   2.441   6.512   0.521
  602    H    ILE  77           H        ILE  77   3.570   1.879   0.080
  603    HA   ILE  77           HA       ILE  77   6.349   1.473  -0.690
  604    HB   ILE  77           HB       ILE  77   4.258  -0.603  -0.025
  605   1HG1  ILE  77          2HG1      ILE  77   4.674   0.971   1.848
  606   2HG1  ILE  77          1HG1      ILE  77   5.219  -0.665   2.205
  607   1HG2  ILE  77          1HG2      ILE  77   6.178  -1.415  -1.339
  608   2HG2  ILE  77          2HG2      ILE  77   6.130  -2.104   0.284
  609   3HG2  ILE  77          3HG2      ILE  77   7.265  -0.808  -0.090
  610   1HD1  ILE  77          1HD1      ILE  77   7.464   0.477   1.152
  611   2HD1  ILE  77          2HD1      ILE  77   7.103   0.315   2.870
  612   3HD1  ILE  77          3HD1      ILE  77   6.728   1.818   2.027
  613    H    VAL  78           H        VAL  78   3.123   0.454  -1.818
  614    HA   VAL  78           HA       VAL  78   2.372  -0.271  -3.846
  615    HB   VAL  78           HB       VAL  78   4.598   1.441  -4.967
  616   1HG1  VAL  78          1HG1      VAL  78   2.437   1.675  -6.623
  617   2HG1  VAL  78          2HG1      VAL  78   2.335  -0.013  -6.122
  618   3HG1  VAL  78          3HG1      VAL  78   3.804   0.592  -6.885
  619   1HG2  VAL  78          1HG2      VAL  78   1.833   2.476  -4.672
  620   2HG2  VAL  78          2HG2      VAL  78   3.375   3.330  -4.624
  621   3HG2  VAL  78          3HG2      VAL  78   2.838   2.402  -3.225
  622    H    ILE  79           H        ILE  79   2.806  -2.425  -3.867
  623    HA   ILE  79           HA       ILE  79   5.435  -3.304  -4.837
  624    HB   ILE  79           HB       ILE  79   3.395  -5.263  -3.890
  625   1HG1  ILE  79          2HG1      ILE  79   5.094  -3.653  -1.980
  626   2HG1  ILE  79          1HG1      ILE  79   3.375  -3.378  -2.236
  627   1HG2  ILE  79          1HG2      ILE  79   5.153  -6.615  -3.988
  628   2HG2  ILE  79          2HG2      ILE  79   6.013  -5.617  -2.816
  629   3HG2  ILE  79          3HG2      ILE  79   6.147  -5.267  -4.539
  630   1HD1  ILE  79          1HD1      ILE  79   3.436  -4.681  -0.328
  631   2HD1  ILE  79          2HD1      ILE  79   4.739  -5.698  -0.944
  632   3HD1  ILE  79          3HD1      ILE  79   3.111  -5.856  -1.603
  633    H    THR  80           H        THR  80   4.840  -5.740  -5.937
  634    HA   THR  80           HA       THR  80   3.996  -6.826  -7.753
  635    HB   THR  80           HB       THR  80   1.985  -4.621  -8.156
  636    HG1  THR  80           1HG      THR  80   0.645  -5.935  -6.732
  637   1HG2  THR  80          1HG2      THR  80   0.536  -6.437  -8.889
  638   2HG2  THR  80          2HG2      THR  80   1.840  -7.591  -8.609
  639   3HG2  THR  80          3HG2      THR  80   2.011  -6.353  -9.853
  640    H    GLY  81           H        GLY  81   5.341  -6.803  -9.418
  641   1HA   GLY  81          2HA       GLY  81   5.226  -5.226 -11.629
  642   2HA   GLY  81          1HA       GLY  81   6.292  -4.332 -10.557
  643    H    HIS  82           H        HIS  82   5.835  -7.508 -12.067
  644    HA   HIS  82           HA       HIS  82   8.674  -8.095 -11.735
  645   1HB   HIS  82          2HB       HIS  82   6.260  -9.660 -12.030
  646   2HB   HIS  82          1HB       HIS  82   7.467 -10.160 -13.209
  647    HD1  HIS  82           1HD      HIS  82   9.955  -9.648 -11.315
  648    HD2  HIS  82           2HD      HIS  82   6.554 -11.833 -10.357
  649    HE1  HIS  82           1HE      HIS  82  10.660 -11.219  -9.481
  650    HE2  HIS  82           2HE      HIS  82   8.608 -12.591  -8.979
  651    H    GLY  83           H        GLY  83   6.292  -8.027 -14.392
  652   1HA   GLY  83          2HA       GLY  83   8.479  -7.882 -16.326
  653   2HA   GLY  83          1HA       GLY  83   6.780  -8.126 -16.698
  654    H    SER  84           H        SER  84   8.396  -5.600 -14.789
  655    HA   SER  84           HA       SER  84   8.292  -3.583 -16.727
  656   1HB   SER  84          2HB       SER  84   6.369  -2.253 -15.825
  657   2HB   SER  84          1HB       SER  84   5.886  -3.747 -16.626
  658    HG   SER  84           HG       SER  84   4.882  -3.282 -14.528
  659    H    VAL  85           H        VAL  85  10.324  -3.254 -15.738
  660    HA   VAL  85           HA       VAL  85  10.397  -2.391 -12.964
  661    HB   VAL  85           HB       VAL  85  12.828  -2.219 -13.281
  662   1HG1  VAL  85          1HG1      VAL  85  11.586  -4.789 -14.254
  663   2HG1  VAL  85          2HG1      VAL  85  11.937  -4.342 -12.585
  664   3HG1  VAL  85          3HG1      VAL  85  13.259  -4.622 -13.719
  665   1HG2  VAL  85          1HG2      VAL  85  13.354  -3.460 -15.686
  666   2HG2  VAL  85          2HG2      VAL  85  13.549  -1.742 -15.342
  667   3HG2  VAL  85          3HG2      VAL  85  12.062  -2.329 -16.088
  668    H    ASP  86           H        ASP  86   9.344  -0.857 -15.550
  669    HA   ASP  86           HA       ASP  86  10.801   1.644 -15.064
  670   1HB   ASP  86          2HB       ASP  86   8.916   0.913 -17.315
  671   2HB   ASP  86          1HB       ASP  86   9.798   2.431 -17.165
  672    H    THR  87           H        THR  87   8.107   0.116 -13.953
  673    HA   THR  87           HA       THR  87   6.421   2.495 -13.852
  674    HB   THR  87           HB       THR  87   5.637  -0.010 -14.189
  675    HG1  THR  87           1HG      THR  87   4.234   1.680 -12.403
  676   1HG2  THR  87          1HG2      THR  87   6.673  -0.613 -11.886
  677   2HG2  THR  87          2HG2      THR  87   5.093  -1.255 -12.334
  678   3HG2  THR  87          3HG2      THR  87   5.207   0.124 -11.240
  679    H    ALA  88           H        ALA  88   8.375   0.428 -11.832
  680    HA   ALA  88           HA       ALA  88   7.735   1.449  -9.312
  681   1HB   ALA  88          1HB       ALA  88   9.973   0.622  -8.649
  682   2HB   ALA  88          2HB       ALA  88  10.343   0.346 -10.351
  683   3HB   ALA  88          3HB       ALA  88   9.050  -0.565  -9.572
  684    H    VAL  89           H        VAL  89  10.461   2.270 -11.423
  685    HA   VAL  89           HA       VAL  89  11.428   4.422  -9.940
  686    HB   VAL  89           HB       VAL  89  12.635   5.097 -11.932
  687   1HG1  VAL  89          1HG1      VAL  89  12.423   2.097 -11.705
  688   2HG1  VAL  89          2HG1      VAL  89  13.461   3.148 -10.741
  689   3HG1  VAL  89          3HG1      VAL  89  13.747   2.974 -12.472
  690   1HG2  VAL  89          1HG2      VAL  89  12.085   3.468 -13.992
  691   2HG2  VAL  89          2HG2      VAL  89  11.346   5.057 -13.797
  692   3HG2  VAL  89          3HG2      VAL  89  10.472   3.611 -13.294
  693    H    LYS  90           H        LYS  90   8.772   4.230 -12.208
  694    HA   LYS  90           HA       LYS  90   8.533   7.064 -12.570
  695   1HB   LYS  90          2HB       LYS  90   7.744   5.438 -14.252
  696   2HB   LYS  90          1HB       LYS  90   6.518   4.884 -13.119
  697   1HG   LYS  90          2HG       LYS  90   5.410   7.004 -13.179
  698   2HG   LYS  90          1HG       LYS  90   6.716   7.709 -14.135
  699   1HD   LYS  90          2HD       LYS  90   5.240   5.320 -15.159
  700   2HD   LYS  90          1HD       LYS  90   4.523   6.925 -15.305
  701   1HE   LYS  90          2HE       LYS  90   5.683   6.581 -17.321
  702   2HE   LYS  90          1HE       LYS  90   6.717   7.644 -16.366
  703   1HZ   LYS  90          1HZ       LYS  90   7.654   5.518 -17.568
  704   2HZ   LYS  90          2HZ       LYS  90   7.152   4.761 -16.140
  705   3HZ   LYS  90          3HZ       LYS  90   8.269   6.030 -16.078
  706    H    ALA  91           H        ALA  91   7.648   4.916 -10.084
  707    HA   ALA  91           HA       ALA  91   5.664   6.834  -9.057
  708   1HB   ALA  91          1HB       ALA  91   4.847   4.941  -7.655
  709   2HB   ALA  91          2HB       ALA  91   5.965   3.884  -8.518
  710   3HB   ALA  91          3HB       ALA  91   4.658   4.688  -9.390
  711    H    ILE  92           H        ILE  92   8.365   4.743  -8.096
  712    HA   ILE  92           HA       ILE  92   8.502   5.678  -5.429
  713    HB   ILE  92           HB       ILE  92  10.412   4.390  -5.160
  714   1HG1  ILE  92          2HG1      ILE  92  10.972   4.771  -8.110
  715   2HG1  ILE  92          1HG1      ILE  92  11.867   5.475  -6.770
  716   1HG2  ILE  92          1HG2      ILE  92   9.794   2.696  -7.405
  717   2HG2  ILE  92          2HG2      ILE  92   8.318   3.312  -6.663
  718   3HG2  ILE  92          3HG2      ILE  92   9.497   2.438  -5.687
  719   1HD1  ILE  92          1HD1      ILE  92  13.228   3.738  -6.800
  720   2HD1  ILE  92          2HD1      ILE  92  12.281   2.995  -8.088
  721   3HD1  ILE  92          3HD1      ILE  92  11.877   2.679  -6.401
  722    H    LYS  93           H        LYS  93  10.568   6.725  -4.576
  723    HA   LYS  93           HA       LYS  93  12.026   8.464  -4.452
  724   1HB   LYS  93          2HB       LYS  93  11.993   7.887  -7.291
  725   2HB   LYS  93          1HB       LYS  93  12.182   9.611  -7.001
  726   1HG   LYS  93          2HG       LYS  93  13.945   8.606  -5.214
  727   2HG   LYS  93          1HG       LYS  93  14.030   7.388  -6.488
  728   1HD   LYS  93          2HD       LYS  93  14.335   9.306  -8.115
  729   2HD   LYS  93          1HD       LYS  93  14.562  10.343  -6.705
  730   1HE   LYS  93          2HE       LYS  93  16.732   9.804  -6.991
  731   2HE   LYS  93          1HE       LYS  93  16.272   8.352  -6.104
  732   1HZ   LYS  93          1HZ       LYS  93  17.499   7.764  -8.072
  733   2HZ   LYS  93          2HZ       LYS  93  16.430   8.629  -9.057
  734   3HZ   LYS  93          3HZ       LYS  93  15.897   7.245  -8.244
  735    H    LYS  94           H        LYS  94   9.247   9.046  -6.581
  736    HA   LYS  94           HA       LYS  94   9.063  11.817  -6.112
  737   1HB   LYS  94          2HB       LYS  94   7.680   9.890  -7.622
  738   2HB   LYS  94          1HB       LYS  94   6.484  10.677  -6.602
  739   1HG   LYS  94          2HG       LYS  94   6.573  12.580  -7.765
  740   2HG   LYS  94          1HG       LYS  94   8.333  12.535  -7.885
  741   1HD   LYS  94          2HD       LYS  94   6.681  10.637  -9.500
  742   2HD   LYS  94          1HD       LYS  94   6.873  12.308 -10.035
  743   1HE   LYS  94          2HE       LYS  94   9.432  11.343  -9.290
  744   2HE   LYS  94          1HE       LYS  94   8.679  10.122 -10.314
  745   1HZ   LYS  94          1HZ       LYS  94   9.989  11.883 -11.497
  746   2HZ   LYS  94          2HZ       LYS  94   8.789  12.989 -11.052
  747   3HZ   LYS  94          3HZ       LYS  94   8.403  11.675 -12.047
  748    H    GLY  95           H        GLY  95   8.351   9.140  -4.135
  749   1HA   GLY  95          2HA       GLY  95   7.823  10.534  -1.833
  750   2HA   GLY  95          1HA       GLY  95   6.251  10.316  -2.588
  751    H    ALA  96           H        ALA  96   7.058   7.729  -3.767
  752    HA   ALA  96           HA       ALA  96   6.107   6.025  -1.766
  753   1HB   ALA  96          1HB       ALA  96   6.089   4.453  -3.371
  754   2HB   ALA  96          2HB       ALA  96   7.768   4.750  -3.823
  755   3HB   ALA  96          3HB       ALA  96   6.489   5.796  -4.442
  756    H    TYR  97           H        TYR  97   7.500   3.866  -1.387
  757    HA   TYR  97           HA       TYR  97  10.031   4.760  -0.173
  758   1HB   TYR  97          2HB       TYR  97   8.325   4.193   1.482
  759   2HB   TYR  97          1HB       TYR  97   8.128   2.603   0.759
  760    HD1  TYR  97           1HD      TYR  97  10.685   4.774   2.386
  761    HD2  TYR  97           2HD      TYR  97   9.378   0.810   1.561
  762    HE1  TYR  97           1HE      TYR  97  12.436   3.894   3.871
  763    HE2  TYR  97           2HE      TYR  97  11.124  -0.081   3.044
  764    HH   TYR  97           HH       TYR  97  13.237   0.560   3.996
  765    H    GLU  98           H        GLU  98   9.543   3.695  -2.850
  766    HA   GLU  98           HA       GLU  98  10.883   2.526  -4.297
  767   1HB   GLU  98          2HB       GLU  98  12.774   1.468  -3.629
  768   2HB   GLU  98          1HB       GLU  98  12.444   2.331  -2.137
  769   1HG   GLU  98          2HG       GLU  98  11.077   0.089  -1.636
  770   2HG   GLU  98          1HG       GLU  98  12.289  -0.557  -2.742
  771    H    PHE  99           H        PHE  99  10.838   0.443  -5.342
  772    HA   PHE  99           HA       PHE  99   8.319  -0.904  -4.852
  773   1HB   PHE  99          2HB       PHE  99  10.065  -0.473  -7.108
  774   2HB   PHE  99          1HB       PHE  99   9.669  -2.180  -6.965
  775    HD1  PHE  99           1HD      PHE  99   7.992  -2.790  -8.386
  776    HD2  PHE  99           2HD      PHE  99   7.771   1.000  -6.464
  777    HE1  PHE  99           1HE      PHE  99   5.820  -2.376  -9.465
  778    HE2  PHE  99           2HE      PHE  99   5.595   1.421  -7.538
  779    HZ   PHE  99           HZ       PHE  99   4.618  -0.269  -9.038
  780    H    LEU 100           H        LEU 100   8.462  -2.281  -3.151
  781    HA   LEU 100           HA       LEU 100  10.733  -3.878  -2.581
  782   1HB   LEU 100          2HB       LEU 100   9.254  -3.225  -0.823
  783   2HB   LEU 100          1HB       LEU 100   7.874  -3.927  -1.643
  784    HG   LEU 100           HG       LEU 100   8.753  -6.167  -1.262
  785   1HD1  LEU 100          1HD1      LEU 100  10.756  -6.616  -0.143
  786   2HD1  LEU 100          2HD1      LEU 100  10.925  -4.950   0.409
  787   3HD1  LEU 100          3HD1      LEU 100  11.170  -5.345  -1.292
  788   1HD2  LEU 100          1HD2      LEU 100   8.971  -5.605   1.440
  789   2HD2  LEU 100          2HD2      LEU 100   7.489  -5.953   0.551
  790   3HD2  LEU 100          3HD2      LEU 100   7.996  -4.282   0.800
  791    H    GLU 101           H        GLU 101  11.267  -5.866  -3.276
  792    HA   GLU 101           HA       GLU 101   9.939  -7.039  -5.478
  793   1HB   GLU 101          2HB       GLU 101  11.976  -8.267  -3.608
  794   2HB   GLU 101          1HB       GLU 101  11.518  -8.902  -5.182
  795   1HG   GLU 101          2HG       GLU 101  12.389  -6.121  -5.259
  796   2HG   GLU 101          1HG       GLU 101  13.624  -7.237  -4.681
  797    H    LYS 102           H        LYS 102   9.778  -9.738  -5.035
  798    HA   LYS 102           HA       LYS 102   7.900 -10.046  -2.803
  799   1HB   LYS 102          2HB       LYS 102   7.376 -10.537  -5.708
  800   2HB   LYS 102          1HB       LYS 102   6.562 -11.524  -4.502
  801   1HG   LYS 102          2HG       LYS 102   6.486  -8.555  -4.248
  802   2HG   LYS 102          1HG       LYS 102   5.440  -9.359  -5.420
  803   1HD   LYS 102          2HD       LYS 102   4.003  -9.727  -3.759
  804   2HD   LYS 102          1HD       LYS 102   5.179 -10.851  -3.077
  805   1HE   LYS 102          2HE       LYS 102   5.435  -7.926  -2.531
  806   2HE   LYS 102          1HE       LYS 102   4.251  -8.878  -1.637
  807   1HZ   LYS 102          1HZ       LYS 102   6.469 -10.395  -1.458
  808   2HZ   LYS 102          2HZ       LYS 102   5.957  -9.297  -0.279
  809   3HZ   LYS 102          3HZ       LYS 102   7.124  -8.835  -1.412
  810    HA   PRO 103           HA       PRO 103  10.771 -13.753  -3.522
  811   1HB   PRO 103          2HB       PRO 103  12.735 -13.302  -1.759
  812   2HB   PRO 103          1HB       PRO 103  12.773 -12.592  -3.379
  813   1HG   PRO 103          2HG       PRO 103  11.954 -11.339  -0.783
  814   2HG   PRO 103          1HG       PRO 103  12.971 -10.671  -2.074
  815   1HD   PRO 103          2HD       PRO 103  10.318 -10.074  -1.781
  816   2HD   PRO 103          1HD       PRO 103  11.167 -10.047  -3.338
  817    H    PHE 104           H        PHE 104  10.390 -15.565  -2.356
  818    HA   PHE 104           HA       PHE 104   9.580 -16.933  -0.730
  819   1HB   PHE 104          2HB       PHE 104  11.533 -15.388   0.447
  820   2HB   PHE 104          1HB       PHE 104  10.167 -15.175   1.538
  821    HD1  PHE 104           1HD      PHE 104  12.733 -17.417   0.355
  822    HD2  PHE 104           2HD      PHE 104   9.133 -17.161   2.609
  823    HE1  PHE 104           1HE      PHE 104  13.230 -19.595   1.389
  824    HE2  PHE 104           2HE      PHE 104   9.623 -19.338   3.648
  825    HZ   PHE 104           HZ       PHE 104  11.673 -20.558   3.036
  826    H    SER 105           H        SER 105   7.754 -15.096  -1.893
  827    HA   SER 105           HA       SER 105   5.586 -14.453  -1.655
  828   1HB   SER 105          2HB       SER 105   5.298 -15.402   1.133
  829   2HB   SER 105          1HB       SER 105   4.277 -15.701  -0.273
  830    HG   SER 105           HG       SER 105   5.666 -17.295  -0.933
  831    H    VAL 106           H        VAL 106   4.109 -13.445   0.385
  832    HA   VAL 106           HA       VAL 106   5.119 -10.835   0.669
  833    HB   VAL 106           HB       VAL 106   2.724 -11.317   0.687
  834   1HG1  VAL 106          1HG1      VAL 106   1.979 -12.084   3.159
  835   2HG1  VAL 106          2HG1      VAL 106   3.481 -12.994   2.987
  836   3HG1  VAL 106          3HG1      VAL 106   2.186 -13.196   1.806
  837   1HG2  VAL 106          1HG2      VAL 106   3.601 -10.076   3.292
  838   2HG2  VAL 106          2HG2      VAL 106   2.073  -9.806   2.454
  839   3HG2  VAL 106          3HG2      VAL 106   3.583  -9.252   1.734
  840    H    GLU 107           H        GLU 107   5.651 -13.672   2.552
  841    HA   GLU 107           HA       GLU 107   6.023 -12.822   5.100
  842   1HB   GLU 107          2HB       GLU 107   6.351 -15.136   4.289
  843   2HB   GLU 107          1HB       GLU 107   7.882 -14.649   3.573
  844   1HG   GLU 107          2HG       GLU 107   8.747 -14.091   5.763
  845   2HG   GLU 107          1HG       GLU 107   7.206 -14.534   6.494
  846    H    ARG 108           H        ARG 108   8.091 -12.204   2.331
  847    HA   ARG 108           HA       ARG 108  10.232 -11.065   3.856
  848   1HB   ARG 108          2HB       ARG 108  10.440 -12.076   1.540
  849   2HB   ARG 108          1HB       ARG 108   9.658 -10.626   0.925
  850   1HG   ARG 108          2HG       ARG 108  11.986 -10.179   2.671
  851   2HG   ARG 108          1HG       ARG 108  12.320 -10.933   1.110
  852   1HD   ARG 108          2HD       ARG 108  10.485  -8.770   0.743
  853   2HD   ARG 108          1HD       ARG 108  11.872  -8.202   1.672
  854    HE   ARG 108           HE       ARG 108  11.828  -8.828  -1.089
  855   1HH1  ARG 108          1HH1      ARG 108  13.856  -9.062   1.743
  856   2HH1  ARG 108          2HH1      ARG 108  15.334  -9.029   0.840
  857   1HH2  ARG 108          1HH2      ARG 108  13.771  -8.786  -2.277
  858   2HH2  ARG 108          2HH2      ARG 108  15.285  -8.871  -1.441
  859    H    PHE 109           H        PHE 109   7.425  -9.845   2.114
  860    HA   PHE 109           HA       PHE 109   7.966  -7.119   2.180
  861   1HB   PHE 109          2HB       PHE 109   6.119  -7.702   0.879
  862   2HB   PHE 109          1HB       PHE 109   5.436  -8.732   2.129
  863    HD1  PHE 109           1HD      PHE 109   5.646  -5.359   0.798
  864    HD2  PHE 109           2HD      PHE 109   4.209  -7.751   4.010
  865    HE1  PHE 109           1HE      PHE 109   4.152  -3.529   1.486
  866    HE2  PHE 109           2HE      PHE 109   2.711  -5.928   4.705
  867    HZ   PHE 109           HZ       PHE 109   2.683  -3.812   3.443
  868    H    LEU 110           H        LEU 110   6.940  -9.283   4.697
  869    HA   LEU 110           HA       LEU 110   5.811  -7.646   6.577
  870   1HB   LEU 110          2HB       LEU 110   6.833 -10.201   6.526
  871   2HB   LEU 110          1HB       LEU 110   7.805  -9.403   7.746
  872    HG   LEU 110           HG       LEU 110   4.831  -9.157   7.868
  873   1HD1  LEU 110          1HD1      LEU 110   4.997 -11.193   9.444
  874   2HD1  LEU 110          2HD1      LEU 110   6.456 -11.580   8.531
  875   3HD1  LEU 110          3HD1      LEU 110   4.903 -11.470   7.704
  876   1HD2  LEU 110          1HD2      LEU 110   7.156  -8.720   9.611
  877   2HD2  LEU 110          2HD2      LEU 110   5.761  -9.468  10.389
  878   3HD2  LEU 110          3HD2      LEU 110   5.590  -7.910   9.579
  879    H    LEU 111           H        LEU 111   9.219  -8.004   5.794
  880    HA   LEU 111           HA       LEU 111  10.324  -6.521   7.881
  881   1HB   LEU 111          2HB       LEU 111  11.213  -7.035   5.066
  882   2HB   LEU 111          1HB       LEU 111  12.162  -6.040   6.157
  883    HG   LEU 111           HG       LEU 111  12.407  -7.916   7.697
  884   1HD1  LEU 111          1HD1      LEU 111  10.689  -9.363   5.697
  885   2HD1  LEU 111          2HD1      LEU 111  10.379  -9.108   7.414
  886   3HD1  LEU 111          3HD1      LEU 111  11.677 -10.187   6.903
  887   1HD2  LEU 111          1HD2      LEU 111  13.272  -8.081   4.874
  888   2HD2  LEU 111          2HD2      LEU 111  13.500  -9.523   5.864
  889   3HD2  LEU 111          3HD2      LEU 111  14.229  -7.993   6.353
  890    H    THR 112           H        THR 112   9.597  -5.400   4.569
  891    HA   THR 112           HA       THR 112  10.190  -2.748   4.807
  892    HB   THR 112           HB       THR 112   7.885  -4.018   3.321
  893    HG1  THR 112           1HG      THR 112  10.094  -4.603   2.778
  894   1HG2  THR 112          1HG2      THR 112   8.665  -1.773   1.914
  895   2HG2  THR 112          2HG2      THR 112   8.557  -1.219   3.585
  896   3HG2  THR 112          3HG2      THR 112   7.165  -1.984   2.817
  897    H    ILE 113           H        ILE 113   7.172  -4.327   5.806
  898    HA   ILE 113           HA       ILE 113   5.697  -2.091   6.541
  899    HB   ILE 113           HB       ILE 113   5.762  -4.885   7.669
  900   1HG1  ILE 113          2HG1      ILE 113   4.872  -4.549   5.387
  901   2HG1  ILE 113          1HG1      ILE 113   3.634  -5.109   6.507
  902   1HG2  ILE 113          1HG2      ILE 113   3.967  -2.611   8.493
  903   2HG2  ILE 113          2HG2      ILE 113   5.060  -3.547   9.514
  904   3HG2  ILE 113          3HG2      ILE 113   3.625  -4.309   8.828
  905   1HD1  ILE 113          1HD1      ILE 113   3.567  -2.296   6.558
  906   2HD1  ILE 113          2HD1      ILE 113   2.366  -3.408   5.901
  907   3HD1  ILE 113          3HD1      ILE 113   3.652  -2.786   4.866
  908    H    LYS 114           H        LYS 114   7.479  -4.166   8.825
  909    HA   LYS 114           HA       LYS 114   7.425  -2.405  10.984
  910   1HB   LYS 114          2HB       LYS 114   8.003  -4.740  11.268
  911   2HB   LYS 114          1HB       LYS 114   9.445  -4.541  10.282
  912   1HG   LYS 114          2HG       LYS 114   9.223  -2.807  12.663
  913   2HG   LYS 114          1HG       LYS 114   9.481  -4.528  12.950
  914   1HD   LYS 114          2HD       LYS 114  11.620  -4.390  12.337
  915   2HD   LYS 114          1HD       LYS 114  11.203  -3.545  10.844
  916   1HE   LYS 114          2HE       LYS 114  12.188  -1.752  11.725
  917   2HE   LYS 114          1HE       LYS 114  10.810  -1.644  12.817
  918   1HZ   LYS 114          1HZ       LYS 114  12.951  -1.624  13.983
  919   2HZ   LYS 114          2HZ       LYS 114  13.299  -3.164  13.377
  920   3HZ   LYS 114          3HZ       LYS 114  11.998  -2.946  14.436
  921    H    HIS 115           H        HIS 115   9.202  -2.198   8.087
  922    HA   HIS 115           HA       HIS 115  11.289  -0.509   9.208
  923   1HB   HIS 115          2HB       HIS 115  10.748  -1.439   6.386
  924   2HB   HIS 115          1HB       HIS 115  12.091  -0.395   6.842
  925    HD1  HIS 115           1HD      HIS 115  12.468  -2.188   9.584
  926    HD2  HIS 115           2HD      HIS 115  12.626  -3.422   5.620
  927    HE1  HIS 115           1HE      HIS 115  13.835  -4.299   9.591
  928    HE2  HIS 115           2HE      HIS 115  13.992  -4.977   7.170
  929    H    ALA 116           H        ALA 116   8.269  -0.278   7.533
  930    HA   ALA 116           HA       ALA 116   8.594   2.438   6.659
  931   1HB   ALA 116          1HB       ALA 116   6.231   2.291   6.049
  932   2HB   ALA 116          2HB       ALA 116   6.105   0.749   6.894
  933   3HB   ALA 116          3HB       ALA 116   7.130   0.890   5.466
  934    H    PHE 117           H        PHE 117   7.002   0.802   9.359
  935    HA   PHE 117           HA       PHE 117   5.893   3.213  10.445
  936   1HB   PHE 117          2HB       PHE 117   6.140   0.385  11.445
  937   2HB   PHE 117          1HB       PHE 117   5.531   1.671  12.481
  938    HD1  PHE 117           1HD      PHE 117   3.683   3.189  11.190
  939    HD2  PHE 117           2HD      PHE 117   4.557  -0.906  10.427
  940    HE1  PHE 117           1HE      PHE 117   1.435   2.890  10.235
  941    HE2  PHE 117           2HE      PHE 117   2.310  -1.212   9.472
  942    HZ   PHE 117           HZ       PHE 117   0.747   0.688   9.374
  943    H    GLU 118           H        GLU 118   8.953   1.675  10.605
  944    HA   GLU 118           HA       GLU 118   9.759   2.631  13.161
  945   1HB   GLU 118          2HB       GLU 118  10.744   0.761  11.559
  946   2HB   GLU 118          1HB       GLU 118  11.776   2.092  11.057
  947   1HG   GLU 118          2HG       GLU 118  11.974   2.320  13.729
  948   2HG   GLU 118          1HG       GLU 118  11.717   0.582  13.577
  949    H    GLU 119           H        GLU 119   9.166   4.276  10.316
  950    HA   GLU 119           HA       GLU 119  11.263   6.260  10.703
  951   1HB   GLU 119          2HB       GLU 119   9.052   6.229   8.645
  952   2HB   GLU 119          1HB       GLU 119  10.492   7.239   8.633
  953   1HG   GLU 119          2HG       GLU 119  11.896   5.341   8.251
  954   2HG   GLU 119          1HG       GLU 119  10.539   4.237   8.464
  955    H    TYR 120           H        TYR 120   9.518   6.098  12.853
  956    HA   TYR 120           HA       TYR 120   8.665   8.799  13.065
  957   1HB   TYR 120          2HB       TYR 120   6.801   7.460  11.753
  958   2HB   TYR 120          1HB       TYR 120   6.362   6.918  13.370
  959    HD1  TYR 120           1HD      TYR 120   5.464   8.480  15.005
  960    HD2  TYR 120           2HD      TYR 120   6.503   9.774  11.088
  961    HE1  TYR 120           1HE      TYR 120   4.202  10.560  15.364
  962    HE2  TYR 120           2HE      TYR 120   5.246  11.858  11.437
  963    HH   TYR 120           HH       TYR 120   3.163  12.502  13.058
  964    H    SER 121           H        SER 121  10.323   6.850  14.454
  965    HA   SER 121           HA       SER 121   9.467   7.425  17.124
  966   1HB   SER 121          2HB       SER 121   8.085   5.469  16.802
  967   2HB   SER 121          1HB       SER 121   9.453   4.553  16.171
  968    HG   SER 121           HG       SER 121   9.128   4.028  18.333
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  -1.828   0.257  16.953
    2   2H    MET   1          2HT       MET   1  -1.943   1.172  18.400
    3   3H    MET   1          3HT       MET   1  -0.462   0.416  17.974
    4    HA   MET   1           HA       MET   1  -1.799   2.673  16.648
    5   1HB   MET   1          2HB       MET   1   0.282   3.830  17.258
    6   2HB   MET   1          1HB       MET   1  -0.534   3.190  18.677
    7   1HG   MET   1          2HG       MET   1   1.095   1.667  19.105
    8   2HG   MET   1          1HG       MET   1   1.536   1.495  17.407
    9   1HE   MET   1          1HE       MET   1   0.970   4.181  19.861
   10   2HE   MET   1          2HE       MET   1   1.797   5.467  18.982
   11   3HE   MET   1          3HE       MET   1   2.577   4.703  20.367
   12    H    LYS   2           H        LYS   2  -1.773   0.657  14.983
   13    HA   LYS   2           HA       LYS   2   0.197   1.389  13.031
   14   1HB   LYS   2          2HB       LYS   2   0.599  -0.953  14.677
   15   2HB   LYS   2          1HB       LYS   2   0.512  -1.364  12.971
   16   1HG   LYS   2          2HG       LYS   2   2.710  -0.921  13.026
   17   2HG   LYS   2          1HG       LYS   2   2.168   0.751  12.860
   18   1HD   LYS   2          2HD       LYS   2   3.057   1.269  14.831
   19   2HD   LYS   2          1HD       LYS   2   2.103   0.012  15.622
   20   1HE   LYS   2          2HE       LYS   2   4.484  -0.323  16.014
   21   2HE   LYS   2          1HE       LYS   2   3.811  -1.643  15.056
   22   1HZ   LYS   2          1HZ       LYS   2   6.037  -0.568  14.358
   23   2HZ   LYS   2          2HZ       LYS   2   5.065   0.653  13.707
   24   3HZ   LYS   2          3HZ       LYS   2   4.894  -0.941  13.168
   25    H    ARG   3           H        ARG   3  -0.833   1.445  11.152
   26    HA   ARG   3           HA       ARG   3  -2.751  -0.649  10.480
   27   1HB   ARG   3          2HB       ARG   3  -3.506   2.241  10.107
   28   2HB   ARG   3          1HB       ARG   3  -4.531   0.821   9.955
   29   1HG   ARG   3          2HG       ARG   3  -5.218   1.589  11.982
   30   2HG   ARG   3          1HG       ARG   3  -3.916   0.516  12.496
   31   1HD   ARG   3          2HD       ARG   3  -2.386   2.428  12.589
   32   2HD   ARG   3          1HD       ARG   3  -3.692   3.496  12.081
   33    HE   ARG   3           HE       ARG   3  -4.325   2.002  14.442
   34   1HH1  ARG   3          1HH1      ARG   3  -2.711   4.852  13.240
   35   2HH1  ARG   3          2HH1      ARG   3  -2.850   5.715  14.736
   36   1HH2  ARG   3          1HH2      ARG   3  -4.510   3.134  16.409
   37   2HH2  ARG   3          2HH2      ARG   3  -3.872   4.739  16.535
   38    H    VAL   4           H        VAL   4  -2.653  -1.222   8.373
   39    HA   VAL   4           HA       VAL   4  -1.253   0.598   6.527
   40    HB   VAL   4           HB       VAL   4  -1.000  -2.410   6.469
   41   1HG1  VAL   4          1HG1      VAL   4   0.138  -0.163   4.869
   42   2HG1  VAL   4          2HG1      VAL   4  -0.520  -1.706   4.327
   43   3HG1  VAL   4          3HG1      VAL   4   1.074  -1.641   5.080
   44   1HG2  VAL   4          1HG2      VAL   4   1.058  -0.434   7.441
   45   2HG2  VAL   4          2HG2      VAL   4   1.170  -2.194   7.454
   46   3HG2  VAL   4          3HG2      VAL   4   0.018  -1.376   8.509
   47    H    LEU   5           H        LEU   5  -1.761   0.211   4.230
   48    HA   LEU   5           HA       LEU   5  -4.494  -0.834   3.894
   49   1HB   LEU   5          2HB       LEU   5  -4.332   1.628   3.717
   50   2HB   LEU   5          1HB       LEU   5  -3.190   1.441   2.400
   51    HG   LEU   5           HG       LEU   5  -4.981   0.250   1.111
   52   1HD1  LEU   5          1HD1      LEU   5  -7.196   0.203   1.831
   53   2HD1  LEU   5          2HD1      LEU   5  -6.905   1.383   3.109
   54   3HD1  LEU   5          3HD1      LEU   5  -6.277  -0.258   3.263
   55   1HD2  LEU   5          1HD2      LEU   5  -5.213   3.108   1.962
   56   2HD2  LEU   5          2HD2      LEU   5  -6.368   2.416   0.824
   57   3HD2  LEU   5          3HD2      LEU   5  -4.649   2.440   0.431
   58    H    VAL   6           H        VAL   6  -4.884  -2.229   2.260
   59    HA   VAL   6           HA       VAL   6  -2.607  -2.879   0.494
   60    HB   VAL   6           HB       VAL   6  -4.775  -4.809   1.295
   61   1HG1  VAL   6          1HG1      VAL   6  -2.356  -4.908  -0.386
   62   2HG1  VAL   6          2HG1      VAL   6  -3.861  -5.822  -0.502
   63   3HG1  VAL   6          3HG1      VAL   6  -2.627  -6.299   0.665
   64   1HG2  VAL   6          1HG2      VAL   6  -2.941  -5.804   2.754
   65   2HG2  VAL   6          2HG2      VAL   6  -3.715  -4.331   3.340
   66   3HG2  VAL   6          3HG2      VAL   6  -2.121  -4.250   2.588
   67    H    VAL   7           H        VAL   7  -3.252  -1.525  -1.194
   68    HA   VAL   7           HA       VAL   7  -5.905  -1.841  -2.330
   69    HB   VAL   7           HB       VAL   7  -3.611  -0.219  -3.435
   70   1HG1  VAL   7          1HG1      VAL   7  -5.922  -0.882  -4.658
   71   2HG1  VAL   7          2HG1      VAL   7  -5.052   0.624  -4.950
   72   3HG1  VAL   7          3HG1      VAL   7  -6.414   0.596  -3.829
   73   1HG2  VAL   7          1HG2      VAL   7  -5.701   0.500  -1.394
   74   2HG2  VAL   7          2HG2      VAL   7  -4.822   1.710  -2.329
   75   3HG2  VAL   7          3HG2      VAL   7  -3.947   0.621  -1.251
   76    H    ASP   8           H        ASP   8  -6.197  -3.703  -3.407
   77    HA   ASP   8           HA       ASP   8  -4.386  -4.270  -5.636
   78   1HB   ASP   8          2HB       ASP   8  -3.657  -5.718  -3.790
   79   2HB   ASP   8          1HB       ASP   8  -5.294  -6.343  -3.625
   80    H    ASP   9           H        ASP   9  -5.387  -4.992  -7.451
   81    HA   ASP   9           HA       ASP   9  -8.293  -4.968  -7.430
   82   1HB   ASP   9          2HB       ASP   9  -7.093  -3.692  -9.155
   83   2HB   ASP   9          1HB       ASP   9  -6.347  -5.174  -9.742
   84    H    GLU  10           H        GLU  10  -7.481  -7.128  -6.051
   85    HA   GLU  10           HA       GLU  10  -8.767  -9.261  -7.303
   86   1HB   GLU  10          2HB       GLU  10  -6.349  -9.016  -8.464
   87   2HB   GLU  10          1HB       GLU  10  -5.910 -10.036  -7.100
   88   1HG   GLU  10          2HG       GLU  10  -6.437 -11.320  -9.124
   89   2HG   GLU  10          1HG       GLU  10  -7.502 -11.709  -7.774
   90    H    GLU  11           H        GLU  11  -8.459 -11.349  -6.060
   91    HA   GLU  11           HA       GLU  11  -7.992 -10.689  -3.233
   92   1HB   GLU  11          2HB       GLU  11 -10.281 -11.505  -4.071
   93   2HB   GLU  11          1HB       GLU  11  -9.520 -13.081  -4.240
   94   1HG   GLU  11          2HG       GLU  11  -8.878 -12.136  -1.665
   95   2HG   GLU  11          1HG       GLU  11 -10.598 -11.840  -1.912
   96    H    SER  12           H        SER  12  -5.675 -11.097  -4.397
   97    HA   SER  12           HA       SER  12  -4.971 -13.913  -3.897
   98   1HB   SER  12          2HB       SER  12  -3.416 -11.876  -5.507
   99   2HB   SER  12          1HB       SER  12  -3.058 -13.597  -5.357
  100    HG   SER  12           HG       SER  12  -5.355 -12.439  -6.557
  101    H    ILE  13           H        ILE  13  -3.574 -10.641  -3.629
  102    HA   ILE  13           HA       ILE  13  -1.699 -11.498  -1.619
  103    HB   ILE  13           HB       ILE  13  -2.361  -8.761  -2.713
  104   1HG1  ILE  13          2HG1      ILE  13  -0.098  -8.961  -3.718
  105   2HG1  ILE  13          1HG1      ILE  13   0.018 -10.596  -3.076
  106   1HG2  ILE  13          1HG2      ILE  13  -0.576  -9.586  -0.479
  107   2HG2  ILE  13          2HG2      ILE  13  -1.573  -8.142  -0.654
  108   3HG2  ILE  13          3HG2      ILE  13  -0.054  -8.279  -1.540
  109   1HD1  ILE  13          1HD1      ILE  13  -0.651 -10.284  -5.525
  110   2HD1  ILE  13          2HD1      ILE  13  -2.226  -9.810  -4.887
  111   3HD1  ILE  13          3HD1      ILE  13  -1.580 -11.416  -4.542
  112    H    THR  14           H        THR  14  -4.788  -9.856  -1.722
  113    HA   THR  14           HA       THR  14  -4.845  -8.799   0.866
  114    HB   THR  14           HB       THR  14  -7.341  -8.923   0.610
  115    HG1  THR  14           1HG      THR  14  -8.161  -9.746  -1.289
  116   1HG2  THR  14          1HG2      THR  14  -5.937  -7.065  -0.369
  117   2HG2  THR  14          2HG2      THR  14  -7.530  -7.313  -1.082
  118   3HG2  THR  14          3HG2      THR  14  -6.091  -7.899  -1.914
  119    H    SER  15           H        SER  15  -5.016 -12.059  -0.199
  120    HA   SER  15           HA       SER  15  -6.302 -12.996   2.235
  121   1HB   SER  15          2HB       SER  15  -6.241 -15.192   1.224
  122   2HB   SER  15          1HB       SER  15  -6.805 -14.035   0.018
  123    HG   SER  15           HG       SER  15  -5.238 -15.401  -0.871
  124    H    SER  16           H        SER  16  -3.116 -12.656   0.895
  125    HA   SER  16           HA       SER  16  -1.958 -14.335   2.993
  126   1HB   SER  16          2HB       SER  16  -0.178 -12.952   1.072
  127   2HB   SER  16          1HB       SER  16  -0.144 -14.620   1.645
  128    HG   SER  16           HG       SER  16  -2.116 -14.857   0.292
  129    H    LEU  17           H        LEU  17  -1.206 -11.143   1.578
  130    HA   LEU  17           HA       LEU  17   0.407 -10.198   3.608
  131   1HB   LEU  17          2HB       LEU  17  -0.020  -9.151   1.359
  132   2HB   LEU  17          1HB       LEU  17  -1.519  -8.516   2.005
  133    HG   LEU  17           HG       LEU  17   0.630  -7.026   1.901
  134   1HD1  LEU  17          1HD1      LEU  17  -0.839  -5.716   2.899
  135   2HD1  LEU  17          2HD1      LEU  17  -0.307  -6.366   4.447
  136   3HD1  LEU  17          3HD1      LEU  17  -1.674  -7.098   3.606
  137   1HD2  LEU  17          1HD2      LEU  17   2.165  -7.167   3.595
  138   2HD2  LEU  17          2HD2      LEU  17   1.819  -8.875   3.336
  139   3HD2  LEU  17          3HD2      LEU  17   1.061  -8.017   4.676
  140    H    SER  18           H        SER  18  -3.111  -9.754   3.265
  141    HA   SER  18           HA       SER  18  -3.584  -8.235   5.528
  142   1HB   SER  18          2HB       SER  18  -5.232  -8.929   3.699
  143   2HB   SER  18          1HB       SER  18  -5.456 -10.417   4.618
  144    HG   SER  18           HG       SER  18  -6.056  -7.763   5.376
  145    H    ALA  19           H        ALA  19  -3.927 -11.785   5.305
  146    HA   ALA  19           HA       ALA  19  -4.400 -12.320   7.973
  147   1HB   ALA  19          1HB       ALA  19  -4.678 -14.203   6.738
  148   2HB   ALA  19          2HB       ALA  19  -3.043 -14.524   7.318
  149   3HB   ALA  19          3HB       ALA  19  -3.292 -13.861   5.702
  150    H    ILE  20           H        ILE  20  -1.320 -11.863   6.324
  151    HA   ILE  20           HA       ILE  20   0.402 -12.639   8.377
  152    HB   ILE  20           HB       ILE  20   0.657 -10.804   6.032
  153   1HG1  ILE  20          2HG1      ILE  20   2.206 -13.238   6.931
  154   2HG1  ILE  20          1HG1      ILE  20   0.873 -13.246   5.781
  155   1HG2  ILE  20          1HG2      ILE  20   3.177 -10.705   6.787
  156   2HG2  ILE  20          2HG2      ILE  20   2.462 -10.827   8.394
  157   3HG2  ILE  20          3HG2      ILE  20   2.011  -9.497   7.326
  158   1HD1  ILE  20          1HD1      ILE  20   3.578 -11.985   5.439
  159   2HD1  ILE  20          2HD1      ILE  20   2.230 -11.738   4.329
  160   3HD1  ILE  20          3HD1      ILE  20   2.901 -13.353   4.555
  161    H    LEU  21           H        LEU  21  -0.634  -9.315   7.564
  162    HA   LEU  21           HA       LEU  21   0.504  -7.952   9.652
  163   1HB   LEU  21          2HB       LEU  21  -2.281  -7.452   8.628
  164   2HB   LEU  21          1HB       LEU  21  -1.196  -6.286   9.358
  165    HG   LEU  21           HG       LEU  21  -0.035  -7.561   7.012
  166   1HD1  LEU  21          1HD1      LEU  21  -1.703  -7.424   5.570
  167   2HD1  LEU  21          2HD1      LEU  21  -1.851  -5.701   5.904
  168   3HD1  LEU  21          3HD1      LEU  21  -2.783  -6.865   6.842
  169   1HD2  LEU  21          1HD2      LEU  21  -0.292  -4.891   8.247
  170   2HD2  LEU  21          2HD2      LEU  21  -0.046  -4.938   6.501
  171   3HD2  LEU  21          3HD2      LEU  21   1.122  -5.706   7.577
  172    H    GLU  22           H        GLU  22  -2.493  -9.816   9.654
  173    HA   GLU  22           HA       GLU  22  -3.412  -9.113  12.205
  174   1HB   GLU  22          2HB       GLU  22  -3.825 -11.535  10.480
  175   2HB   GLU  22          1HB       GLU  22  -4.551 -11.414  12.077
  176   1HG   GLU  22          2HG       GLU  22  -5.699  -9.365  11.393
  177   2HG   GLU  22          1HG       GLU  22  -4.986  -9.511   9.787
  178    H    GLU  23           H        GLU  23  -0.920 -11.314  11.161
  179    HA   GLU  23           HA       GLU  23  -0.718 -12.645  13.714
  180   1HB   GLU  23          2HB       GLU  23  -0.110 -13.994  11.881
  181   2HB   GLU  23          1HB       GLU  23   0.854 -12.721  11.150
  182   1HG   GLU  23          2HG       GLU  23   2.685 -13.333  12.243
  183   2HG   GLU  23          1HG       GLU  23   1.826 -13.488  13.774
  184    H    GLU  24           H        GLU  24   0.840 -10.017  12.005
  185    HA   GLU  24           HA       GLU  24   2.978  -9.710  13.887
  186   1HB   GLU  24          2HB       GLU  24   1.960  -7.778  11.796
  187   2HB   GLU  24          1HB       GLU  24   3.490  -7.654  12.655
  188   1HG   GLU  24          2HG       GLU  24   2.908 -10.130  11.113
  189   2HG   GLU  24          1HG       GLU  24   3.360  -8.664  10.243
  190    H    GLY  25           H        GLY  25   0.454  -7.350  13.002
  191   1HA   GLY  25          2HA       GLY  25  -0.947  -6.907  15.192
  192   2HA   GLY  25          1HA       GLY  25   0.603  -6.251  15.692
  193    H    TYR  26           H        TYR  26  -1.420  -6.089  12.760
  194    HA   TYR  26           HA       TYR  26  -1.257  -3.156  12.928
  195   1HB   TYR  26          2HB       TYR  26  -0.996  -4.827  10.422
  196   2HB   TYR  26          1HB       TYR  26  -1.092  -3.073  10.457
  197    HD1  TYR  26           1HD      TYR  26   0.820  -1.751  10.905
  198    HD2  TYR  26           2HD      TYR  26   0.996  -5.972  11.400
  199    HE1  TYR  26           1HE      TYR  26   3.264  -1.617  11.113
  200    HE2  TYR  26           2HE      TYR  26   3.441  -5.850  11.612
  201    HH   TYR  26           HH       TYR  26   5.278  -4.238  10.847
  202    H    HIS  27           H        HIS  27  -2.806  -2.479  10.814
  203    HA   HIS  27           HA       HIS  27  -5.359  -3.877  11.144
  204   1HB   HIS  27          2HB       HIS  27  -4.836  -1.496  12.430
  205   2HB   HIS  27          1HB       HIS  27  -5.620  -0.958  10.949
  206    HD1  HIS  27           1HD      HIS  27  -8.087  -0.868  11.074
  207    HD2  HIS  27           2HD      HIS  27  -6.504  -3.592  13.782
  208    HE1  HIS  27           1HE      HIS  27 -10.052  -1.739  12.378
  209    HE2  HIS  27           2HE      HIS  27  -9.058  -3.313  14.076
  210    HA   PRO  28           HA       PRO  28  -4.528  -3.048   6.727
  211   1HB   PRO  28          2HB       PRO  28  -5.342  -5.433   5.790
  212   2HB   PRO  28          1HB       PRO  28  -3.737  -5.177   6.479
  213   1HG   PRO  28          2HG       PRO  28  -6.139  -6.452   7.693
  214   2HG   PRO  28          1HG       PRO  28  -4.432  -6.883   7.867
  215   1HD   PRO  28          2HD       PRO  28  -5.904  -5.439   9.717
  216   2HD   PRO  28          1HD       PRO  28  -4.135  -5.439   9.603
  217    H    ASP  29           H        ASP  29  -5.883  -2.073   5.442
  218    HA   ASP  29           HA       ASP  29  -8.756  -2.602   5.776
  219   1HB   ASP  29          2HB       ASP  29  -8.025  -0.310   6.419
  220   2HB   ASP  29          1HB       ASP  29  -7.543  -0.044   4.748
  221    H    THR  30           H        THR  30  -6.499  -3.516   3.850
  222    HA   THR  30           HA       THR  30  -6.289  -3.388   1.436
  223    HB   THR  30           HB       THR  30  -6.836  -5.590   0.875
  224    HG1  THR  30           1HG      THR  30  -8.483  -6.737   1.868
  225   1HG2  THR  30          1HG2      THR  30  -5.780  -6.740   2.476
  226   2HG2  THR  30          2HG2      THR  30  -6.867  -6.180   3.745
  227   3HG2  THR  30          3HG2      THR  30  -5.545  -5.148   3.197
  228    H    ALA  31           H        ALA  31  -7.072  -2.482  -0.287
  229    HA   ALA  31           HA       ALA  31  -9.983  -2.128  -0.535
  230   1HB   ALA  31          1HB       ALA  31  -8.515  -0.081  -0.417
  231   2HB   ALA  31          2HB       ALA  31  -9.583  -0.173  -1.817
  232   3HB   ALA  31          3HB       ALA  31  -7.869  -0.553  -1.988
  233    H    LYS  32           H        LYS  32 -10.105  -1.488  -3.233
  234    HA   LYS  32           HA       LYS  32  -9.310  -4.031  -4.491
  235   1HB   LYS  32          2HB       LYS  32 -11.649  -2.370  -5.391
  236   2HB   LYS  32          1HB       LYS  32 -11.309  -4.061  -5.734
  237   1HG   LYS  32          2HG       LYS  32 -11.728  -4.610  -3.381
  238   2HG   LYS  32          1HG       LYS  32 -12.105  -2.915  -3.068
  239   1HD   LYS  32          2HD       LYS  32 -13.586  -4.759  -4.946
  240   2HD   LYS  32          1HD       LYS  32 -14.147  -4.209  -3.366
  241   1HE   LYS  32          2HE       LYS  32 -15.131  -2.514  -4.423
  242   2HE   LYS  32          1HE       LYS  32 -13.517  -1.870  -4.720
  243   1HZ   LYS  32          1HZ       LYS  32 -14.486  -1.969  -6.812
  244   2HZ   LYS  32          2HZ       LYS  32 -15.223  -3.465  -6.526
  245   3HZ   LYS  32          3HZ       LYS  32 -13.551  -3.378  -6.763
  246    H    THR  33           H        THR  33  -9.577  -0.559  -4.865
  247    HA   THR  33           HA       THR  33  -7.505  -0.547  -6.845
  248    HB   THR  33           HB       THR  33 -10.042   0.724  -7.794
  249    HG1  THR  33           1HG      THR  33 -10.941  -1.156  -7.918
  250   1HG2  THR  33          1HG2      THR  33  -7.450   0.041  -8.922
  251   2HG2  THR  33          2HG2      THR  33  -8.649   1.223  -9.450
  252   3HG2  THR  33          3HG2      THR  33  -8.811  -0.468  -9.922
  253    H    LEU  34           H        LEU  34  -7.279   1.829  -7.714
  254    HA   LEU  34           HA       LEU  34  -6.723   3.478  -5.549
  255   1HB   LEU  34          2HB       LEU  34  -7.301   4.410  -8.359
  256   2HB   LEU  34          1HB       LEU  34  -6.338   5.239  -7.152
  257    HG   LEU  34           HG       LEU  34  -5.625   2.619  -8.474
  258   1HD1  LEU  34          1HD1      LEU  34  -3.926   5.001  -8.789
  259   2HD1  LEU  34          2HD1      LEU  34  -5.485   5.057  -9.614
  260   3HD1  LEU  34          3HD1      LEU  34  -4.355   3.745  -9.950
  261   1HD2  LEU  34          1HD2      LEU  34  -4.668   3.904  -6.065
  262   2HD2  LEU  34          2HD2      LEU  34  -3.379   3.712  -7.253
  263   3HD2  LEU  34          3HD2      LEU  34  -4.299   2.307  -6.714
  264    H    ARG  35           H        ARG  35  -9.634   3.178  -7.474
  265    HA   ARG  35           HA       ARG  35 -10.919   5.534  -6.601
  266   1HB   ARG  35          2HB       ARG  35 -11.525   3.370  -8.303
  267   2HB   ARG  35          1HB       ARG  35 -12.804   3.409  -7.098
  268   1HG   ARG  35          2HG       ARG  35 -13.743   4.879  -8.503
  269   2HG   ARG  35          1HG       ARG  35 -12.647   6.030  -7.735
  270   1HD   ARG  35          2HD       ARG  35 -12.465   6.277 -10.113
  271   2HD   ARG  35          1HD       ARG  35 -10.981   5.539  -9.513
  272    HE   ARG  35           HE       ARG  35 -11.472   3.648 -10.711
  273   1HH1  ARG  35          1HH1      ARG  35 -14.318   5.660 -10.548
  274   2HH1  ARG  35          2HH1      ARG  35 -15.208   4.712 -11.690
  275   1HH2  ARG  35          1HH2      ARG  35 -12.640   2.399 -12.216
  276   2HH2  ARG  35          2HH2      ARG  35 -14.256   2.859 -12.638
  277    H    GLU  36           H        GLU  36 -11.080   2.181  -5.441
  278    HA   GLU  36           HA       GLU  36 -12.838   2.795  -3.278
  279   1HB   GLU  36          2HB       GLU  36 -11.623   0.438  -4.423
  280   2HB   GLU  36          1HB       GLU  36 -11.482   0.408  -2.670
  281   1HG   GLU  36          2HG       GLU  36 -13.486  -0.684  -3.115
  282   2HG   GLU  36          1HG       GLU  36 -13.971   0.938  -2.626
  283    H    ALA  37           H        ALA  37  -9.377   2.727  -3.714
  284    HA   ALA  37           HA       ALA  37  -8.733   2.728  -0.926
  285   1HB   ALA  37          1HB       ALA  37  -6.486   3.665  -2.000
  286   2HB   ALA  37          2HB       ALA  37  -7.229   3.025  -3.466
  287   3HB   ALA  37          3HB       ALA  37  -6.934   1.962  -2.089
  288    H    GLU  38           H        GLU  38  -9.244   5.201  -3.379
  289    HA   GLU  38           HA       GLU  38  -8.305   7.376  -1.809
  290   1HB   GLU  38          2HB       GLU  38 -10.119   7.216  -4.207
  291   2HB   GLU  38          1HB       GLU  38  -9.716   8.742  -3.433
  292   1HG   GLU  38          2HG       GLU  38  -7.443   8.550  -4.000
  293   2HG   GLU  38          1HG       GLU  38  -7.614   6.849  -4.432
  294    H    LYS  39           H        LYS  39 -11.457   5.877  -2.321
  295    HA   LYS  39           HA       LYS  39 -12.968   7.730  -0.825
  296   1HB   LYS  39          2HB       LYS  39 -14.104   6.226  -2.312
  297   2HB   LYS  39          1HB       LYS  39 -13.427   4.821  -1.502
  298   1HG   LYS  39          2HG       LYS  39 -15.101   6.671   0.106
  299   2HG   LYS  39          1HG       LYS  39 -15.904   5.630  -1.073
  300   1HD   LYS  39          2HD       LYS  39 -14.528   3.729  -0.007
  301   2HD   LYS  39          1HD       LYS  39 -14.280   4.858   1.327
  302   1HE   LYS  39          2HE       LYS  39 -16.681   5.061   1.632
  303   2HE   LYS  39          1HE       LYS  39 -16.964   4.000   0.252
  304   1HZ   LYS  39          1HZ       LYS  39 -15.367   3.075   2.553
  305   2HZ   LYS  39          2HZ       LYS  39 -16.214   2.159   1.410
  306   3HZ   LYS  39          3HZ       LYS  39 -17.057   3.014   2.601
  307    H    LYS  40           H        LYS  40 -11.106   4.878   0.029
  308    HA   LYS  40           HA       LYS  40 -12.019   4.799   2.747
  309   1HB   LYS  40          2HB       LYS  40  -9.682   3.469   1.377
  310   2HB   LYS  40          1HB       LYS  40 -10.155   3.165   3.043
  311   1HG   LYS  40          2HG       LYS  40 -12.116   2.797   0.817
  312   2HG   LYS  40          1HG       LYS  40 -10.934   1.543   1.197
  313   1HD   LYS  40          2HD       LYS  40 -11.810   1.213   3.346
  314   2HD   LYS  40          1HD       LYS  40 -12.686   2.745   3.319
  315   1HE   LYS  40          2HE       LYS  40 -14.133   1.835   1.528
  316   2HE   LYS  40          1HE       LYS  40 -13.299   0.289   1.679
  317   1HZ   LYS  40          1HZ       LYS  40 -15.518   0.804   2.973
  318   2HZ   LYS  40          2HZ       LYS  40 -14.441   1.453   4.104
  319   3HZ   LYS  40          3HZ       LYS  40 -14.307  -0.171   3.643
  320    H    ILE  41           H        ILE  41  -9.091   5.936   1.094
  321    HA   ILE  41           HA       ILE  41  -7.813   6.815   3.491
  322    HB   ILE  41           HB       ILE  41  -7.248   7.623   0.637
  323   1HG1  ILE  41          2HG1      ILE  41  -5.607   5.640   2.152
  324   2HG1  ILE  41          1HG1      ILE  41  -7.135   5.107   1.458
  325   1HG2  ILE  41          1HG2      ILE  41  -5.583   7.854   3.140
  326   2HG2  ILE  41          2HG2      ILE  41  -6.259   9.178   2.192
  327   3HG2  ILE  41          3HG2      ILE  41  -4.994   8.160   1.506
  328   1HD1  ILE  41          1HD1      ILE  41  -5.950   4.699  -0.378
  329   2HD1  ILE  41          2HD1      ILE  41  -4.593   5.682   0.171
  330   3HD1  ILE  41          3HD1      ILE  41  -5.970   6.444  -0.626
  331    H    LYS  42           H        LYS  42 -10.087   8.213   1.278
  332    HA   LYS  42           HA       LYS  42  -9.707  10.920   1.596
  333   1HB   LYS  42          2HB       LYS  42 -12.043   9.204   1.029
  334   2HB   LYS  42          1HB       LYS  42 -12.383  10.854   1.533
  335   1HG   LYS  42          2HG       LYS  42 -10.343  10.977  -0.415
  336   2HG   LYS  42          1HG       LYS  42 -11.591   9.889  -1.024
  337   1HD   LYS  42          2HD       LYS  42 -12.519  11.830  -1.730
  338   2HD   LYS  42          1HD       LYS  42 -13.144  11.863  -0.081
  339   1HE   LYS  42          2HE       LYS  42 -10.461  13.004  -0.388
  340   2HE   LYS  42          1HE       LYS  42 -11.726  13.871  -1.259
  341   1HZ   LYS  42          1HZ       LYS  42 -11.292  13.604   1.598
  342   2HZ   LYS  42          2HZ       LYS  42 -12.906  13.513   1.096
  343   3HZ   LYS  42          3HZ       LYS  42 -11.979  14.878   0.720
  344    H    GLU  43           H        GLU  43 -10.884   8.631   3.919
  345    HA   GLU  43           HA       GLU  43 -11.295  10.834   5.819
  346   1HB   GLU  43          2HB       GLU  43 -12.818   8.226   5.762
  347   2HB   GLU  43          1HB       GLU  43 -13.054   9.542   6.904
  348   1HG   GLU  43          2HG       GLU  43 -14.181  10.827   5.409
  349   2HG   GLU  43          1HG       GLU  43 -13.320  10.166   4.021
  350    H    LEU  44           H        LEU  44 -10.484   7.399   5.465
  351    HA   LEU  44           HA       LEU  44  -9.444   7.167   8.120
  352   1HB   LEU  44          2HB       LEU  44 -10.140   5.413   6.050
  353   2HB   LEU  44          1HB       LEU  44  -8.419   5.182   6.287
  354    HG   LEU  44           HG       LEU  44  -9.692   3.596   7.618
  355   1HD1  LEU  44          1HD1      LEU  44  -8.678   4.025   9.785
  356   2HD1  LEU  44          2HD1      LEU  44  -8.392   5.706   9.334
  357   3HD1  LEU  44          3HD1      LEU  44  -7.552   4.409   8.483
  358   1HD2  LEU  44          1HD2      LEU  44 -11.251   4.213   9.271
  359   2HD2  LEU  44          2HD2      LEU  44 -11.681   5.154   7.843
  360   3HD2  LEU  44          3HD2      LEU  44 -10.805   5.916   9.170
  361    H    PHE  45           H        PHE  45  -7.406   7.412   8.853
  362    HA   PHE  45           HA       PHE  45  -5.464   8.584   7.021
  363   1HB   PHE  45          2HB       PHE  45  -6.007   9.623   9.257
  364   2HB   PHE  45          1HB       PHE  45  -5.219   8.243  10.013
  365    HD1  PHE  45           1HD      PHE  45  -4.709  11.243   7.961
  366    HD2  PHE  45           2HD      PHE  45  -2.840   8.030  10.033
  367    HE1  PHE  45           1HE      PHE  45  -2.537  12.382   7.760
  368    HE2  PHE  45           2HE      PHE  45  -0.665   9.164   9.837
  369    HZ   PHE  45           HZ       PHE  45  -0.511  11.342   8.699
  370    H    PHE  46           H        PHE  46  -4.601   6.899   5.868
  371    HA   PHE  46           HA       PHE  46  -3.570   4.576   7.288
  372   1HB   PHE  46          2HB       PHE  46  -3.797   5.253   4.358
  373   2HB   PHE  46          1HB       PHE  46  -2.981   3.808   4.942
  374    HD1  PHE  46           1HD      PHE  46  -6.098   5.282   4.050
  375    HD2  PHE  46           2HD      PHE  46  -4.325   2.168   6.345
  376    HE1  PHE  46           1HE      PHE  46  -8.254   4.099   4.102
  377    HE2  PHE  46           2HE      PHE  46  -6.479   0.979   6.402
  378    HZ   PHE  46           HZ       PHE  46  -8.445   1.948   5.280
  379    HA   PRO  47           HA       PRO  47   0.440   6.654   7.372
  380   1HB   PRO  47          2HB       PRO  47   1.679   4.856   8.960
  381   2HB   PRO  47          1HB       PRO  47   0.544   6.051   9.600
  382   1HG   PRO  47          2HG       PRO  47   0.095   3.166   8.959
  383   2HG   PRO  47          1HG       PRO  47  -0.449   4.095  10.366
  384   1HD   PRO  47          2HD       PRO  47  -2.062   3.531   8.246
  385   2HD   PRO  47          1HD       PRO  47  -2.243   4.989   9.240
  386    H    VAL  48           H        VAL  48  -0.409   3.508   6.263
  387    HA   VAL  48           HA       VAL  48   1.873   3.482   4.470
  388    HB   VAL  48           HB       VAL  48   1.195   0.999   6.021
  389   1HG1  VAL  48          1HG1      VAL  48   3.211   1.799   4.020
  390   2HG1  VAL  48          2HG1      VAL  48   2.461   0.230   4.314
  391   3HG1  VAL  48          3HG1      VAL  48   3.782   0.783   5.343
  392   1HG2  VAL  48          1HG2      VAL  48   1.833   2.574   7.672
  393   2HG2  VAL  48          2HG2      VAL  48   3.181   3.146   6.689
  394   3HG2  VAL  48          3HG2      VAL  48   3.218   1.522   7.379
  395    H    ILE  49           H        ILE  49   1.298   2.811   2.502
  396    HA   ILE  49           HA       ILE  49  -1.229   1.342   2.170
  397    HB   ILE  49           HB       ILE  49  -0.075   3.095   0.021
  398   1HG1  ILE  49          2HG1      ILE  49  -0.310   4.572   1.935
  399   2HG1  ILE  49          1HG1      ILE  49  -1.596   4.906   0.778
  400   1HG2  ILE  49          1HG2      ILE  49  -2.572   1.620   0.514
  401   2HG2  ILE  49          2HG2      ILE  49  -1.750   1.993  -1.000
  402   3HG2  ILE  49          3HG2      ILE  49  -2.757   3.211  -0.220
  403   1HD1  ILE  49          1HD1      ILE  49  -2.181   4.816   3.265
  404   2HD1  ILE  49          2HD1      ILE  49  -2.039   3.067   3.095
  405   3HD1  ILE  49          3HD1      ILE  49  -3.223   3.953   2.134
  406    H    VAL  50           H        VAL  50  -1.277  -0.020   0.150
  407    HA   VAL  50           HA       VAL  50   1.330  -0.764  -0.886
  408    HB   VAL  50           HB       VAL  50  -0.409  -2.799   0.512
  409   1HG1  VAL  50          1HG1      VAL  50   2.284  -3.621  -0.159
  410   2HG1  VAL  50          2HG1      VAL  50   1.371  -3.164  -1.597
  411   3HG1  VAL  50          3HG1      VAL  50   0.746  -4.408  -0.515
  412   1HG2  VAL  50          1HG2      VAL  50   1.514  -2.986   2.059
  413   2HG2  VAL  50          2HG2      VAL  50   0.727  -1.410   2.115
  414   3HG2  VAL  50          3HG2      VAL  50   2.254  -1.603   1.255
  415    H    LEU  51           H        LEU  51   0.772  -0.293  -2.917
  416    HA   LEU  51           HA       LEU  51  -1.716  -1.186  -4.076
  417   1HB   LEU  51          2HB       LEU  51  -0.723   0.963  -4.712
  418   2HB   LEU  51          1HB       LEU  51   0.687   0.133  -5.339
  419    HG   LEU  51           HG       LEU  51  -0.640  -0.887  -7.095
  420   1HD1  LEU  51          1HD1      LEU  51  -2.811  -1.225  -6.793
  421   2HD1  LEU  51          2HD1      LEU  51  -3.073   0.508  -6.990
  422   3HD1  LEU  51          3HD1      LEU  51  -2.824  -0.170  -5.381
  423   1HD2  LEU  51          1HD2      LEU  51  -0.907   2.088  -6.773
  424   2HD2  LEU  51          2HD2      LEU  51  -1.415   1.246  -8.238
  425   3HD2  LEU  51          3HD2      LEU  51   0.272   1.186  -7.725
  426    H    ASP  52           H        ASP  52  -1.946  -2.687  -5.760
  427    HA   ASP  52           HA       ASP  52   0.209  -4.686  -5.882
  428   1HB   ASP  52          2HB       ASP  52  -2.153  -5.260  -4.997
  429   2HB   ASP  52          1HB       ASP  52  -2.638  -5.208  -6.688
  430    H    VAL  53           H        VAL  53  -1.587  -2.446  -7.758
  431    HA   VAL  53           HA       VAL  53  -1.754  -2.020  -9.989
  432    HB   VAL  53           HB       VAL  53   0.281  -1.693 -11.094
  433   1HG1  VAL  53          1HG1      VAL  53   0.156  -0.369  -9.087
  434   2HG1  VAL  53          2HG1      VAL  53   1.829  -0.850  -9.369
  435   3HG1  VAL  53          3HG1      VAL  53   0.868  -1.675  -8.140
  436   1HG2  VAL  53          1HG2      VAL  53   1.896  -3.211 -11.282
  437   2HG2  VAL  53          2HG2      VAL  53   0.945  -4.280 -10.257
  438   3HG2  VAL  53          3HG2      VAL  53   2.163  -3.227  -9.541
  439    H    TRP  54           H        TRP  54  -2.623  -4.687  -9.248
  440    HA   TRP  54           HA       TRP  54  -1.700  -6.688 -10.953
  441   1HB   TRP  54          2HB       TRP  54  -3.204  -7.188  -9.114
  442   2HB   TRP  54          1HB       TRP  54  -4.487  -6.242  -9.859
  443    HD1  TRP  54           HD       TRP  54  -6.270  -7.866 -10.706
  444    HE1  TRP  54           1HE      TRP  54  -6.279 -10.099 -11.983
  445    HE3  TRP  54           3HE      TRP  54  -1.230  -8.654 -10.993
  446    HZ2  TRP  54           2HZ      TRP  54  -4.396 -11.952 -12.981
  447    HZ3  TRP  54           3HZ      TRP  54  -0.414 -10.682 -12.126
  448    HH2  TRP  54           HH       TRP  54  -1.966 -12.295 -13.099
  449    H    MET  55           H        MET  55  -4.922  -5.309 -11.484
  450    HA   MET  55           HA       MET  55  -4.252  -4.528 -14.189
  451   1HB   MET  55          2HB       MET  55  -6.131  -6.813 -13.594
  452   2HB   MET  55          1HB       MET  55  -6.147  -5.937 -15.118
  453   1HG   MET  55          2HG       MET  55  -3.549  -6.546 -15.004
  454   2HG   MET  55          1HG       MET  55  -4.202  -7.892 -14.071
  455   1HE   MET  55          1HE       MET  55  -5.198  -6.699 -18.330
  456   2HE   MET  55          2HE       MET  55  -3.491  -6.993 -18.000
  457   3HE   MET  55          3HE       MET  55  -4.371  -5.774 -17.076
  458    HA   PRO  56           HA       PRO  56  -7.809  -2.234 -12.223
  459   1HB   PRO  56          2HB       PRO  56  -6.240   0.000 -11.471
  460   2HB   PRO  56          1HB       PRO  56  -6.913  -1.231 -10.405
  461   1HG   PRO  56          2HG       PRO  56  -4.204  -0.795 -10.915
  462   2HG   PRO  56          1HG       PRO  56  -4.903  -2.229 -10.151
  463   1HD   PRO  56          2HD       PRO  56  -4.025  -1.817 -12.972
  464   2HD   PRO  56          1HD       PRO  56  -3.948  -3.277 -11.964
  465    H    ASP  57           H        ASP  57  -7.718   0.576 -12.449
  466    HA   ASP  57           HA       ASP  57  -6.894   1.281 -15.120
  467   1HB   ASP  57          2HB       ASP  57  -9.829   1.070 -14.439
  468   2HB   ASP  57          1HB       ASP  57  -9.195   1.894 -15.859
  469    H    GLY  58           H        GLY  58  -6.270   2.268 -12.533
  470   1HA   GLY  58          2HA       GLY  58  -7.419   4.981 -12.748
  471   2HA   GLY  58          1HA       GLY  58  -7.164   4.210 -11.192
  472    H    ASP  59           H        ASP  59  -4.635   3.235 -13.057
  473    HA   ASP  59           HA       ASP  59  -2.422   3.759 -13.101
  474   1HB   ASP  59          2HB       ASP  59  -3.443   6.608 -13.097
  475   2HB   ASP  59          1HB       ASP  59  -1.827   6.090 -13.566
  476    H    GLY  60           H        GLY  60  -1.454   3.144 -11.261
  477   1HA   GLY  60          2HA       GLY  60  -1.985   4.460  -8.751
  478   2HA   GLY  60          1HA       GLY  60  -0.872   3.128  -9.018
  479    H    VAL  61           H        VAL  61  -0.077   5.372 -11.286
  480    HA   VAL  61           HA       VAL  61   2.336   6.082 -10.008
  481    HB   VAL  61           HB       VAL  61   1.066   7.347 -12.440
  482   1HG1  VAL  61          1HG1      VAL  61   3.696   7.593 -11.118
  483   2HG1  VAL  61          2HG1      VAL  61   2.772   8.777 -12.044
  484   3HG1  VAL  61          3HG1      VAL  61   3.687   7.522 -12.881
  485   1HG2  VAL  61          1HG2      VAL  61   3.094   5.122 -12.383
  486   2HG2  VAL  61          2HG2      VAL  61   2.220   5.759 -13.777
  487   3HG2  VAL  61          3HG2      VAL  61   1.359   4.847 -12.537
  488    H    ASN  62           H        ASN  62  -0.245   8.268 -11.173
  489    HA   ASN  62           HA       ASN  62   0.629  10.459  -9.658
  490   1HB   ASN  62          2HB       ASN  62  -1.579  11.389 -10.342
  491   2HB   ASN  62          1HB       ASN  62  -0.627  10.773 -11.675
  492   1HD2  ASN  62          1HD2      ASN  62  -1.521   9.330 -12.982
  493   2HD2  ASN  62          2HD2      ASN  62  -3.020   8.519 -12.703
  494    H    PHE  63           H        PHE  63  -1.134   7.683  -8.764
  495    HA   PHE  63           HA       PHE  63  -2.878   8.745  -6.833
  496   1HB   PHE  63          2HB       PHE  63  -3.075   6.450  -7.691
  497   2HB   PHE  63          1HB       PHE  63  -1.568   6.020  -6.886
  498    HD1  PHE  63           1HD      PHE  63  -4.503   7.994  -5.725
  499    HD2  PHE  63           2HD      PHE  63  -2.079   4.536  -5.195
  500    HE1  PHE  63           1HE      PHE  63  -5.755   7.435  -3.683
  501    HE2  PHE  63           2HE      PHE  63  -3.327   3.970  -3.152
  502    HZ   PHE  63           HZ       PHE  63  -5.168   5.422  -2.394
  503    H    ILE  64           H        ILE  64   0.498   7.719  -6.630
  504    HA   ILE  64           HA       ILE  64   0.901   7.654  -3.919
  505    HB   ILE  64           HB       ILE  64   2.786   8.838  -5.964
  506   1HG1  ILE  64          2HG1      ILE  64   3.469   6.197  -5.062
  507   2HG1  ILE  64          1HG1      ILE  64   1.807   6.198  -5.643
  508   1HG2  ILE  64          1HG2      ILE  64   4.116   7.533  -3.804
  509   2HG2  ILE  64          2HG2      ILE  64   2.994   8.723  -3.145
  510   3HG2  ILE  64          3HG2      ILE  64   4.219   9.219  -4.312
  511   1HD1  ILE  64          1HD1      ILE  64   4.075   5.954  -7.170
  512   2HD1  ILE  64          2HD1      ILE  64   3.591   7.630  -7.419
  513   3HD1  ILE  64          3HD1      ILE  64   2.456   6.323  -7.759
  514    H    ASP  65           H        ASP  65   0.492  10.474  -5.965
  515    HA   ASP  65           HA       ASP  65   1.297  12.387  -4.015
  516   1HB   ASP  65          2HB       ASP  65   1.248  12.897  -6.433
  517   2HB   ASP  65          1HB       ASP  65  -0.507  12.744  -6.424
  518    H    PHE  66           H        PHE  66  -1.715  10.781  -4.796
  519    HA   PHE  66           HA       PHE  66  -3.462  12.444  -3.348
  520   1HB   PHE  66          2HB       PHE  66  -4.291  10.787  -4.940
  521   2HB   PHE  66          1HB       PHE  66  -3.639   9.482  -3.959
  522    HD1  PHE  66           1HD      PHE  66  -4.548   9.350  -1.511
  523    HD2  PHE  66           2HD      PHE  66  -6.497  11.388  -4.699
  524    HE1  PHE  66           1HE      PHE  66  -6.682   9.202  -0.298
  525    HE2  PHE  66           2HE      PHE  66  -8.636  11.240  -3.491
  526    HZ   PHE  66           HZ       PHE  66  -8.729  10.146  -1.286
  527    H    ILE  67           H        ILE  67  -1.596   9.576  -2.442
  528    HA   ILE  67           HA       ILE  67  -2.540   9.315   0.184
  529    HB   ILE  67           HB       ILE  67   0.128   8.569  -1.022
  530   1HG1  ILE  67          2HG1      ILE  67  -0.943   6.236  -0.628
  531   2HG1  ILE  67          1HG1      ILE  67  -2.457   7.125  -0.497
  532   1HG2  ILE  67          1HG2      ILE  67   0.554   8.809   1.302
  533   2HG2  ILE  67          2HG2      ILE  67   0.359   7.084   0.995
  534   3HG2  ILE  67          3HG2      ILE  67  -0.955   8.003   1.729
  535   1HD1  ILE  67          1HD1      ILE  67  -0.783   7.699  -2.859
  536   2HD1  ILE  67          2HD1      ILE  67  -2.536   7.577  -2.707
  537   3HD1  ILE  67          3HD1      ILE  67  -1.553   6.115  -2.786
  538    H    LYS  68           H        LYS  68   0.187  11.165  -1.141
  539    HA   LYS  68           HA       LYS  68   0.893  12.231   1.434
  540   1HB   LYS  68          2HB       LYS  68   2.671  13.313   0.365
  541   2HB   LYS  68          1HB       LYS  68   2.474  11.821  -0.539
  542   1HG   LYS  68          2HG       LYS  68   2.343  13.008  -2.388
  543   2HG   LYS  68          1HG       LYS  68   0.841  13.716  -1.796
  544   1HD   LYS  68          2HD       LYS  68   1.953  15.575  -0.879
  545   2HD   LYS  68          1HD       LYS  68   3.529  14.791  -1.002
  546   1HE   LYS  68          2HE       LYS  68   3.775  15.328  -3.184
  547   2HE   LYS  68          1HE       LYS  68   2.059  15.129  -3.534
  548   1HZ   LYS  68          1HZ       LYS  68   2.230  17.370  -3.720
  549   2HZ   LYS  68          2HZ       LYS  68   3.506  17.495  -2.615
  550   3HZ   LYS  68          3HZ       LYS  68   1.923  17.289  -2.058
  551    H    GLU  69           H        GLU  69  -1.293  13.040  -1.073
  552    HA   GLU  69           HA       GLU  69  -1.501  15.829  -0.651
  553   1HB   GLU  69          2HB       GLU  69  -2.352  14.613  -2.662
  554   2HB   GLU  69          1HB       GLU  69  -3.638  13.953  -1.662
  555   1HG   GLU  69          2HG       GLU  69  -4.538  16.144  -1.275
  556   2HG   GLU  69          1HG       GLU  69  -3.183  16.890  -2.120
  557    H    ASN  70           H        ASN  70  -2.917  13.044   0.897
  558    HA   ASN  70           HA       ASN  70  -4.139  14.824   2.885
  559   1HB   ASN  70          2HB       ASN  70  -5.903  12.788   2.956
  560   2HB   ASN  70          1HB       ASN  70  -6.132  14.225   1.964
  561   1HD2  ASN  70          1HD2      ASN  70  -5.055  14.046  -0.252
  562   2HD2  ASN  70          2HD2      ASN  70  -5.284  12.551  -1.087
  563    H    SER  71           H        SER  71  -1.688  13.001   2.629
  564    HA   SER  71           HA       SER  71  -1.707  12.084   5.317
  565   1HB   SER  71          2HB       SER  71  -2.553  10.215   3.262
  566   2HB   SER  71          1HB       SER  71  -1.106   9.643   4.091
  567    HG   SER  71           HG       SER  71  -2.306  10.140   6.084
  568    HA   PRO  72           HA       PRO  72   2.394  12.981   3.288
  569   1HB   PRO  72          2HB       PRO  72   2.777  14.781   5.560
  570   2HB   PRO  72          1HB       PRO  72   2.877  15.131   3.833
  571   1HG   PRO  72          2HG       PRO  72   0.866  16.052   5.384
  572   2HG   PRO  72          1HG       PRO  72   0.645  15.650   3.672
  573   1HD   PRO  72          2HD       PRO  72  -0.093  14.068   6.103
  574   2HD   PRO  72          1HD       PRO  72  -0.996  14.299   4.589
  575    H    ASP  73           H        ASP  73   1.297  12.092   6.398
  576    HA   ASP  73           HA       ASP  73   3.950  11.196   7.233
  577   1HB   ASP  73          2HB       ASP  73   2.125  12.460   8.690
  578   2HB   ASP  73          1HB       ASP  73   1.580  10.810   8.973
  579    H    SER  74           H        SER  74   2.435   9.888   5.085
  580    HA   SER  74           HA       SER  74   1.971   7.256   6.315
  581   1HB   SER  74          2HB       SER  74   0.007   8.133   5.152
  582   2HB   SER  74          1HB       SER  74   0.956   8.360   3.684
  583    HG   SER  74           HG       SER  74  -0.402   6.273   4.236
  584    H    VAL  75           H        VAL  75   2.138   5.718   3.966
  585    HA   VAL  75           HA       VAL  75   4.705   6.237   2.738
  586    HB   VAL  75           HB       VAL  75   4.373   3.697   4.338
  587   1HG1  VAL  75          1HG1      VAL  75   6.716   4.856   2.814
  588   2HG1  VAL  75          2HG1      VAL  75   5.718   3.498   2.297
  589   3HG1  VAL  75          3HG1      VAL  75   6.727   3.352   3.735
  590   1HG2  VAL  75          1HG2      VAL  75   4.647   5.515   5.883
  591   2HG2  VAL  75          2HG2      VAL  75   5.973   6.186   4.933
  592   3HG2  VAL  75          3HG2      VAL  75   6.178   4.644   5.766
  593    H    VAL  76           H        VAL  76   4.849   5.357   0.763
  594    HA   VAL  76           HA       VAL  76   2.702   3.489  -0.016
  595    HB   VAL  76           HB       VAL  76   4.124   5.150  -2.052
  596   1HG1  VAL  76          1HG1      VAL  76   2.249   3.234  -2.266
  597   2HG1  VAL  76          2HG1      VAL  76   2.433   4.557  -3.418
  598   3HG1  VAL  76          3HG1      VAL  76   1.222   4.663  -2.142
  599   1HG2  VAL  76          1HG2      VAL  76   2.147   6.130  -0.048
  600   2HG2  VAL  76          2HG2      VAL  76   2.071   6.747  -1.699
  601   3HG2  VAL  76          3HG2      VAL  76   3.543   6.951  -0.748
  602    H    ILE  77           H        ILE  77   3.467   1.499  -0.170
  603    HA   ILE  77           HA       ILE  77   6.224   0.990  -0.878
  604    HB   ILE  77           HB       ILE  77   4.009  -1.012  -0.423
  605   1HG1  ILE  77          2HG1      ILE  77   4.282   0.429   1.540
  606   2HG1  ILE  77          1HG1      ILE  77   4.885  -1.192   1.872
  607   1HG2  ILE  77          1HG2      ILE  77   6.436  -1.458  -1.521
  608   2HG2  ILE  77          2HG2      ILE  77   5.549  -2.648  -0.568
  609   3HG2  ILE  77          3HG2      ILE  77   6.809  -1.674   0.189
  610   1HD1  ILE  77          1HD1      ILE  77   7.161  -0.056   1.076
  611   2HD1  ILE  77          2HD1      ILE  77   6.598  -0.014   2.747
  612   3HD1  ILE  77          3HD1      ILE  77   6.331   1.373   1.691
  613    H    VAL  78           H        VAL  78   3.085  -0.130  -2.176
  614    HA   VAL  78           HA       VAL  78   2.452  -0.778  -4.270
  615    HB   VAL  78           HB       VAL  78   4.567   1.198  -5.152
  616   1HG1  VAL  78          1HG1      VAL  78   2.108   0.275  -6.632
  617   2HG1  VAL  78          2HG1      VAL  78   3.724  -0.375  -6.902
  618   3HG1  VAL  78          3HG1      VAL  78   3.391   1.325  -7.231
  619   1HG2  VAL  78          1HG2      VAL  78   2.241   2.514  -5.439
  620   2HG2  VAL  78          2HG2      VAL  78   3.241   2.612  -3.989
  621   3HG2  VAL  78          3HG2      VAL  78   1.855   1.523  -4.031
  622    H    ILE  79           H        ILE  79   3.186  -2.914  -4.128
  623    HA   ILE  79           HA       ILE  79   5.857  -3.504  -5.166
  624    HB   ILE  79           HB       ILE  79   4.013  -5.679  -4.281
  625   1HG1  ILE  79          2HG1      ILE  79   5.533  -3.941  -2.330
  626   2HG1  ILE  79          1HG1      ILE  79   3.794  -3.855  -2.580
  627   1HG2  ILE  79          1HG2      ILE  79   5.928  -6.777  -4.613
  628   2HG2  ILE  79          2HG2      ILE  79   6.528  -5.994  -3.153
  629   3HG2  ILE  79          3HG2      ILE  79   6.847  -5.277  -4.732
  630   1HD1  ILE  79          1HD1      ILE  79   3.590  -5.372  -0.985
  631   2HD1  ILE  79          2HD1      ILE  79   5.330  -5.661  -0.955
  632   3HD1  ILE  79          3HD1      ILE  79   4.308  -6.540  -2.093
  633    H    THR  80           H        THR  80   5.005  -6.195  -6.117
  634    HA   THR  80           HA       THR  80   4.239  -7.226  -7.990
  635    HB   THR  80           HB       THR  80   2.486  -5.014  -8.862
  636    HG1  THR  80           1HG      THR  80   1.909  -4.625  -6.870
  637   1HG2  THR  80          1HG2      THR  80   1.238  -6.658  -9.659
  638   2HG2  THR  80          2HG2      THR  80   1.206  -7.485  -8.101
  639   3HG2  THR  80          3HG2      THR  80   2.547  -7.754  -9.215
  640    H    GLY  81           H        GLY  81   4.937  -7.364 -10.075
  641   1HA   GLY  81          2HA       GLY  81   5.382  -6.130 -12.187
  642   2HA   GLY  81          1HA       GLY  81   6.192  -4.930 -11.190
  643    H    HIS  82           H        HIS  82   6.416  -8.438 -10.865
  644    HA   HIS  82           HA       HIS  82   9.255  -8.358 -10.763
  645   1HB   HIS  82          2HB       HIS  82   9.043 -10.875 -10.827
  646   2HB   HIS  82          1HB       HIS  82   8.154 -10.081  -9.532
  647    HD1  HIS  82           1HD      HIS  82   7.686 -12.079 -12.638
  648    HD2  HIS  82           2HD      HIS  82   5.346 -10.195  -9.767
  649    HE1  HIS  82           1HE      HIS  82   5.353 -12.945 -12.997
  650    HE2  HIS  82           2HE      HIS  82   3.941 -11.731 -11.301
  651    H    GLY  83           H        GLY  83   9.433  -7.160 -12.865
  652   1HA   GLY  83          2HA       GLY  83  10.599  -8.730 -14.826
  653   2HA   GLY  83          1HA       GLY  83   8.930  -8.501 -15.322
  654    H    SER  84           H        SER  84   8.706  -5.840 -14.191
  655    HA   SER  84           HA       SER  84  10.558  -4.344 -15.921
  656   1HB   SER  84          2HB       SER  84   7.558  -4.088 -15.741
  657   2HB   SER  84          1HB       SER  84   8.573  -2.791 -16.371
  658    HG   SER  84           HG       SER  84   9.039  -3.968 -18.103
  659    H    VAL  85           H        VAL  85  11.799  -3.278 -14.509
  660    HA   VAL  85           HA       VAL  85  10.762  -2.308 -12.000
  661    HB   VAL  85           HB       VAL  85  13.049  -3.189 -12.143
  662   1HG1  VAL  85          1HG1      VAL  85  13.244  -1.204 -14.289
  663   2HG1  VAL  85          2HG1      VAL  85  14.152  -2.693 -14.031
  664   3HG1  VAL  85          3HG1      VAL  85  14.618  -1.218 -13.184
  665   1HG2  VAL  85          1HG2      VAL  85  13.276  -0.267 -11.507
  666   2HG2  VAL  85          2HG2      VAL  85  14.024  -1.642 -10.696
  667   3HG2  VAL  85          3HG2      VAL  85  12.294  -1.346 -10.515
  668    H    ASP  86           H        ASP  86  10.475  -1.145 -15.054
  669    HA   ASP  86           HA       ASP  86  11.130   1.603 -14.675
  670   1HB   ASP  86          2HB       ASP  86   9.285   0.350 -16.719
  671   2HB   ASP  86          1HB       ASP  86   9.978   1.968 -16.797
  672    H    THR  87           H        THR  87   8.628  -0.269 -13.445
  673    HA   THR  87           HA       THR  87   6.682   1.898 -13.427
  674    HB   THR  87           HB       THR  87   6.211  -0.692 -13.661
  675    HG1  THR  87           1HG      THR  87   4.613   0.934 -13.601
  676   1HG2  THR  87          1HG2      THR  87   7.280  -1.161 -11.395
  677   2HG2  THR  87          2HG2      THR  87   5.698  -1.871 -11.716
  678   3HG2  THR  87          3HG2      THR  87   5.830  -0.435 -10.701
  679    H    ALA  88           H        ALA  88   8.798   0.134 -11.246
  680    HA   ALA  88           HA       ALA  88   7.985   1.217  -8.808
  681   1HB   ALA  88          1HB       ALA  88  10.133   0.568  -7.962
  682   2HB   ALA  88          2HB       ALA  88  10.822   0.551  -9.584
  683   3HB   ALA  88          3HB       ALA  88   9.617  -0.652  -9.126
  684    H    VAL  89           H        VAL  89  10.662   2.254 -10.892
  685    HA   VAL  89           HA       VAL  89  11.337   4.587  -9.550
  686    HB   VAL  89           HB       VAL  89  12.422   5.324 -11.587
  687   1HG1  VAL  89          1HG1      VAL  89  12.626   2.528 -10.679
  688   2HG1  VAL  89          2HG1      VAL  89  13.858   3.786 -10.774
  689   3HG1  VAL  89          3HG1      VAL  89  13.396   2.893 -12.223
  690   1HG2  VAL  89          1HG2      VAL  89  12.118   3.803 -13.652
  691   2HG2  VAL  89          2HG2      VAL  89  10.886   5.018 -13.311
  692   3HG2  VAL  89          3HG2      VAL  89  10.600   3.329 -12.889
  693    H    LYS  90           H        LYS  90   8.744   3.941 -11.801
  694    HA   LYS  90           HA       LYS  90   8.068   6.695 -12.240
  695   1HB   LYS  90          2HB       LYS  90   7.532   5.054 -13.938
  696   2HB   LYS  90          1HB       LYS  90   6.568   4.130 -12.795
  697   1HG   LYS  90          2HG       LYS  90   4.916   5.862 -12.691
  698   2HG   LYS  90          1HG       LYS  90   5.920   6.939 -13.664
  699   1HD   LYS  90          2HD       LYS  90   5.464   4.390 -14.975
  700   2HD   LYS  90          1HD       LYS  90   3.953   5.217 -14.593
  701   1HE   LYS  90          2HE       LYS  90   4.271   6.708 -16.216
  702   2HE   LYS  90          1HE       LYS  90   5.908   7.054 -15.663
  703   1HZ   LYS  90          1HZ       LYS  90   6.794   5.709 -17.200
  704   2HZ   LYS  90          2HZ       LYS  90   5.312   5.882 -17.997
  705   3HZ   LYS  90          3HZ       LYS  90   5.599   4.524 -17.030
  706    H    ALA  91           H        ALA  91   7.728   4.713  -9.588
  707    HA   ALA  91           HA       ALA  91   5.350   6.190  -8.672
  708   1HB   ALA  91          1HB       ALA  91   5.092   4.186  -7.083
  709   2HB   ALA  91          2HB       ALA  91   6.186   3.353  -8.187
  710   3HB   ALA  91          3HB       ALA  91   4.644   3.975  -8.776
  711    H    ILE  92           H        ILE  92   8.505   4.888  -7.758
  712    HA   ILE  92           HA       ILE  92   8.407   5.914  -5.095
  713    HB   ILE  92           HB       ILE  92  10.630   5.169  -4.824
  714   1HG1  ILE  92          2HG1      ILE  92  10.824   5.087  -7.843
  715   2HG1  ILE  92          1HG1      ILE  92  11.648   6.219  -6.778
  716   1HG2  ILE  92          1HG2      ILE  92  10.555   2.882  -6.036
  717   2HG2  ILE  92          2HG2      ILE  92   8.972   3.418  -6.595
  718   3HG2  ILE  92          3HG2      ILE  92   9.295   3.278  -4.869
  719   1HD1  ILE  92          1HD1      ILE  92  12.230   3.500  -6.033
  720   2HD1  ILE  92          2HD1      ILE  92  13.327   4.808  -6.474
  721   3HD1  ILE  92          3HD1      ILE  92  12.613   3.795  -7.729
  722    H    LYS  93           H        LYS  93   9.628   7.102  -8.159
  723    HA   LYS  93           HA       LYS  93  11.136   9.259  -7.137
  724   1HB   LYS  93          2HB       LYS  93  11.008   8.215  -9.547
  725   2HB   LYS  93          1HB       LYS  93   9.763   9.433  -9.790
  726   1HG   LYS  93          2HG       LYS  93  11.353  11.186  -9.194
  727   2HG   LYS  93          1HG       LYS  93  12.602   9.966  -8.937
  728   1HD   LYS  93          2HD       LYS  93  11.267   9.813 -11.545
  729   2HD   LYS  93          1HD       LYS  93  12.180  11.300 -11.275
  730   1HE   LYS  93          2HE       LYS  93  13.576   8.863 -10.444
  731   2HE   LYS  93          1HE       LYS  93  13.229   8.940 -12.170
  732   1HZ   LYS  93          1HZ       LYS  93  15.397   9.920 -11.512
  733   2HZ   LYS  93          2HZ       LYS  93  14.560  11.119 -10.660
  734   3HZ   LYS  93          3HZ       LYS  93  14.387  10.995 -12.339
  735    H    LYS  94           H        LYS  94   7.765   8.749  -7.376
  736    HA   LYS  94           HA       LYS  94   7.078  11.558  -7.407
  737   1HB   LYS  94          2HB       LYS  94   5.769   9.373  -8.282
  738   2HB   LYS  94          1HB       LYS  94   5.021   9.571  -6.703
  739   1HG   LYS  94          2HG       LYS  94   3.617  10.896  -7.857
  740   2HG   LYS  94          1HG       LYS  94   4.880  12.098  -7.583
  741   1HD   LYS  94          2HD       LYS  94   5.695  11.922  -9.749
  742   2HD   LYS  94          1HD       LYS  94   4.976  10.328  -9.995
  743   1HE   LYS  94          2HE       LYS  94   2.741  11.725  -9.618
  744   2HE   LYS  94          1HE       LYS  94   3.763  13.026 -10.228
  745   1HZ   LYS  94          1HZ       LYS  94   4.285  11.077 -11.982
  746   2HZ   LYS  94          2HZ       LYS  94   3.091  12.255 -12.209
  747   3HZ   LYS  94          3HZ       LYS  94   2.671  10.729 -11.612
  748    H    GLY  95           H        GLY  95   6.562   8.851  -5.135
  749   1HA   GLY  95          2HA       GLY  95   7.378  10.264  -2.855
  750   2HA   GLY  95          1HA       GLY  95   5.640  10.459  -3.012
  751    H    ALA  96           H        ALA  96   7.359   7.543  -3.983
  752    HA   ALA  96           HA       ALA  96   5.756   6.037  -2.079
  753   1HB   ALA  96          1HB       ALA  96   5.930   4.272  -3.471
  754   2HB   ALA  96          2HB       ALA  96   7.628   4.587  -3.832
  755   3HB   ALA  96          3HB       ALA  96   6.366   5.512  -4.647
  756    H    TYR  97           H        TYR  97   7.437   3.803  -1.750
  757    HA   TYR  97           HA       TYR  97   9.473   4.932   0.049
  758   1HB   TYR  97          2HB       TYR  97   7.641   3.746   1.178
  759   2HB   TYR  97          1HB       TYR  97   8.008   2.297   0.252
  760    HD1  TYR  97           1HD      TYR  97   9.517   0.733   1.093
  761    HD2  TYR  97           2HD      TYR  97   9.519   4.677   2.686
  762    HE1  TYR  97           1HE      TYR  97  11.103   0.023   2.832
  763    HE2  TYR  97           2HE      TYR  97  11.106   3.979   4.430
  764    HH   TYR  97           HH       TYR  97  11.841   0.696   5.038
  765    H    GLU  98           H        GLU  98   9.678   4.161  -2.835
  766    HA   GLU  98           HA       GLU  98  11.453   3.503  -4.116
  767   1HB   GLU  98          2HB       GLU  98  13.453   2.964  -3.208
  768   2HB   GLU  98          1HB       GLU  98  12.682   3.548  -1.744
  769   1HG   GLU  98          2HG       GLU  98  11.980   0.961  -1.615
  770   2HG   GLU  98          1HG       GLU  98  13.491   0.818  -2.511
  771    H    PHE  99           H        PHE  99   8.943   1.946  -3.417
  772    HA   PHE  99           HA       PHE  99   7.949  -0.001  -4.052
  773   1HB   PHE  99          2HB       PHE  99   9.963   0.584  -6.009
  774   2HB   PHE  99          1HB       PHE  99   9.839  -1.159  -5.813
  775    HD1  PHE  99           1HD      PHE  99   8.596  -2.076  -7.501
  776    HD2  PHE  99           2HD      PHE  99   7.341   1.617  -5.799
  777    HE1  PHE  99           1HE      PHE  99   6.606  -2.092  -8.948
  778    HE2  PHE  99           2HE      PHE  99   5.348   1.608  -7.242
  779    HZ   PHE  99           HZ       PHE  99   4.978  -0.248  -8.818
  780    H    LEU 100           H        LEU 100   8.128  -2.384  -4.043
  781    HA   LEU 100           HA       LEU 100  10.211  -3.297  -2.182
  782   1HB   LEU 100          2HB       LEU 100   7.783  -3.191  -1.394
  783   2HB   LEU 100          1HB       LEU 100   7.481  -4.516  -2.498
  784    HG   LEU 100           HG       LEU 100   7.825  -5.258  -0.166
  785   1HD1  LEU 100          1HD1      LEU 100   8.425  -6.625  -2.217
  786   2HD1  LEU 100          2HD1      LEU 100   9.178  -7.106  -0.696
  787   3HD1  LEU 100          3HD1      LEU 100  10.102  -6.191  -1.886
  788   1HD2  LEU 100          1HD2      LEU 100  10.664  -4.336  -0.558
  789   2HD2  LEU 100          2HD2      LEU 100   9.965  -5.080   0.879
  790   3HD2  LEU 100          3HD2      LEU 100   9.460  -3.463   0.390
  791    H    GLU 101           H        GLU 101  11.550  -3.806  -4.031
  792    HA   GLU 101           HA       GLU 101  10.646  -6.200  -5.494
  793   1HB   GLU 101          2HB       GLU 101  12.158  -5.563  -7.290
  794   2HB   GLU 101          1HB       GLU 101  11.043  -4.249  -6.941
  795   1HG   GLU 101          2HG       GLU 101  13.234  -3.735  -5.323
  796   2HG   GLU 101          1HG       GLU 101  13.930  -4.307  -6.838
  797    H    LYS 102           H        LYS 102  11.513  -7.980  -4.682
  798    HA   LYS 102           HA       LYS 102  14.219  -8.551  -4.686
  799   1HB   LYS 102          2HB       LYS 102  14.488  -6.985  -2.858
  800   2HB   LYS 102          1HB       LYS 102  13.215  -7.772  -1.943
  801   1HG   LYS 102          2HG       LYS 102  15.113  -8.597  -0.944
  802   2HG   LYS 102          1HG       LYS 102  14.741  -9.866  -2.113
  803   1HD   LYS 102          2HD       LYS 102  16.817  -9.629  -2.888
  804   2HD   LYS 102          1HD       LYS 102  16.327  -8.055  -3.515
  805   1HE   LYS 102          2HE       LYS 102  17.565  -8.631  -0.827
  806   2HE   LYS 102          1HE       LYS 102  18.326  -7.806  -2.187
  807   1HZ   LYS 102          1HZ       LYS 102  16.410  -6.805  -0.248
  808   2HZ   LYS 102          2HZ       LYS 102  16.164  -6.299  -1.844
  809   3HZ   LYS 102          3HZ       LYS 102  17.640  -5.991  -1.078
  810    HA   PRO 103           HA       PRO 103  11.923 -12.090  -2.451
  811   1HB   PRO 103          2HB       PRO 103   9.493 -11.734  -1.402
  812   2HB   PRO 103          1HB       PRO 103  10.945 -11.195  -0.548
  813   1HG   PRO 103          2HG       PRO 103   9.008  -9.598  -2.181
  814   2HG   PRO 103          1HG       PRO 103   9.746  -9.201  -0.618
  815   1HD   PRO 103          2HD       PRO 103  10.648  -8.248  -3.030
  816   2HD   PRO 103          1HD       PRO 103  11.662  -8.426  -1.587
  817    H    PHE 104           H        PHE 104   9.543 -13.276  -2.645
  818    HA   PHE 104           HA       PHE 104   8.346 -12.659  -5.229
  819   1HB   PHE 104          2HB       PHE 104   9.898 -15.150  -4.610
  820   2HB   PHE 104          1HB       PHE 104   8.549 -15.212  -5.739
  821    HD1  PHE 104           1HD      PHE 104  11.998 -14.401  -5.290
  822    HD2  PHE 104           2HD      PHE 104   8.604 -13.671  -7.752
  823    HE1  PHE 104           1HE      PHE 104  13.478 -13.609  -7.089
  824    HE2  PHE 104           2HE      PHE 104  10.078 -12.880  -9.555
  825    HZ   PHE 104           HZ       PHE 104  12.518 -12.848  -9.226
  826    H    SER 105           H        SER 105   7.558 -12.703  -2.344
  827    HA   SER 105           HA       SER 105   5.066 -14.141  -2.726
  828   1HB   SER 105          2HB       SER 105   6.295 -15.879  -1.656
  829   2HB   SER 105          1HB       SER 105   6.993 -14.760  -0.485
  830    HG   SER 105           HG       SER 105   5.340 -15.801   0.543
  831    H    VAL 106           H        VAL 106   6.445 -13.017   0.333
  832    HA   VAL 106           HA       VAL 106   5.436 -10.419   0.348
  833    HB   VAL 106           HB       VAL 106   3.224 -11.475   0.159
  834   1HG1  VAL 106          1HG1      VAL 106   3.900 -12.779   2.794
  835   2HG1  VAL 106          2HG1      VAL 106   3.731 -13.601   1.242
  836   3HG1  VAL 106          3HG1      VAL 106   2.332 -12.828   1.988
  837   1HG2  VAL 106          1HG2      VAL 106   3.580 -10.333   2.921
  838   2HG2  VAL 106          2HG2      VAL 106   2.151 -10.251   1.891
  839   3HG2  VAL 106          3HG2      VAL 106   3.606  -9.358   1.452
  840    H    GLU 107           H        GLU 107   5.949 -13.335   2.277
  841    HA   GLU 107           HA       GLU 107   6.199 -12.469   4.806
  842   1HB   GLU 107          2HB       GLU 107   6.717 -14.769   3.780
  843   2HB   GLU 107          1HB       GLU 107   8.368 -14.179   3.643
  844   1HG   GLU 107          2HG       GLU 107   8.467 -13.825   6.031
  845   2HG   GLU 107          1HG       GLU 107   6.787 -14.332   6.194
  846    H    ARG 108           H        ARG 108   8.608 -11.956   2.265
  847    HA   ARG 108           HA       ARG 108  10.538 -10.751   3.976
  848   1HB   ARG 108          2HB       ARG 108  10.611 -11.712   1.443
  849   2HB   ARG 108          1HB       ARG 108  10.533  -9.985   1.121
  850   1HG   ARG 108          2HG       ARG 108  12.639  -9.647   1.783
  851   2HG   ARG 108          1HG       ARG 108  12.468 -10.704   3.187
  852   1HD   ARG 108          2HD       ARG 108  12.399 -12.328   0.861
  853   2HD   ARG 108          1HD       ARG 108  13.764 -11.224   0.706
  854    HE   ARG 108           HE       ARG 108  14.814 -12.327   2.419
  855   1HH1  ARG 108          1HH1      ARG 108  11.456 -13.273   2.343
  856   2HH1  ARG 108          2HH1      ARG 108  11.658 -14.546   3.498
  857   1HH2  ARG 108          1HH2      ARG 108  15.082 -14.003   3.940
  858   2HH2  ARG 108          2HH2      ARG 108  13.716 -14.961   4.406
  859    H    PHE 109           H        PHE 109   7.946  -9.518   1.931
  860    HA   PHE 109           HA       PHE 109   8.529  -6.794   2.047
  861   1HB   PHE 109          2HB       PHE 109   6.861  -7.484   0.515
  862   2HB   PHE 109          1HB       PHE 109   5.938  -8.309   1.765
  863    HD1  PHE 109           1HD      PHE 109   7.344  -4.868   1.782
  864    HD2  PHE 109           2HD      PHE 109   3.855  -7.302   1.702
  865    HE1  PHE 109           1HE      PHE 109   5.945  -2.866   2.076
  866    HE2  PHE 109           2HE      PHE 109   2.449  -5.304   1.995
  867    HZ   PHE 109           HZ       PHE 109   3.495  -3.082   2.181
  868    H    LEU 110           H        LEU 110   7.090  -8.920   4.410
  869    HA   LEU 110           HA       LEU 110   5.791  -7.174   6.091
  870   1HB   LEU 110          2HB       LEU 110   6.714  -9.813   6.216
  871   2HB   LEU 110          1HB       LEU 110   7.303  -9.015   7.662
  872    HG   LEU 110           HG       LEU 110   4.428  -9.188   6.766
  873   1HD1  LEU 110          1HD1      LEU 110   6.073 -10.611   8.806
  874   2HD1  LEU 110          2HD1      LEU 110   4.898 -11.255   7.660
  875   3HD1  LEU 110          3HD1      LEU 110   4.348 -10.362   9.078
  876   1HD2  LEU 110          1HD2      LEU 110   5.324  -7.063   8.018
  877   2HD2  LEU 110          2HD2      LEU 110   5.277  -8.131   9.419
  878   3HD2  LEU 110          3HD2      LEU 110   3.805  -7.819   8.499
  879    H    LEU 111           H        LEU 111   9.230  -7.720   5.729
  880    HA   LEU 111           HA       LEU 111  10.116  -6.351   8.015
  881   1HB   LEU 111          2HB       LEU 111  11.383  -6.902   5.351
  882   2HB   LEU 111          1HB       LEU 111  12.221  -6.006   6.604
  883    HG   LEU 111           HG       LEU 111  12.063  -7.933   8.108
  884   1HD1  LEU 111          1HD1      LEU 111  10.692  -9.248   5.770
  885   2HD1  LEU 111          2HD1      LEU 111  10.018  -8.938   7.370
  886   3HD1  LEU 111          3HD1      LEU 111  11.319 -10.113   7.173
  887   1HD2  LEU 111          1HD2      LEU 111  13.995  -7.663   6.580
  888   2HD2  LEU 111          2HD2      LEU 111  13.185  -8.718   5.421
  889   3HD2  LEU 111          3HD2      LEU 111  13.665  -9.345   6.998
  890    H    THR 112           H        THR 112   9.737  -5.230   4.659
  891    HA   THR 112           HA       THR 112  10.517  -2.604   4.966
  892    HB   THR 112           HB       THR 112   8.336  -3.724   3.198
  893    HG1  THR 112           1HG      THR 112  11.067  -3.156   2.697
  894   1HG2  THR 112          1HG2      THR 112   9.289  -1.679   1.776
  895   2HG2  THR 112          2HG2      THR 112   9.453  -1.002   3.396
  896   3HG2  THR 112          3HG2      THR 112   7.877  -1.550   2.824
  897    H    ILE 113           H        ILE 113   7.372  -4.063   5.699
  898    HA   ILE 113           HA       ILE 113   5.878  -1.764   6.164
  899    HB   ILE 113           HB       ILE 113   5.788  -4.501   7.418
  900   1HG1  ILE 113          2HG1      ILE 113   5.049  -4.331   5.106
  901   2HG1  ILE 113          1HG1      ILE 113   3.666  -4.639   6.151
  902   1HG2  ILE 113          1HG2      ILE 113   4.041  -2.139   8.063
  903   2HG2  ILE 113          2HG2      ILE 113   4.982  -3.133   9.174
  904   3HG2  ILE 113          3HG2      ILE 113   3.563  -3.809   8.374
  905   1HD1  ILE 113          1HD1      ILE 113   3.690  -1.920   6.049
  906   2HD1  ILE 113          2HD1      ILE 113   2.711  -2.970   5.025
  907   3HD1  ILE 113          3HD1      ILE 113   4.256  -2.355   4.437
  908    H    LYS 114           H        LYS 114   7.454  -3.722   8.694
  909    HA   LYS 114           HA       LYS 114   7.248  -1.815  10.733
  910   1HB   LYS 114          2HB       LYS 114   7.710  -4.116  11.268
  911   2HB   LYS 114          1HB       LYS 114   9.200  -4.086  10.338
  912   1HG   LYS 114          2HG       LYS 114   8.977  -2.141  12.552
  913   2HG   LYS 114          1HG       LYS 114   9.132  -3.844  12.991
  914   1HD   LYS 114          2HD       LYS 114  11.296  -3.877  12.439
  915   2HD   LYS 114          1HD       LYS 114  10.984  -3.099  10.886
  916   1HE   LYS 114          2HE       LYS 114  11.748  -1.154  11.640
  917   2HE   LYS 114          1HE       LYS 114  10.668  -1.210  13.032
  918   1HZ   LYS 114          1HZ       LYS 114  13.312  -1.277  13.231
  919   2HZ   LYS 114          2HZ       LYS 114  13.000  -2.938  13.159
  920   3HZ   LYS 114          3HZ       LYS 114  12.285  -1.994  14.366
  921    H    HIS 115           H        HIS 115   9.184  -1.809   7.969
  922    HA   HIS 115           HA       HIS 115  11.282  -0.146   9.115
  923   1HB   HIS 115          2HB       HIS 115  10.860  -1.126   6.285
  924   2HB   HIS 115          1HB       HIS 115  12.250  -0.199   6.837
  925    HD1  HIS 115           1HD      HIS 115  12.182  -2.032   9.612
  926    HD2  HIS 115           2HD      HIS 115  12.688  -3.230   5.666
  927    HE1  HIS 115           1HE      HIS 115  13.374  -4.243   9.729
  928    HE2  HIS 115           2HE      HIS 115  13.748  -4.906   7.327
  929    H    ALA 116           H        ALA 116   8.343   0.079   7.323
  930    HA   ALA 116           HA       ALA 116   8.778   2.759   6.356
  931   1HB   ALA 116          1HB       ALA 116   6.142   2.407   6.030
  932   2HB   ALA 116          2HB       ALA 116   6.645   0.722   6.161
  933   3HB   ALA 116          3HB       ALA 116   7.345   1.756   4.916
  934    H    PHE 117           H        PHE 117   6.768   1.227   8.857
  935    HA   PHE 117           HA       PHE 117   5.504   3.523   9.810
  936   1HB   PHE 117          2HB       PHE 117   6.160   0.862  11.021
  937   2HB   PHE 117          1HB       PHE 117   5.476   2.131  12.030
  938    HD1  PHE 117           1HD      PHE 117   3.215   2.986  11.582
  939    HD2  PHE 117           2HD      PHE 117   4.843  -0.286   9.403
  940    HE1  PHE 117           1HE      PHE 117   0.958   2.384  10.808
  941    HE2  PHE 117           2HE      PHE 117   2.591  -0.893   8.627
  942    HZ   PHE 117           HZ       PHE 117   0.645   0.448   9.325
  943    H    GLU 118           H        GLU 118   8.764   2.474  10.176
  944    HA   GLU 118           HA       GLU 118   9.568   3.542  12.575
  945   1HB   GLU 118          2HB       GLU 118  11.098   3.677   9.972
  946   2HB   GLU 118          1HB       GLU 118  11.788   3.802  11.584
  947   1HG   GLU 118          2HG       GLU 118  10.770   1.475  11.971
  948   2HG   GLU 118          1HG       GLU 118  10.628   1.410  10.215
  949    H    GLU 119           H        GLU 119   8.636   5.225   9.678
  950    HA   GLU 119           HA       GLU 119   9.557   7.779  10.773
  951   1HB   GLU 119          2HB       GLU 119   8.306   7.227   8.078
  952   2HB   GLU 119          1HB       GLU 119   9.103   8.710   8.585
  953   1HG   GLU 119          2HG       GLU 119  11.076   7.937   7.953
  954   2HG   GLU 119          1HG       GLU 119  10.873   6.482   8.927
  955    H    TYR 120           H        TYR 120   7.328   6.321  11.951
  956    HA   TYR 120           HA       TYR 120   5.378   8.476  11.876
  957   1HB   TYR 120          2HB       TYR 120   4.612   6.854  10.154
  958   2HB   TYR 120          1HB       TYR 120   4.549   5.606  11.393
  959    HD1  TYR 120           1HD      TYR 120   2.435   5.121  12.155
  960    HD2  TYR 120           2HD      TYR 120   3.315   9.119  11.004
  961    HE1  TYR 120           1HE      TYR 120   0.129   5.779  12.701
  962    HE2  TYR 120           2HE      TYR 120   1.012   9.789  11.547
  963    HH   TYR 120           HH       TYR 120  -0.853   9.061  12.879
  964    H    SER 121           H        SER 121   7.308   7.458  13.804
  965    HA   SER 121           HA       SER 121   5.467   7.093  16.033
  966   1HB   SER 121          2HB       SER 121   7.173   5.317  16.922
  967   2HB   SER 121          1HB       SER 121   5.927   4.826  15.774
  968    HG   SER 121           HG       SER 121   7.447   4.923  14.130
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  -3.352   2.361  14.649
    2   2H    MET   1          2HT       MET   1  -2.732   3.956  14.531
    3   3H    MET   1          3HT       MET   1  -3.527   3.445  15.963
    4    HA   MET   1           HA       MET   1  -1.044   3.563  15.992
    5   1HB   MET   1          2HB       MET   1  -0.991   1.338  17.248
    6   2HB   MET   1          1HB       MET   1  -2.173   2.524  17.783
    7   1HG   MET   1          2HG       MET   1  -3.818   1.290  16.259
    8   2HG   MET   1          1HG       MET   1  -2.617  -0.001  16.240
    9   1HE   MET   1          1HE       MET   1  -1.813  -1.278  18.681
   10   2HE   MET   1          2HE       MET   1  -2.971  -1.885  17.497
   11   3HE   MET   1          3HE       MET   1  -3.338  -1.983  19.219
   12    H    LYS   2           H        LYS   2  -2.422   0.682  14.392
   13    HA   LYS   2           HA       LYS   2  -0.092   0.579  12.649
   14   1HB   LYS   2          2HB       LYS   2  -0.961  -1.784  14.321
   15   2HB   LYS   2          1HB       LYS   2   0.291  -1.805  13.088
   16   1HG   LYS   2          2HG       LYS   2   0.392  -0.111  15.572
   17   2HG   LYS   2          1HG       LYS   2   1.153  -1.695  15.408
   18   1HD   LYS   2          2HD       LYS   2   2.667  -0.923  13.790
   19   2HD   LYS   2          1HD       LYS   2   1.723   0.536  13.479
   20   1HE   LYS   2          2HE       LYS   2   2.598   1.639  15.248
   21   2HE   LYS   2          1HE       LYS   2   2.686   0.187  16.244
   22   1HZ   LYS   2          1HZ       LYS   2   4.569  -0.452  14.615
   23   2HZ   LYS   2          2HZ       LYS   2   4.888   0.655  15.855
   24   3HZ   LYS   2          3HZ       LYS   2   4.623   1.205  14.277
   25    H    ARG   3           H        ARG   3  -1.333   0.988  10.864
   26    HA   ARG   3           HA       ARG   3  -3.060  -1.197   9.989
   27   1HB   ARG   3          2HB       ARG   3  -4.025   1.610   9.578
   28   2HB   ARG   3          1HB       ARG   3  -4.933   0.107   9.518
   29   1HG   ARG   3          2HG       ARG   3  -5.677   0.932  11.500
   30   2HG   ARG   3          1HG       ARG   3  -4.284   0.013  12.072
   31   1HD   ARG   3          2HD       ARG   3  -3.195   1.859  12.723
   32   2HD   ARG   3          1HD       ARG   3  -3.623   2.734  11.254
   33    HE   ARG   3           HE       ARG   3  -5.791   2.427  13.127
   34   1HH1  ARG   3          1HH1      ARG   3  -3.088   4.408  12.149
   35   2HH1  ARG   3          2HH1      ARG   3  -3.721   5.847  12.873
   36   1HH2  ARG   3          1HH2      ARG   3  -6.624   4.320  14.080
   37   2HH2  ARG   3          2HH2      ARG   3  -5.727   5.797  13.970
   38    H    VAL   4           H        VAL   4  -2.863  -1.638   7.848
   39    HA   VAL   4           HA       VAL   4  -1.465   0.344   6.177
   40    HB   VAL   4           HB       VAL   4  -1.048  -2.635   5.938
   41   1HG1  VAL   4          1HG1      VAL   4   1.038  -0.934   4.907
   42   2HG1  VAL   4          2HG1      VAL   4  -0.518  -0.521   4.192
   43   3HG1  VAL   4          3HG1      VAL   4   0.090  -2.172   4.084
   44   1HG2  VAL   4          1HG2      VAL   4   0.865  -0.654   7.162
   45   2HG2  VAL   4          2HG2      VAL   4   1.039  -2.406   7.070
   46   3HG2  VAL   4          3HG2      VAL   4  -0.199  -1.696   8.106
   47    H    LEU   5           H        LEU   5  -2.128   0.512   4.056
   48    HA   LEU   5           HA       LEU   5  -4.692  -0.762   3.456
   49   1HB   LEU   5          2HB       LEU   5  -4.403   1.755   3.401
   50   2HB   LEU   5          1HB       LEU   5  -3.392   1.526   1.988
   51    HG   LEU   5           HG       LEU   5  -5.235   0.640   0.724
   52   1HD1  LEU   5          1HD1      LEU   5  -6.733  -0.563   1.858
   53   2HD1  LEU   5          2HD1      LEU   5  -7.519   0.976   2.208
   54   3HD1  LEU   5          3HD1      LEU   5  -6.391   0.278   3.370
   55   1HD2  LEU   5          1HD2      LEU   5  -6.644   2.891   2.001
   56   2HD2  LEU   5          2HD2      LEU   5  -6.207   2.633   0.312
   57   3HD2  LEU   5          3HD2      LEU   5  -5.000   3.223   1.455
   58    H    VAL   6           H        VAL   6  -4.833  -2.331   1.997
   59    HA   VAL   6           HA       VAL   6  -2.565  -2.710   0.153
   60    HB   VAL   6           HB       VAL   6  -4.526  -4.829   1.029
   61   1HG1  VAL   6          1HG1      VAL   6  -2.236  -4.724  -0.825
   62   2HG1  VAL   6          2HG1      VAL   6  -3.666  -5.756  -0.842
   63   3HG1  VAL   6          3HG1      VAL   6  -2.315  -6.137   0.227
   64   1HG2  VAL   6          1HG2      VAL   6  -3.102  -5.522   2.701
   65   2HG2  VAL   6          2HG2      VAL   6  -2.909  -3.772   2.798
   66   3HG2  VAL   6          3HG2      VAL   6  -1.696  -4.749   1.972
   67    H    VAL   7           H        VAL   7  -3.373  -1.380  -1.479
   68    HA   VAL   7           HA       VAL   7  -6.004  -1.827  -2.573
   69    HB   VAL   7           HB       VAL   7  -3.761  -0.187  -3.762
   70   1HG1  VAL   7          1HG1      VAL   7  -6.748  -0.039  -4.152
   71   2HG1  VAL   7          2HG1      VAL   7  -5.596  -0.729  -5.296
   72   3HG1  VAL   7          3HG1      VAL   7  -5.542   0.993  -4.921
   73   1HG2  VAL   7          1HG2      VAL   7  -5.878   0.580  -1.760
   74   2HG2  VAL   7          2HG2      VAL   7  -4.930   1.746  -2.682
   75   3HG2  VAL   7          3HG2      VAL   7  -4.129   0.651  -1.557
   76    H    ASP   8           H        ASP   8  -6.268  -3.747  -3.562
   77    HA   ASP   8           HA       ASP   8  -4.484  -4.344  -5.812
   78   1HB   ASP   8          2HB       ASP   8  -3.767  -5.747  -3.922
   79   2HB   ASP   8          1HB       ASP   8  -5.404  -6.372  -3.762
   80    H    ASP   9           H        ASP   9  -5.468  -5.130  -7.599
   81    HA   ASP   9           HA       ASP   9  -8.388  -5.193  -7.561
   82   1HB   ASP   9          2HB       ASP   9  -7.220  -3.761  -9.226
   83   2HB   ASP   9          1HB       ASP   9  -6.496  -5.206  -9.926
   84    H    GLU  10           H        GLU  10  -7.068  -7.387  -6.377
   85    HA   GLU  10           HA       GLU  10  -8.140  -9.530  -8.017
   86   1HB   GLU  10          2HB       GLU  10  -5.602  -9.143  -8.482
   87   2HB   GLU  10          1HB       GLU  10  -5.376  -9.905  -6.914
   88   1HG   GLU  10          2HG       GLU  10  -5.172 -11.461  -8.823
   89   2HG   GLU  10          1HG       GLU  10  -6.419 -11.919  -7.664
   90    H    GLU  11           H        GLU  11  -8.168 -11.621  -6.804
   91    HA   GLU  11           HA       GLU  11  -9.125 -11.153  -4.142
   92   1HB   GLU  11          2HB       GLU  11  -8.750 -13.715  -5.701
   93   2HB   GLU  11          1HB       GLU  11  -9.543 -13.606  -4.136
   94   1HG   GLU  11          2HG       GLU  11 -10.512 -11.947  -6.418
   95   2HG   GLU  11          1HG       GLU  11 -10.959 -13.649  -6.305
   96    H    SER  12           H        SER  12  -6.256 -12.585  -5.585
   97    HA   SER  12           HA       SER  12  -5.182 -13.816  -3.318
   98   1HB   SER  12          2HB       SER  12  -4.303 -14.177  -5.584
   99   2HB   SER  12          1HB       SER  12  -3.705 -12.518  -5.618
  100    HG   SER  12           HG       SER  12  -2.857 -14.638  -3.942
  101    H    ILE  13           H        ILE  13  -2.758 -12.852  -2.723
  102    HA   ILE  13           HA       ILE  13  -1.625 -11.396  -1.408
  103    HB   ILE  13           HB       ILE  13  -3.290  -9.526  -3.046
  104   1HG1  ILE  13          2HG1      ILE  13  -1.367 -10.665  -4.076
  105   2HG1  ILE  13          1HG1      ILE  13  -1.129  -8.922  -4.003
  106   1HG2  ILE  13          1HG2      ILE  13  -1.506  -8.800  -0.740
  107   2HG2  ILE  13          2HG2      ILE  13  -3.152  -8.261  -1.071
  108   3HG2  ILE  13          3HG2      ILE  13  -1.818  -7.680  -2.066
  109   1HD1  ILE  13          1HD1      ILE  13   0.263 -11.091  -2.533
  110   2HD1  ILE  13          2HD1      ILE  13   0.100  -9.515  -1.760
  111   3HD1  ILE  13          3HD1      ILE  13   0.915  -9.654  -3.318
  112    H    THR  14           H        THR  14  -4.812  -9.798  -1.474
  113    HA   THR  14           HA       THR  14  -4.889  -9.117   1.207
  114    HB   THR  14           HB       THR  14  -7.255  -8.748   0.921
  115    HG1  THR  14           1HG      THR  14  -8.436  -9.816  -0.475
  116   1HG2  THR  14          1HG2      THR  14  -5.691  -7.265  -0.363
  117   2HG2  THR  14          2HG2      THR  14  -7.341  -7.352  -0.979
  118   3HG2  THR  14          3HG2      THR  14  -6.051  -8.247  -1.782
  119    H    SER  15           H        SER  15  -5.404 -12.203  -0.257
  120    HA   SER  15           HA       SER  15  -6.749 -13.288   2.083
  121   1HB   SER  15          2HB       SER  15  -7.442 -14.001  -0.185
  122   2HB   SER  15          1HB       SER  15  -5.839 -14.690  -0.440
  123    HG   SER  15           HG       SER  15  -6.244 -16.116   1.280
  124    H    SER  16           H        SER  16  -3.891 -12.306   2.113
  125    HA   SER  16           HA       SER  16  -2.840 -14.426   3.718
  126   1HB   SER  16          2HB       SER  16  -2.189 -15.320   1.549
  127   2HB   SER  16          1HB       SER  16  -1.465 -13.777   1.098
  128    HG   SER  16           HG       SER  16  -0.626 -15.344   3.309
  129    H    LEU  17           H        LEU  17  -1.829 -11.587   1.824
  130    HA   LEU  17           HA       LEU  17   0.155 -10.676   3.566
  131   1HB   LEU  17          2HB       LEU  17  -0.052  -9.833   1.309
  132   2HB   LEU  17          1HB       LEU  17  -1.634  -9.169   1.656
  133    HG   LEU  17           HG       LEU  17   0.453  -7.611   1.543
  134   1HD1  LEU  17          1HD1      LEU  17  -0.617  -6.058   3.029
  135   2HD1  LEU  17          2HD1      LEU  17  -1.501  -7.363   3.819
  136   3HD1  LEU  17          3HD1      LEU  17  -1.846  -6.958   2.139
  137   1HD2  LEU  17          1HD2      LEU  17   1.740  -7.351   3.459
  138   2HD2  LEU  17          2HD2      LEU  17   1.617  -9.102   3.296
  139   3HD2  LEU  17          3HD2      LEU  17   0.607  -8.252   4.465
  140    H    SER  18           H        SER  18  -3.275  -9.711   3.358
  141    HA   SER  18           HA       SER  18  -3.263  -7.890   5.476
  142   1HB   SER  18          2HB       SER  18  -5.689  -9.579   5.136
  143   2HB   SER  18          1HB       SER  18  -5.541  -7.824   5.223
  144    HG   SER  18           HG       SER  18  -4.514  -8.067   3.059
  145    H    ALA  19           H        ALA  19  -4.084 -11.356   5.492
  146    HA   ALA  19           HA       ALA  19  -4.592 -11.641   8.212
  147   1HB   ALA  19          1HB       ALA  19  -4.651 -13.321   6.117
  148   2HB   ALA  19          2HB       ALA  19  -4.690 -13.864   7.795
  149   3HB   ALA  19          3HB       ALA  19  -3.170 -13.873   6.900
  150    H    ILE  20           H        ILE  20  -1.552 -11.712   6.436
  151    HA   ILE  20           HA       ILE  20   0.145 -12.561   8.488
  152    HB   ILE  20           HB       ILE  20   0.610 -10.839   6.061
  153   1HG1  ILE  20          2HG1      ILE  20   1.812 -13.512   6.706
  154   2HG1  ILE  20          1HG1      ILE  20   0.202 -13.375   6.006
  155   1HG2  ILE  20          1HG2      ILE  20   2.546 -11.504   8.249
  156   2HG2  ILE  20          2HG2      ILE  20   2.260  -9.959   7.446
  157   3HG2  ILE  20          3HG2      ILE  20   3.095 -11.256   6.591
  158   1HD1  ILE  20          1HD1      ILE  20   2.372 -11.895   4.658
  159   2HD1  ILE  20          2HD1      ILE  20   0.988 -12.754   3.983
  160   3HD1  ILE  20          3HD1      ILE  20   2.399 -13.654   4.539
  161    H    LEU  21           H        LEU  21  -0.192  -9.177   7.361
  162    HA   LEU  21           HA       LEU  21   1.094  -7.956   9.465
  163   1HB   LEU  21          2HB       LEU  21  -1.348  -6.904   8.048
  164   2HB   LEU  21          1HB       LEU  21  -0.139  -5.952   8.888
  165    HG   LEU  21           HG       LEU  21   1.020  -7.630   6.813
  166   1HD1  LEU  21          1HD1      LEU  21  -1.134  -7.249   5.747
  167   2HD1  LEU  21          2HD1      LEU  21   0.154  -6.367   4.926
  168   3HD1  LEU  21          3HD1      LEU  21  -0.956  -5.511   5.996
  169   1HD2  LEU  21          1HD2      LEU  21   1.790  -5.471   8.182
  170   2HD2  LEU  21          2HD2      LEU  21   1.138  -4.678   6.748
  171   3HD2  LEU  21          3HD2      LEU  21   2.425  -5.873   6.587
  172    H    GLU  22           H        GLU  22  -2.133  -9.277   9.318
  173    HA   GLU  22           HA       GLU  22  -3.183  -8.084  11.646
  174   1HB   GLU  22          2HB       GLU  22  -4.282  -9.541   9.718
  175   2HB   GLU  22          1HB       GLU  22  -4.025 -10.828  10.888
  176   1HG   GLU  22          2HG       GLU  22  -5.155  -8.790  12.375
  177   2HG   GLU  22          1HG       GLU  22  -6.017  -8.731  10.839
  178    H    GLU  23           H        GLU  23  -1.101 -10.835  11.098
  179    HA   GLU  23           HA       GLU  23  -1.359 -11.841  13.788
  180   1HB   GLU  23          2HB       GLU  23  -0.892 -13.501  12.181
  181   2HB   GLU  23          1HB       GLU  23   0.362 -12.534  11.418
  182   1HG   GLU  23          2HG       GLU  23   1.946 -13.299  12.783
  183   2HG   GLU  23          1HG       GLU  23   0.917 -13.167  14.208
  184    H    GLU  24           H        GLU  24   0.823  -9.799  11.961
  185    HA   GLU  24           HA       GLU  24   2.833  -9.659  13.989
  186   1HB   GLU  24          2HB       GLU  24   2.374  -7.744  11.700
  187   2HB   GLU  24          1HB       GLU  24   3.863  -7.969  12.609
  188   1HG   GLU  24          2HG       GLU  24   2.566 -10.028  10.837
  189   2HG   GLU  24          1HG       GLU  24   3.952  -9.026  10.408
  190    H    GLY  25           H        GLY  25  -0.226  -8.261  13.669
  191   1HA   GLY  25          2HA       GLY  25  -1.185  -7.003  15.447
  192   2HA   GLY  25          1HA       GLY  25   0.411  -6.366  15.806
  193    H    TYR  26           H        TYR  26  -1.591  -6.510  12.866
  194    HA   TYR  26           HA       TYR  26  -1.337  -3.583  12.665
  195   1HB   TYR  26          2HB       TYR  26  -1.051  -5.661  10.501
  196   2HB   TYR  26          1HB       TYR  26  -1.353  -3.965  10.144
  197    HD1  TYR  26           1HD      TYR  26   0.327  -2.265  11.169
  198    HD2  TYR  26           2HD      TYR  26   1.139  -6.415  10.720
  199    HE1  TYR  26           1HE      TYR  26   2.737  -1.802  11.299
  200    HE2  TYR  26           2HE      TYR  26   3.551  -5.967  10.849
  201    HH   TYR  26           HH       TYR  26   4.857  -3.274  12.033
  202    H    HIS  27           H        HIS  27  -2.924  -2.947  10.675
  203    HA   HIS  27           HA       HIS  27  -5.502  -4.281  11.067
  204   1HB   HIS  27          2HB       HIS  27  -4.938  -1.964  12.393
  205   2HB   HIS  27          1HB       HIS  27  -5.648  -1.337  10.909
  206    HD1  HIS  27           1HD      HIS  27  -6.487  -3.164  14.035
  207    HD2  HIS  27           2HD      HIS  27  -8.381  -1.962  10.538
  208    HE1  HIS  27           1HE      HIS  27  -8.946  -3.453  14.470
  209    HE2  HIS  27           2HE      HIS  27 -10.067  -2.811  12.306
  210    HA   PRO  28           HA       PRO  28  -4.402  -3.467   6.595
  211   1HB   PRO  28          2HB       PRO  28  -5.729  -6.095   6.347
  212   2HB   PRO  28          1HB       PRO  28  -4.197  -5.537   5.668
  213   1HG   PRO  28          2HG       PRO  28  -4.269  -7.268   7.707
  214   2HG   PRO  28          1HG       PRO  28  -3.015  -6.022   7.589
  215   1HD   PRO  28          2HD       PRO  28  -5.456  -6.099   9.315
  216   2HD   PRO  28          1HD       PRO  28  -3.824  -5.508   9.691
  217    H    ASP  29           H        ASP  29  -5.744  -2.571   5.185
  218    HA   ASP  29           HA       ASP  29  -8.623  -2.947   5.610
  219   1HB   ASP  29          2HB       ASP  29  -7.444  -0.639   6.160
  220   2HB   ASP  29          1HB       ASP  29  -7.741  -0.383   4.445
  221    H    THR  30           H        THR  30  -6.359  -3.728   3.562
  222    HA   THR  30           HA       THR  30  -6.229  -3.508   1.171
  223    HB   THR  30           HB       THR  30  -6.861  -5.683   0.509
  224    HG1  THR  30           1HG      THR  30  -8.534  -6.745   1.312
  225   1HG2  THR  30          1HG2      THR  30  -5.605  -6.842   1.933
  226   2HG2  THR  30          2HG2      THR  30  -6.649  -6.470   3.304
  227   3HG2  THR  30          3HG2      THR  30  -5.417  -5.316   2.797
  228    H    ALA  31           H        ALA  31  -7.045  -2.518  -0.494
  229    HA   ALA  31           HA       ALA  31  -9.955  -2.124  -0.661
  230   1HB   ALA  31          1HB       ALA  31  -8.426  -0.114  -0.567
  231   2HB   ALA  31          2HB       ALA  31  -9.550  -0.159  -1.925
  232   3HB   ALA  31          3HB       ALA  31  -7.855  -0.580  -2.169
  233    H    LYS  32           H        LYS  32 -10.066  -1.427  -3.384
  234    HA   LYS  32           HA       LYS  32  -9.383  -3.992  -4.669
  235   1HB   LYS  32          2HB       LYS  32 -11.689  -2.293  -5.567
  236   2HB   LYS  32          1HB       LYS  32 -11.415  -4.009  -5.826
  237   1HG   LYS  32          2HG       LYS  32 -11.932  -4.496  -3.532
  238   2HG   LYS  32          1HG       LYS  32 -12.039  -2.776  -3.152
  239   1HD   LYS  32          2HD       LYS  32 -14.087  -2.550  -4.116
  240   2HD   LYS  32          1HD       LYS  32 -13.766  -3.783  -5.338
  241   1HE   LYS  32          2HE       LYS  32 -15.148  -5.059  -4.120
  242   2HE   LYS  32          1HE       LYS  32 -13.760  -5.261  -3.051
  243   1HZ   LYS  32          1HZ       LYS  32 -16.125  -4.382  -2.228
  244   2HZ   LYS  32          2HZ       LYS  32 -15.390  -2.901  -2.589
  245   3HZ   LYS  32          3HZ       LYS  32 -14.670  -3.955  -1.479
  246    H    THR  33           H        THR  33  -9.417  -0.520  -4.940
  247    HA   THR  33           HA       THR  33  -7.478  -0.600  -7.039
  248    HB   THR  33           HB       THR  33  -9.812   0.989  -7.915
  249    HG1  THR  33           1HG      THR  33 -10.809  -0.877  -8.805
  250   1HG2  THR  33          1HG2      THR  33  -7.564  -0.443  -9.126
  251   2HG2  THR  33          2HG2      THR  33  -8.387   1.032  -9.634
  252   3HG2  THR  33          3HG2      THR  33  -9.083  -0.543 -10.016
  253    H    LEU  34           H        LEU  34  -7.582   1.936  -7.996
  254    HA   LEU  34           HA       LEU  34  -6.608   3.446  -5.803
  255   1HB   LEU  34          2HB       LEU  34  -7.335   4.408  -8.571
  256   2HB   LEU  34          1HB       LEU  34  -6.316   5.249  -7.416
  257    HG   LEU  34           HG       LEU  34  -5.633   2.559  -8.599
  258   1HD1  LEU  34          1HD1      LEU  34  -3.915   3.971  -9.863
  259   2HD1  LEU  34          2HD1      LEU  34  -4.965   5.340  -9.496
  260   3HD1  LEU  34          3HD1      LEU  34  -5.580   3.986 -10.445
  261   1HD2  LEU  34          1HD2      LEU  34  -4.618   3.124  -6.408
  262   2HD2  LEU  34          2HD2      LEU  34  -3.916   4.564  -7.144
  263   3HD2  LEU  34          3HD2      LEU  34  -3.437   2.963  -7.707
  264    H    ARG  35           H        ARG  35  -9.567   3.659  -7.757
  265    HA   ARG  35           HA       ARG  35 -10.652   5.932  -6.538
  266   1HB   ARG  35          2HB       ARG  35 -11.525   3.905  -8.377
  267   2HB   ARG  35          1HB       ARG  35 -12.793   4.196  -7.195
  268   1HG   ARG  35          2HG       ARG  35 -11.591   6.638  -8.257
  269   2HG   ARG  35          1HG       ARG  35 -12.387   5.639  -9.474
  270   1HD   ARG  35          2HD       ARG  35 -13.836   6.073  -6.928
  271   2HD   ARG  35          1HD       ARG  35 -13.684   7.460  -8.006
  272    HE   ARG  35           HE       ARG  35 -15.298   5.115  -8.408
  273   1HH1  ARG  35          1HH1      ARG  35 -13.660   7.766  -9.980
  274   2HH1  ARG  35          2HH1      ARG  35 -14.674   7.723 -11.384
  275   1HH2  ARG  35          1HH2      ARG  35 -16.632   5.059 -10.253
  276   2HH2  ARG  35          2HH2      ARG  35 -16.361   6.187 -11.539
  277    H    GLU  36           H        GLU  36 -11.095   2.491  -5.784
  278    HA   GLU  36           HA       GLU  36 -12.785   2.920  -3.548
  279   1HB   GLU  36          2HB       GLU  36 -11.009   0.524  -4.026
  280   2HB   GLU  36          1HB       GLU  36 -12.489   0.585  -3.077
  281   1HG   GLU  36          2HG       GLU  36 -12.730   1.357  -5.911
  282   2HG   GLU  36          1HG       GLU  36 -12.366  -0.337  -5.588
  283    H    ALA  37           H        ALA  37  -9.325   2.844  -3.993
  284    HA   ALA  37           HA       ALA  37  -8.697   2.632  -1.201
  285   1HB   ALA  37          1HB       ALA  37  -6.394   3.148  -1.919
  286   2HB   ALA  37          2HB       ALA  37  -6.989   3.447  -3.552
  287   3HB   ALA  37          3HB       ALA  37  -7.114   1.834  -2.850
  288    H    GLU  38           H        GLU  38  -9.452   5.213  -3.393
  289    HA   GLU  38           HA       GLU  38  -8.301   7.300  -1.795
  290   1HB   GLU  38          2HB       GLU  38 -10.234   7.290  -4.102
  291   2HB   GLU  38          1HB       GLU  38  -9.787   8.768  -3.262
  292   1HG   GLU  38          2HG       GLU  38  -7.543   8.601  -3.945
  293   2HG   GLU  38          1HG       GLU  38  -7.749   6.933  -4.475
  294    H    LYS  39           H        LYS  39 -11.432   5.757  -2.126
  295    HA   LYS  39           HA       LYS  39 -12.853   7.576  -0.455
  296   1HB   LYS  39          2HB       LYS  39 -14.071   6.176  -2.010
  297   2HB   LYS  39          1HB       LYS  39 -13.426   4.719  -1.267
  298   1HG   LYS  39          2HG       LYS  39 -15.029   6.616   0.382
  299   2HG   LYS  39          1HG       LYS  39 -15.845   5.515  -0.729
  300   1HD   LYS  39          2HD       LYS  39 -14.126   3.817   0.488
  301   2HD   LYS  39          1HD       LYS  39 -14.432   4.961   1.795
  302   1HE   LYS  39          2HE       LYS  39 -15.988   3.023   1.773
  303   2HE   LYS  39          1HE       LYS  39 -16.796   4.585   1.653
  304   1HZ   LYS  39          1HZ       LYS  39 -16.109   3.307  -0.864
  305   2HZ   LYS  39          2HZ       LYS  39 -17.504   4.158  -0.426
  306   3HZ   LYS  39          3HZ       LYS  39 -17.316   2.544   0.040
  307    H    LYS  40           H        LYS  40 -11.063   4.598   0.043
  308    HA   LYS  40           HA       LYS  40 -11.775   4.272   2.786
  309   1HB   LYS  40          2HB       LYS  40  -9.395   3.173   1.278
  310   2HB   LYS  40          1HB       LYS  40  -9.985   2.603   2.833
  311   1HG   LYS  40          2HG       LYS  40 -12.068   2.585   0.824
  312   2HG   LYS  40          1HG       LYS  40 -10.670   1.625   0.338
  313   1HD   LYS  40          2HD       LYS  40 -10.836   0.687   2.772
  314   2HD   LYS  40          1HD       LYS  40 -12.496   1.274   2.676
  315   1HE   LYS  40          2HE       LYS  40 -12.887  -0.073   0.698
  316   2HE   LYS  40          1HE       LYS  40 -11.207  -0.608   0.704
  317   1HZ   LYS  40          1HZ       LYS  40 -12.950  -1.085   3.037
  318   2HZ   LYS  40          2HZ       LYS  40 -11.544  -1.906   2.577
  319   3HZ   LYS  40          3HZ       LYS  40 -12.979  -2.135   1.709
  320    H    ILE  41           H        ILE  41  -9.133   5.827   1.058
  321    HA   ILE  41           HA       ILE  41  -7.735   6.511   3.506
  322    HB   ILE  41           HB       ILE  41  -7.182   7.370   0.666
  323   1HG1  ILE  41          2HG1      ILE  41  -5.577   5.339   2.177
  324   2HG1  ILE  41          1HG1      ILE  41  -7.066   4.847   1.375
  325   1HG2  ILE  41          1HG2      ILE  41  -5.885   7.941   3.251
  326   2HG2  ILE  41          2HG2      ILE  41  -5.930   8.891   1.766
  327   3HG2  ILE  41          3HG2      ILE  41  -4.810   7.537   1.911
  328   1HD1  ILE  41          1HD1      ILE  41  -5.644   4.442  -0.322
  329   2HD1  ILE  41          2HD1      ILE  41  -4.463   5.626   0.238
  330   3HD1  ILE  41          3HD1      ILE  41  -5.897   6.158  -0.640
  331    H    LYS  42           H        LYS  42 -10.200   7.861   1.562
  332    HA   LYS  42           HA       LYS  42  -9.793  10.580   1.723
  333   1HB   LYS  42          2HB       LYS  42 -12.039   8.816   1.283
  334   2HB   LYS  42          1HB       LYS  42 -12.519  10.280   2.131
  335   1HG   LYS  42          2HG       LYS  42 -11.532  11.638   0.367
  336   2HG   LYS  42          1HG       LYS  42 -11.020  10.176  -0.478
  337   1HD   LYS  42          2HD       LYS  42 -13.364   9.495  -0.708
  338   2HD   LYS  42          1HD       LYS  42 -13.870  10.964   0.129
  339   1HE   LYS  42          2HE       LYS  42 -12.125  11.219  -2.270
  340   2HE   LYS  42          1HE       LYS  42 -13.825  10.819  -2.508
  341   1HZ   LYS  42          1HZ       LYS  42 -13.290  13.015  -0.686
  342   2HZ   LYS  42          2HZ       LYS  42 -14.483  12.860  -1.877
  343   3HZ   LYS  42          3HZ       LYS  42 -12.909  13.308  -2.308
  344    H    GLU  43           H        GLU  43 -10.519   8.385   4.282
  345    HA   GLU  43           HA       GLU  43 -10.668  10.656   6.130
  346   1HB   GLU  43          2HB       GLU  43 -12.314   8.148   6.452
  347   2HB   GLU  43          1HB       GLU  43 -12.396   9.612   7.424
  348   1HG   GLU  43          2HG       GLU  43 -13.547  10.781   5.821
  349   2HG   GLU  43          1HG       GLU  43 -12.940   9.780   4.502
  350    H    LEU  44           H        LEU  44 -10.273   7.123   5.943
  351    HA   LEU  44           HA       LEU  44  -9.018   6.771   8.409
  352   1HB   LEU  44          2HB       LEU  44  -9.718   5.168   6.237
  353   2HB   LEU  44          1HB       LEU  44  -7.982   4.974   6.386
  354    HG   LEU  44           HG       LEU  44  -9.061   3.237   7.638
  355   1HD1  LEU  44          1HD1      LEU  44  -7.730   3.374   9.453
  356   2HD1  LEU  44          2HD1      LEU  44  -8.319   4.976   9.898
  357   3HD1  LEU  44          3HD1      LEU  44  -7.112   4.802   8.624
  358   1HD2  LEU  44          1HD2      LEU  44 -10.853   3.485   8.997
  359   2HD2  LEU  44          2HD2      LEU  44 -11.122   4.903   7.984
  360   3HD2  LEU  44          3HD2      LEU  44 -10.347   5.077   9.559
  361    H    PHE  45           H        PHE  45  -7.161   7.536   9.138
  362    HA   PHE  45           HA       PHE  45  -5.222   8.732   7.406
  363   1HB   PHE  45          2HB       PHE  45  -5.835   9.339   9.869
  364   2HB   PHE  45          1HB       PHE  45  -4.687   8.072  10.287
  365    HD1  PHE  45           1HD      PHE  45  -5.090  11.493   9.499
  366    HD2  PHE  45           2HD      PHE  45  -2.334   8.261   9.227
  367    HE1  PHE  45           1HE      PHE  45  -3.240  13.096   9.251
  368    HE2  PHE  45           2HE      PHE  45  -0.479   9.858   8.981
  369    HZ   PHE  45           HZ       PHE  45  -0.930  12.279   8.992
  370    H    PHE  46           H        PHE  46  -4.944   6.710   6.130
  371    HA   PHE  46           HA       PHE  46  -3.668   4.440   7.213
  372   1HB   PHE  46          2HB       PHE  46  -4.025   5.506   4.432
  373   2HB   PHE  46          1HB       PHE  46  -3.011   4.096   4.724
  374    HD1  PHE  46           1HD      PHE  46  -6.270   5.203   4.029
  375    HD2  PHE  46           2HD      PHE  46  -4.120   2.201   6.145
  376    HE1  PHE  46           1HE      PHE  46  -8.268   3.766   4.012
  377    HE2  PHE  46           2HE      PHE  46  -6.112   0.760   6.131
  378    HZ   PHE  46           HZ       PHE  46  -8.191   1.541   5.064
  379    HA   PRO  47           HA       PRO  47   0.374   6.431   7.596
  380   1HB   PRO  47          2HB       PRO  47   1.524   4.482   9.063
  381   2HB   PRO  47          1HB       PRO  47   0.384   5.635   9.767
  382   1HG   PRO  47          2HG       PRO  47  -0.087   2.824   8.852
  383   2HG   PRO  47          1HG       PRO  47  -0.657   3.631  10.325
  384   1HD   PRO  47          2HD       PRO  47  -2.212   3.293   8.116
  385   2HD   PRO  47          1HD       PRO  47  -2.401   4.655   9.236
  386    H    VAL  48           H        VAL  48  -0.447   3.322   6.300
  387    HA   VAL  48           HA       VAL  48   1.884   3.424   4.550
  388    HB   VAL  48           HB       VAL  48   1.112   0.831   5.858
  389   1HG1  VAL  48          1HG1      VAL  48   2.551   1.124   3.691
  390   2HG1  VAL  48          2HG1      VAL  48   3.027  -0.036   4.931
  391   3HG1  VAL  48          3HG1      VAL  48   3.824   1.535   4.840
  392   1HG2  VAL  48          1HG2      VAL  48   1.700   2.124   7.711
  393   2HG2  VAL  48          2HG2      VAL  48   2.986   2.953   6.834
  394   3HG2  VAL  48          3HG2      VAL  48   3.177   1.259   7.286
  395    H    ILE  49           H        ILE  49   1.358   2.967   2.518
  396    HA   ILE  49           HA       ILE  49  -1.193   1.608   1.972
  397    HB   ILE  49           HB       ILE  49   0.134   3.541   0.083
  398   1HG1  ILE  49          2HG1      ILE  49  -0.355   4.674   2.253
  399   2HG1  ILE  49          1HG1      ILE  49  -1.288   5.312   0.903
  400   1HG2  ILE  49          1HG2      ILE  49  -2.473   2.122   0.237
  401   2HG2  ILE  49          2HG2      ILE  49  -1.422   2.413  -1.149
  402   3HG2  ILE  49          3HG2      ILE  49  -2.427   3.716  -0.515
  403   1HD1  ILE  49          1HD1      ILE  49  -2.330   3.310   2.890
  404   2HD1  ILE  49          2HD1      ILE  49  -3.244   4.141   1.631
  405   3HD1  ILE  49          3HD1      ILE  49  -2.585   5.052   2.989
  406    H    VAL  50           H        VAL  50  -1.262   0.321   0.010
  407    HA   VAL  50           HA       VAL  50   1.286  -0.393  -1.190
  408    HB   VAL  50           HB       VAL  50  -0.413  -2.471   0.196
  409   1HG1  VAL  50          1HG1      VAL  50   2.073  -2.687  -1.492
  410   2HG1  VAL  50          2HG1      VAL  50   0.504  -3.446  -1.767
  411   3HG1  VAL  50          3HG1      VAL  50   1.514  -3.973  -0.421
  412   1HG2  VAL  50          1HG2      VAL  50   1.553  -2.775   1.641
  413   2HG2  VAL  50          2HG2      VAL  50   0.866  -1.157   1.781
  414   3HG2  VAL  50          3HG2      VAL  50   2.335  -1.411   0.839
  415    H    LEU  51           H        LEU  51   0.710   0.069  -3.207
  416    HA   LEU  51           HA       LEU  51  -1.883  -0.699  -4.249
  417   1HB   LEU  51          2HB       LEU  51  -1.052   1.446  -4.915
  418   2HB   LEU  51          1HB       LEU  51   0.464   0.753  -5.460
  419    HG   LEU  51           HG       LEU  51  -0.705  -0.388  -7.292
  420   1HD1  LEU  51          1HD1      LEU  51  -2.940  -0.478  -7.541
  421   2HD1  LEU  51          2HD1      LEU  51  -3.185   1.153  -6.918
  422   3HD1  LEU  51          3HD1      LEU  51  -2.942  -0.189  -5.802
  423   1HD2  LEU  51          1HD2      LEU  51  -1.409   2.540  -7.230
  424   2HD2  LEU  51          2HD2      LEU  51  -1.108   1.536  -8.649
  425   3HD2  LEU  51          3HD2      LEU  51   0.212   1.918  -7.543
  426    H    ASP  52           H        ASP  52  -1.703  -2.979  -4.123
  427    HA   ASP  52           HA       ASP  52   0.364  -4.449  -5.376
  428   1HB   ASP  52          2HB       ASP  52  -1.840  -5.042  -3.769
  429   2HB   ASP  52          1HB       ASP  52  -2.175  -5.866  -5.288
  430    H    VAL  53           H        VAL  53   0.481  -3.248  -7.394
  431    HA   VAL  53           HA       VAL  53  -1.560  -3.118  -9.294
  432    HB   VAL  53           HB       VAL  53   0.383  -1.756  -9.593
  433   1HG1  VAL  53          1HG1      VAL  53   2.556  -2.449  -9.643
  434   2HG1  VAL  53          2HG1      VAL  53   2.153  -4.038 -10.291
  435   3HG1  VAL  53          3HG1      VAL  53   1.872  -3.684  -8.588
  436   1HG2  VAL  53          1HG2      VAL  53   0.432  -1.851 -11.844
  437   2HG2  VAL  53          2HG2      VAL  53  -0.800  -3.092 -11.619
  438   3HG2  VAL  53          3HG2      VAL  53   0.884  -3.556 -11.869
  439    H    TRP  54           H        TRP  54  -2.591  -5.199  -9.195
  440    HA   TRP  54           HA       TRP  54  -1.197  -7.560 -10.028
  441   1HB   TRP  54          2HB       TRP  54  -3.092  -7.848  -8.585
  442   2HB   TRP  54          1HB       TRP  54  -4.134  -6.934  -9.667
  443    HD1  TRP  54           HD       TRP  54  -5.753  -8.478 -10.891
  444    HE1  TRP  54           1HE      TRP  54  -5.675 -10.869 -11.843
  445    HE3  TRP  54           3HE      TRP  54  -0.965  -9.708  -9.599
  446    HZ2  TRP  54           2HZ      TRP  54  -3.826 -12.996 -12.022
  447    HZ3  TRP  54           3HZ      TRP  54  -0.116 -11.941 -10.197
  448    HH2  TRP  54           HH       TRP  54  -1.519 -13.549 -11.383
  449    H    MET  55           H        MET  55  -4.163  -6.388 -11.562
  450    HA   MET  55           HA       MET  55  -2.817  -6.041 -14.108
  451   1HB   MET  55          2HB       MET  55  -3.417  -8.503 -13.853
  452   2HB   MET  55          1HB       MET  55  -5.101  -8.001 -13.928
  453   1HG   MET  55          2HG       MET  55  -4.117  -6.768 -16.120
  454   2HG   MET  55          1HG       MET  55  -3.085  -8.196 -16.053
  455   1HE   MET  55          1HE       MET  55  -5.547  -6.673 -17.595
  456   2HE   MET  55          2HE       MET  55  -7.106  -7.237 -16.993
  457   3HE   MET  55          3HE       MET  55  -6.414  -7.949 -18.451
  458    HA   PRO  56           HA       PRO  56  -6.805  -3.599 -13.474
  459   1HB   PRO  56          2HB       PRO  56  -6.028  -1.381 -12.218
  460   2HB   PRO  56          1HB       PRO  56  -6.335  -2.870 -11.315
  461   1HG   PRO  56          2HG       PRO  56  -3.733  -1.665 -12.153
  462   2HG   PRO  56          1HG       PRO  56  -4.162  -2.452 -10.625
  463   1HD   PRO  56          2HD       PRO  56  -2.809  -3.667 -12.724
  464   2HD   PRO  56          1HD       PRO  56  -3.678  -4.518 -11.434
  465    H    ASP  57           H        ASP  57  -6.862  -0.929 -13.915
  466    HA   ASP  57           HA       ASP  57  -4.973  -0.185 -15.972
  467   1HB   ASP  57          2HB       ASP  57  -7.894  -0.555 -16.663
  468   2HB   ASP  57          1HB       ASP  57  -6.661   0.116 -17.725
  469    H    GLY  58           H        GLY  58  -5.316   1.039 -13.588
  470   1HA   GLY  58          2HA       GLY  58  -6.887   3.452 -14.251
  471   2HA   GLY  58          1HA       GLY  58  -6.647   2.867 -12.612
  472    H    ASP  59           H        ASP  59  -3.754   2.240 -13.586
  473    HA   ASP  59           HA       ASP  59  -1.713   3.232 -13.444
  474   1HB   ASP  59          2HB       ASP  59  -3.199   5.681 -14.422
  475   2HB   ASP  59          1HB       ASP  59  -1.449   5.489 -14.396
  476    H    GLY  60           H        GLY  60  -1.121   3.281 -11.358
  477   1HA   GLY  60          2HA       GLY  60  -2.344   5.250  -9.569
  478   2HA   GLY  60          1HA       GLY  60  -1.355   3.883  -9.080
  479    H    VAL  61           H        VAL  61  -0.154   5.767 -11.696
  480    HA   VAL  61           HA       VAL  61   2.244   6.395 -10.422
  481    HB   VAL  61           HB       VAL  61   1.072   7.948 -12.726
  482   1HG1  VAL  61          1HG1      VAL  61   3.806   7.493 -11.626
  483   2HG1  VAL  61          2HG1      VAL  61   3.035   8.994 -12.137
  484   3HG1  VAL  61          3HG1      VAL  61   3.594   7.834 -13.344
  485   1HG2  VAL  61          1HG2      VAL  61   2.278   5.202 -12.660
  486   2HG2  VAL  61          2HG2      VAL  61   2.373   6.209 -14.104
  487   3HG2  VAL  61          3HG2      VAL  61   0.800   5.746 -13.455
  488    H    ASN  62           H        ASN  62  -0.417   8.626 -11.287
  489    HA   ASN  62           HA       ASN  62   0.640  10.746  -9.725
  490   1HB   ASN  62          2HB       ASN  62  -1.494  11.825 -10.367
  491   2HB   ASN  62          1HB       ASN  62  -0.603  11.196 -11.736
  492   1HD2  ASN  62          1HD2      ASN  62  -3.389  10.800  -9.688
  493   2HD2  ASN  62          2HD2      ASN  62  -4.247   9.719 -10.728
  494    H    PHE  63           H        PHE  63  -0.964   7.957  -8.840
  495    HA   PHE  63           HA       PHE  63  -2.802   8.955  -6.926
  496   1HB   PHE  63          2HB       PHE  63  -2.955   6.682  -7.862
  497   2HB   PHE  63          1HB       PHE  63  -1.456   6.248  -7.045
  498    HD1  PHE  63           1HD      PHE  63  -4.510   8.082  -5.943
  499    HD2  PHE  63           2HD      PHE  63  -1.902   4.773  -5.342
  500    HE1  PHE  63           1HE      PHE  63  -5.788   7.444  -3.940
  501    HE2  PHE  63           2HE      PHE  63  -3.176   4.128  -3.338
  502    HZ   PHE  63           HZ       PHE  63  -5.124   5.465  -2.635
  503    H    ILE  64           H        ILE  64   0.580   7.929  -6.728
  504    HA   ILE  64           HA       ILE  64   0.988   7.791  -4.029
  505    HB   ILE  64           HB       ILE  64   2.847   9.069  -6.039
  506   1HG1  ILE  64          2HG1      ILE  64   3.769   6.527  -5.381
  507   2HG1  ILE  64          1HG1      ILE  64   2.026   6.321  -5.525
  508   1HG2  ILE  64          1HG2      ILE  64   4.634   8.521  -4.461
  509   2HG2  ILE  64          2HG2      ILE  64   3.437   7.928  -3.309
  510   3HG2  ILE  64          3HG2      ILE  64   3.469   9.636  -3.748
  511   1HD1  ILE  64          1HD1      ILE  64   3.494   7.786  -7.657
  512   2HD1  ILE  64          2HD1      ILE  64   2.016   6.832  -7.754
  513   3HD1  ILE  64          3HD1      ILE  64   3.574   6.026  -7.594
  514    H    ASP  65           H        ASP  65   0.533  10.683  -5.963
  515    HA   ASP  65           HA       ASP  65   1.331  12.529  -3.950
  516   1HB   ASP  65          2HB       ASP  65   0.346  12.641  -6.656
  517   2HB   ASP  65          1HB       ASP  65  -0.537  13.792  -5.658
  518    H    PHE  66           H        PHE  66  -1.707  10.981  -4.800
  519    HA   PHE  66           HA       PHE  66  -3.407  12.584  -3.231
  520   1HB   PHE  66          2HB       PHE  66  -4.353  11.118  -4.895
  521   2HB   PHE  66          1HB       PHE  66  -3.631   9.704  -4.137
  522    HD1  PHE  66           1HD      PHE  66  -4.682   8.609  -2.319
  523    HD2  PHE  66           2HD      PHE  66  -6.246  12.276  -3.808
  524    HE1  PHE  66           1HE      PHE  66  -6.735   8.259  -1.012
  525    HE2  PHE  66           2HE      PHE  66  -8.303  11.934  -2.499
  526    HZ   PHE  66           HZ       PHE  66  -8.549   9.923  -1.099
  527    H    ILE  67           H        ILE  67  -1.497   9.700  -2.523
  528    HA   ILE  67           HA       ILE  67  -2.467   9.249   0.086
  529    HB   ILE  67           HB       ILE  67   0.192   8.564  -1.180
  530   1HG1  ILE  67          2HG1      ILE  67  -0.895   6.217  -0.926
  531   2HG1  ILE  67          1HG1      ILE  67  -2.401   7.108  -0.736
  532   1HG2  ILE  67          1HG2      ILE  67   0.659   8.634   1.135
  533   2HG2  ILE  67          2HG2      ILE  67   0.383   6.936   0.749
  534   3HG2  ILE  67          3HG2      ILE  67  -0.879   7.875   1.544
  535   1HD1  ILE  67          1HD1      ILE  67  -0.753   7.851  -3.058
  536   2HD1  ILE  67          2HD1      ILE  67  -2.501   7.660  -2.913
  537   3HD1  ILE  67          3HD1      ILE  67  -1.470   6.240  -3.089
  538    H    LYS  68           H        LYS  68   0.322  11.093  -1.129
  539    HA   LYS  68           HA       LYS  68   1.058  12.034   1.473
  540   1HB   LYS  68          2HB       LYS  68   2.648  13.469   0.277
  541   2HB   LYS  68          1HB       LYS  68   2.743  11.799  -0.266
  542   1HG   LYS  68          2HG       LYS  68   2.825  12.950  -2.230
  543   2HG   LYS  68          1HG       LYS  68   1.111  12.568  -2.096
  544   1HD   LYS  68          2HD       LYS  68   0.527  14.728  -1.944
  545   2HD   LYS  68          1HD       LYS  68   1.831  15.084  -0.809
  546   1HE   LYS  68          2HE       LYS  68   3.256  15.740  -2.443
  547   2HE   LYS  68          1HE       LYS  68   2.627  14.575  -3.607
  548   1HZ   LYS  68          1HZ       LYS  68   0.915  15.981  -4.214
  549   2HZ   LYS  68          2HZ       LYS  68   2.193  17.067  -3.980
  550   3HZ   LYS  68          3HZ       LYS  68   1.000  16.895  -2.793
  551    H    GLU  69           H        GLU  69  -1.227  12.954  -0.890
  552    HA   GLU  69           HA       GLU  69  -1.401  15.730  -0.324
  553   1HB   GLU  69          2HB       GLU  69  -2.282  14.692  -2.395
  554   2HB   GLU  69          1HB       GLU  69  -3.512  13.880  -1.438
  555   1HG   GLU  69          2HG       GLU  69  -4.203  16.228  -0.686
  556   2HG   GLU  69          1HG       GLU  69  -3.231  16.796  -2.044
  557    H    ASN  70           H        ASN  70  -3.109  12.879   0.856
  558    HA   ASN  70           HA       ASN  70  -4.243  14.529   3.017
  559   1HB   ASN  70          2HB       ASN  70  -5.903  12.366   2.947
  560   2HB   ASN  70          1HB       ASN  70  -6.226  13.891   2.130
  561   1HD2  ASN  70          1HD2      ASN  70  -5.099  14.010  -0.097
  562   2HD2  ASN  70          2HD2      ASN  70  -5.287  12.616  -1.099
  563    H    SER  71           H        SER  71  -1.729  12.796   2.704
  564    HA   SER  71           HA       SER  71  -1.760  11.756   5.356
  565   1HB   SER  71          2HB       SER  71  -2.457   9.963   3.181
  566   2HB   SER  71          1HB       SER  71  -1.002   9.419   4.015
  567    HG   SER  71           HG       SER  71  -2.163   9.499   5.965
  568    HA   PRO  72           HA       PRO  72   2.341  12.924   3.442
  569   1HB   PRO  72          2HB       PRO  72   2.562  14.759   5.705
  570   2HB   PRO  72          1HB       PRO  72   2.683  15.103   3.978
  571   1HG   PRO  72          2HG       PRO  72   0.587  15.918   5.481
  572   2HG   PRO  72          1HG       PRO  72   0.433  15.505   3.765
  573   1HD   PRO  72          2HD       PRO  72  -0.280  13.883   6.178
  574   2HD   PRO  72          1HD       PRO  72  -1.155  14.064   4.642
  575    H    ASP  73           H        ASP  73   1.202  12.020   6.539
  576    HA   ASP  73           HA       ASP  73   3.876  11.225   7.427
  577   1HB   ASP  73          2HB       ASP  73   2.361  12.547   8.949
  578   2HB   ASP  73          1HB       ASP  73   1.320  11.129   9.024
  579    H    SER  74           H        SER  74   2.511   9.825   5.308
  580    HA   SER  74           HA       SER  74   2.009   7.225   6.596
  581   1HB   SER  74          2HB       SER  74   0.074   8.093   5.355
  582   2HB   SER  74          1HB       SER  74   1.062   8.232   3.901
  583    HG   SER  74           HG       SER  74   0.115   6.303   3.665
  584    H    VAL  75           H        VAL  75   2.203   5.769   4.114
  585    HA   VAL  75           HA       VAL  75   4.866   6.217   3.084
  586    HB   VAL  75           HB       VAL  75   4.326   3.630   4.548
  587   1HG1  VAL  75          1HG1      VAL  75   6.167   4.366   2.504
  588   2HG1  VAL  75          2HG1      VAL  75   6.039   2.835   3.369
  589   3HG1  VAL  75          3HG1      VAL  75   7.075   4.117   3.995
  590   1HG2  VAL  75          1HG2      VAL  75   4.604   5.361   6.183
  591   2HG2  VAL  75          2HG2      VAL  75   6.002   6.014   5.328
  592   3HG2  VAL  75          3HG2      VAL  75   6.101   4.433   6.104
  593    H    VAL  76           H        VAL  76   5.139   5.384   1.100
  594    HA   VAL  76           HA       VAL  76   2.973   3.656   0.077
  595    HB   VAL  76           HB       VAL  76   4.582   5.453  -1.707
  596   1HG1  VAL  76          1HG1      VAL  76   2.795   3.496  -2.260
  597   2HG1  VAL  76          2HG1      VAL  76   3.120   4.873  -3.312
  598   3HG1  VAL  76          3HG1      VAL  76   1.741   4.910  -2.214
  599   1HG2  VAL  76          1HG2      VAL  76   2.464   6.226   0.200
  600   2HG2  VAL  76          2HG2      VAL  76   2.310   6.859  -1.438
  601   3HG2  VAL  76          3HG2      VAL  76   3.767   7.187  -0.501
  602    H    ILE  77           H        ILE  77   3.842   1.658   0.156
  603    HA   ILE  77           HA       ILE  77   6.578   1.171  -0.632
  604    HB   ILE  77           HB       ILE  77   4.402  -0.836  -0.023
  605   1HG1  ILE  77          2HG1      ILE  77   4.826   0.702   1.866
  606   2HG1  ILE  77          1HG1      ILE  77   5.346  -0.941   2.225
  607   1HG2  ILE  77          1HG2      ILE  77   5.950  -2.198  -0.939
  608   2HG2  ILE  77          2HG2      ILE  77   6.717  -2.043   0.642
  609   3HG2  ILE  77          3HG2      ILE  77   7.261  -1.042  -0.705
  610   1HD1  ILE  77          1HD1      ILE  77   7.628   0.131   1.228
  611   2HD1  ILE  77          2HD1      ILE  77   7.212   0.057   2.940
  612   3HD1  ILE  77          3HD1      ILE  77   6.898   1.527   2.021
  613    H    VAL  78           H        VAL  78   3.390   0.106  -1.830
  614    HA   VAL  78           HA       VAL  78   2.675  -0.557  -3.885
  615    HB   VAL  78           HB       VAL  78   4.957   1.137  -4.920
  616   1HG1  VAL  78          1HG1      VAL  78   2.352   0.328  -6.211
  617   2HG1  VAL  78          2HG1      VAL  78   3.940  -0.333  -6.600
  618   3HG1  VAL  78          3HG1      VAL  78   3.588   1.365  -6.922
  619   1HG2  VAL  78          1HG2      VAL  78   2.375   1.831  -3.680
  620   2HG2  VAL  78          2HG2      VAL  78   2.770   2.694  -5.168
  621   3HG2  VAL  78          3HG2      VAL  78   3.870   2.761  -3.792
  622    H    ILE  79           H        ILE  79   2.942  -2.654  -4.288
  623    HA   ILE  79           HA       ILE  79   5.624  -3.606  -5.054
  624    HB   ILE  79           HB       ILE  79   3.526  -5.536  -4.175
  625   1HG1  ILE  79          2HG1      ILE  79   5.210  -3.964  -2.218
  626   2HG1  ILE  79          1HG1      ILE  79   3.498  -3.671  -2.502
  627   1HG2  ILE  79          1HG2      ILE  79   5.290  -6.875  -4.400
  628   2HG2  ILE  79          2HG2      ILE  79   6.009  -6.074  -3.005
  629   3HG2  ILE  79          3HG2      ILE  79   6.369  -5.500  -4.634
  630   1HD1  ILE  79          1HD1      ILE  79   3.489  -4.990  -0.612
  631   2HD1  ILE  79          2HD1      ILE  79   4.822  -5.995  -1.180
  632   3HD1  ILE  79          3HD1      ILE  79   3.220  -6.167  -1.897
  633    H    THR  80           H        THR  80   4.699  -6.136  -6.068
  634    HA   THR  80           HA       THR  80   4.091  -7.087  -8.031
  635    HB   THR  80           HB       THR  80   1.898  -5.631  -8.950
  636    HG1  THR  80           1HG      THR  80   1.831  -5.709  -6.120
  637   1HG2  THR  80          1HG2      THR  80   0.540  -7.382  -8.074
  638   2HG2  THR  80          2HG2      THR  80   1.794  -7.848  -6.924
  639   3HG2  THR  80          3HG2      THR  80   2.050  -8.086  -8.653
  640    H    GLY  81           H        GLY  81   3.778  -6.707 -10.402
  641   1HA   GLY  81          2HA       GLY  81   3.891  -4.949 -12.165
  642   2HA   GLY  81          1HA       GLY  81   5.173  -4.227 -11.204
  643    H    HIS  82           H        HIS  82   4.625  -7.636 -12.015
  644    HA   HIS  82           HA       HIS  82   7.313  -8.181 -12.552
  645   1HB   HIS  82          2HB       HIS  82   6.532 -10.283 -13.516
  646   2HB   HIS  82          1HB       HIS  82   5.642  -9.920 -12.041
  647    HD1  HIS  82           1HD      HIS  82   5.185 -10.704 -15.576
  648    HD2  HIS  82           2HD      HIS  82   2.951  -8.923 -12.558
  649    HE1  HIS  82           1HE      HIS  82   2.810 -10.718 -16.400
  650    HE2  HIS  82           2HE      HIS  82   1.487  -9.566 -14.592
  651    H    GLY  83           H        GLY  83   8.546  -8.200 -14.382
  652   1HA   GLY  83          2HA       GLY  83   8.937  -8.100 -16.711
  653   2HA   GLY  83          1HA       GLY  83   7.296  -7.516 -16.938
  654    H    SER  84           H        SER  84  10.585  -6.662 -16.445
  655    HA   SER  84           HA       SER  84  11.704  -4.688 -16.587
  656   1HB   SER  84          2HB       SER  84   9.152  -4.119 -17.998
  657   2HB   SER  84          1HB       SER  84  10.124  -2.727 -17.525
  658    HG   SER  84           HG       SER  84  10.949  -4.926 -19.118
  659    H    VAL  85           H        VAL  85  12.130  -2.864 -15.347
  660    HA   VAL  85           HA       VAL  85  10.274  -2.463 -13.102
  661    HB   VAL  85           HB       VAL  85  12.553  -3.241 -12.521
  662   1HG1  VAL  85          1HG1      VAL  85  13.512  -0.546 -13.456
  663   2HG1  VAL  85          2HG1      VAL  85  13.680  -2.024 -14.403
  664   3HG1  VAL  85          3HG1      VAL  85  14.480  -1.884 -12.838
  665   1HG2  VAL  85          1HG2      VAL  85  12.373  -0.456 -11.480
  666   2HG2  VAL  85          2HG2      VAL  85  12.695  -1.962 -10.622
  667   3HG2  VAL  85          3HG2      VAL  85  11.056  -1.581 -11.148
  668    H    ASP  86           H        ASP  86   9.775  -1.182 -15.578
  669    HA   ASP  86           HA       ASP  86  10.688   1.559 -15.328
  670   1HB   ASP  86          2HB       ASP  86   9.391   1.950 -17.378
  671   2HB   ASP  86          1HB       ASP  86  10.458   0.562 -17.559
  672    H    THR  87           H        THR  87   7.978  -0.340 -14.352
  673    HA   THR  87           HA       THR  87   6.188   1.904 -14.041
  674    HB   THR  87           HB       THR  87   5.578  -0.609 -14.425
  675    HG1  THR  87           1HG      THR  87   4.212   0.956 -12.497
  676   1HG2  THR  87          1HG2      THR  87   6.739  -1.542 -12.491
  677   2HG2  THR  87          2HG2      THR  87   5.001  -1.834 -12.412
  678   3HG2  THR  87          3HG2      THR  87   5.729  -0.572 -11.419
  679    H    ALA  88           H        ALA  88   8.369   0.002 -12.075
  680    HA   ALA  88           HA       ALA  88   7.677   0.881  -9.526
  681   1HB   ALA  88          1HB       ALA  88   9.983   0.316  -8.899
  682   2HB   ALA  88          2HB       ALA  88  10.415   0.218 -10.605
  683   3HB   ALA  88          3HB       ALA  88   9.265  -0.930  -9.921
  684    H    VAL  89           H        VAL  89  10.225   2.124 -11.651
  685    HA   VAL  89           HA       VAL  89  10.924   4.350 -10.134
  686    HB   VAL  89           HB       VAL  89  11.924   5.259 -12.169
  687   1HG1  VAL  89          1HG1      VAL  89  12.248   2.406 -11.447
  688   2HG1  VAL  89          2HG1      VAL  89  13.410   3.731 -11.386
  689   3HG1  VAL  89          3HG1      VAL  89  13.033   2.958 -12.927
  690   1HG2  VAL  89          1HG2      VAL  89  11.642   4.026 -14.321
  691   2HG2  VAL  89          2HG2      VAL  89  10.192   4.868 -13.776
  692   3HG2  VAL  89          3HG2      VAL  89  10.326   3.122 -13.571
  693    H    LYS  90           H        LYS  90   8.208   3.806 -12.230
  694    HA   LYS  90           HA       LYS  90   7.518   6.624 -12.376
  695   1HB   LYS  90          2HB       LYS  90   7.131   5.073 -14.295
  696   2HB   LYS  90          1HB       LYS  90   5.938   4.229 -13.320
  697   1HG   LYS  90          2HG       LYS  90   4.471   6.058 -13.325
  698   2HG   LYS  90          1HG       LYS  90   5.723   7.165 -13.891
  699   1HD   LYS  90          2HD       LYS  90   5.497   5.074 -15.792
  700   2HD   LYS  90          1HD       LYS  90   3.866   5.630 -15.413
  701   1HE   LYS  90          2HE       LYS  90   5.273   7.979 -15.653
  702   2HE   LYS  90          1HE       LYS  90   6.009   6.957 -16.887
  703   1HZ   LYS  90          1HZ       LYS  90   4.283   7.444 -18.167
  704   2HZ   LYS  90          2HZ       LYS  90   3.486   8.247 -16.909
  705   3HZ   LYS  90          3HZ       LYS  90   3.282   6.580 -17.112
  706    H    ALA  91           H        ALA  91   7.667   5.663  -9.756
  707    HA   ALA  91           HA       ALA  91   5.146   6.463  -8.745
  708   1HB   ALA  91          1HB       ALA  91   5.022   4.101  -7.466
  709   2HB   ALA  91          2HB       ALA  91   5.679   3.571  -9.014
  710   3HB   ALA  91          3HB       ALA  91   4.148   4.444  -8.959
  711    H    ILE  92           H        ILE  92   8.178   4.759  -8.134
  712    HA   ILE  92           HA       ILE  92   8.235   5.385  -5.348
  713    HB   ILE  92           HB       ILE  92  10.341   4.343  -5.253
  714   1HG1  ILE  92          2HG1      ILE  92  10.530   4.708  -8.253
  715   2HG1  ILE  92          1HG1      ILE  92  11.487   5.549  -7.038
  716   1HG2  ILE  92          1HG2      ILE  92   9.904   2.394  -7.089
  717   2HG2  ILE  92          2HG2      ILE  92   8.309   3.136  -6.997
  718   3HG2  ILE  92          3HG2      ILE  92   9.073   2.510  -5.539
  719   1HD1  ILE  92          1HD1      ILE  92  12.521   3.439  -6.388
  720   2HD1  ILE  92          2HD1      ILE  92  12.759   3.769  -8.104
  721   3HD1  ILE  92          3HD1      ILE  92  11.552   2.590  -7.592
  722    H    LYS  93           H        LYS  93   9.370   6.937  -8.251
  723    HA   LYS  93           HA       LYS  93  11.109   8.769  -6.866
  724   1HB   LYS  93          2HB       LYS  93  11.109   7.917  -9.394
  725   2HB   LYS  93          1HB       LYS  93  10.129   9.360  -9.614
  726   1HG   LYS  93          2HG       LYS  93  11.994  10.607  -8.402
  727   2HG   LYS  93          1HG       LYS  93  12.963   9.155  -8.662
  728   1HD   LYS  93          2HD       LYS  93  13.226   9.577 -10.854
  729   2HD   LYS  93          1HD       LYS  93  11.557  10.118 -11.049
  730   1HE   LYS  93          2HE       LYS  93  12.701  12.073 -11.435
  731   2HE   LYS  93          1HE       LYS  93  12.387  12.200  -9.704
  732   1HZ   LYS  93          1HZ       LYS  93  14.908  11.724 -11.106
  733   2HZ   LYS  93          2HZ       LYS  93  14.700  10.978  -9.601
  734   3HZ   LYS  93          3HZ       LYS  93  14.595  12.660  -9.732
  735    H    LYS  94           H        LYS  94   7.763   8.599  -7.581
  736    HA   LYS  94           HA       LYS  94   7.239  11.409  -7.591
  737   1HB   LYS  94          2HB       LYS  94   5.478   8.989  -7.309
  738   2HB   LYS  94          1HB       LYS  94   4.847  10.629  -7.235
  739   1HG   LYS  94          2HG       LYS  94   6.503  10.362  -9.548
  740   2HG   LYS  94          1HG       LYS  94   5.323   9.050  -9.514
  741   1HD   LYS  94          2HD       LYS  94   4.462  11.006 -10.712
  742   2HD   LYS  94          1HD       LYS  94   3.514  10.666  -9.263
  743   1HE   LYS  94          2HE       LYS  94   4.106  12.597  -8.270
  744   2HE   LYS  94          1HE       LYS  94   5.763  12.510  -8.863
  745   1HZ   LYS  94          1HZ       LYS  94   5.269  13.720 -10.676
  746   2HZ   LYS  94          2HZ       LYS  94   3.977  14.276  -9.736
  747   3HZ   LYS  94          3HZ       LYS  94   3.732  13.042 -10.868
  748    H    GLY  95           H        GLY  95   7.673   9.022  -5.135
  749   1HA   GLY  95          2HA       GLY  95   8.158  10.435  -2.981
  750   2HA   GLY  95          1HA       GLY  95   6.435  10.742  -3.109
  751    H    ALA  96           H        ALA  96   7.631   7.609  -4.052
  752    HA   ALA  96           HA       ALA  96   6.173   6.441  -1.824
  753   1HB   ALA  96          1HB       ALA  96   5.789   4.681  -3.156
  754   2HB   ALA  96          2HB       ALA  96   7.470   4.591  -3.681
  755   3HB   ALA  96          3HB       ALA  96   6.362   5.725  -4.455
  756    H    TYR  97           H        TYR  97   7.506   4.023  -1.549
  757    HA   TYR  97           HA       TYR  97  10.024   4.878  -0.279
  758   1HB   TYR  97          2HB       TYR  97   8.215   4.174   1.274
  759   2HB   TYR  97          1HB       TYR  97   8.222   2.587   0.515
  760    HD1  TYR  97           1HD      TYR  97  10.412   4.968   2.357
  761    HD2  TYR  97           2HD      TYR  97   9.653   0.918   1.299
  762    HE1  TYR  97           1HE      TYR  97  12.172   4.239   3.912
  763    HE2  TYR  97           2HE      TYR  97  11.409   0.178   2.852
  764    HH   TYR  97           HH       TYR  97  12.818   2.254   5.162
  765    H    GLU  98           H        GLU  98   9.531   3.863  -3.027
  766    HA   GLU  98           HA       GLU  98  10.796   2.682  -4.517
  767   1HB   GLU  98          2HB       GLU  98  12.839   1.950  -3.922
  768   2HB   GLU  98          1HB       GLU  98  12.471   2.701  -2.378
  769   1HG   GLU  98          2HG       GLU  98  11.474   0.356  -1.803
  770   2HG   GLU  98          1HG       GLU  98  12.502  -0.183  -3.129
  771    H    PHE  99           H        PHE  99  10.357   0.878  -5.657
  772    HA   PHE  99           HA       PHE  99   8.139  -0.664  -4.994
  773   1HB   PHE  99          2HB       PHE  99  10.017  -0.476  -7.161
  774   2HB   PHE  99          1HB       PHE  99   9.689  -2.167  -6.815
  775    HD1  PHE  99           1HD      PHE  99   8.348  -2.860  -8.578
  776    HD2  PHE  99           2HD      PHE  99   7.414   0.755  -6.540
  777    HE1  PHE  99           1HE      PHE  99   6.241  -2.699  -9.839
  778    HE2  PHE  99           2HE      PHE  99   5.304   0.923  -7.795
  779    HZ   PHE  99           HZ       PHE  99   4.714  -0.807  -9.445
  780    H    LEU 100           H        LEU 100   7.841  -2.462  -3.830
  781    HA   LEU 100           HA       LEU 100  10.033  -3.561  -2.340
  782   1HB   LEU 100          2HB       LEU 100   7.515  -3.216  -1.673
  783   2HB   LEU 100          1HB       LEU 100   7.308  -4.789  -2.415
  784    HG   LEU 100           HG       LEU 100   7.580  -5.271  -0.152
  785   1HD1  LEU 100          1HD1      LEU 100   9.050  -6.607  -1.608
  786   2HD1  LEU 100          2HD1      LEU 100   9.686  -6.432   0.027
  787   3HD1  LEU 100          3HD1      LEU 100  10.362  -5.473  -1.290
  788   1HD2  LEU 100          1HD2      LEU 100   9.472  -2.985  -0.204
  789   2HD2  LEU 100          2HD2      LEU 100   9.753  -4.259   0.983
  790   3HD2  LEU 100          3HD2      LEU 100   8.217  -3.393   0.966
  791    H    GLU 101           H        GLU 101  11.312  -5.142  -3.017
  792    HA   GLU 101           HA       GLU 101  11.024  -6.488  -5.444
  793   1HB   GLU 101          2HB       GLU 101  12.605  -7.448  -3.055
  794   2HB   GLU 101          1HB       GLU 101  12.885  -7.859  -4.741
  795   1HG   GLU 101          2HG       GLU 101  14.017  -5.974  -5.147
  796   2HG   GLU 101          1HG       GLU 101  12.928  -4.988  -4.170
  797    H    LYS 102           H        LYS 102  11.461  -9.157  -5.050
  798    HA   LYS 102           HA       LYS 102   9.317 -10.229  -3.414
  799   1HB   LYS 102          2HB       LYS 102   9.241 -10.124  -6.397
  800   2HB   LYS 102          1HB       LYS 102   8.610 -11.556  -5.596
  801   1HG   LYS 102          2HG       LYS 102   7.692  -8.721  -5.173
  802   2HG   LYS 102          1HG       LYS 102   6.828  -9.991  -6.040
  803   1HD   LYS 102          2HD       LYS 102   7.419 -11.069  -3.524
  804   2HD   LYS 102          1HD       LYS 102   6.890  -9.414  -3.216
  805   1HE   LYS 102          2HE       LYS 102   5.284 -10.950  -5.158
  806   2HE   LYS 102          1HE       LYS 102   5.207 -11.501  -3.485
  807   1HZ   LYS 102          1HZ       LYS 102   4.678  -9.158  -2.873
  808   2HZ   LYS 102          2HZ       LYS 102   3.489  -9.921  -3.805
  809   3HZ   LYS 102          3HZ       LYS 102   4.538  -8.804  -4.521
  810    HA   PRO 103           HA       PRO 103  13.106 -12.940  -4.181
  811   1HB   PRO 103          2HB       PRO 103  14.279 -12.736  -1.762
  812   2HB   PRO 103          1HB       PRO 103  14.595 -11.583  -3.064
  813   1HG   PRO 103          2HG       PRO 103  12.766 -11.325  -0.708
  814   2HG   PRO 103          1HG       PRO 103  13.884 -10.130  -1.393
  815   1HD   PRO 103          2HD       PRO 103  11.207 -10.125  -1.895
  816   2HD   PRO 103          1HD       PRO 103  12.412  -9.520  -3.049
  817    H    PHE 104           H        PHE 104  10.389 -12.833  -2.242
  818    HA   PHE 104           HA       PHE 104  10.626 -15.677  -1.657
  819   1HB   PHE 104          2HB       PHE 104  11.009 -13.734   0.341
  820   2HB   PHE 104          1HB       PHE 104   9.390 -14.373   0.602
  821    HD1  PHE 104           1HD      PHE 104  12.959 -15.246   0.390
  822    HD2  PHE 104           2HD      PHE 104   9.049 -16.572   1.421
  823    HE1  PHE 104           1HE      PHE 104  13.924 -17.220   1.498
  824    HE2  PHE 104           2HE      PHE 104  10.006 -18.548   2.531
  825    HZ   PHE 104           HZ       PHE 104  12.448 -18.875   2.570
  826    H    SER 105           H        SER 105   8.350 -13.173  -0.566
  827    HA   SER 105           HA       SER 105   6.369 -13.554  -2.480
  828   1HB   SER 105          2HB       SER 105   6.033 -15.800  -1.839
  829   2HB   SER 105          1HB       SER 105   6.189 -15.424  -0.124
  830    HG   SER 105           HG       SER 105   4.080 -14.519  -1.795
  831    H    VAL 106           H        VAL 106   6.681 -13.292   1.058
  832    HA   VAL 106           HA       VAL 106   5.570 -10.624   0.992
  833    HB   VAL 106           HB       VAL 106   3.533 -12.000   1.050
  834   1HG1  VAL 106          1HG1      VAL 106   4.298 -12.982   3.772
  835   2HG1  VAL 106          2HG1      VAL 106   4.760 -13.880   2.325
  836   3HG1  VAL 106          3HG1      VAL 106   3.057 -13.585   2.673
  837   1HG2  VAL 106          1HG2      VAL 106   3.875 -10.773   3.768
  838   2HG2  VAL 106          2HG2      VAL 106   2.442 -10.805   2.740
  839   3HG2  VAL 106          3HG2      VAL 106   3.816  -9.787   2.307
  840    H    GLU 107           H        GLU 107   6.542 -13.371   3.024
  841    HA   GLU 107           HA       GLU 107   6.982 -12.308   5.446
  842   1HB   GLU 107          2HB       GLU 107   7.600 -14.626   4.558
  843   2HB   GLU 107          1HB       GLU 107   9.155 -13.917   4.143
  844   1HG   GLU 107          2HG       GLU 107   8.606 -13.199   6.811
  845   2HG   GLU 107          1HG       GLU 107   8.243 -14.916   6.648
  846    H    ARG 108           H        ARG 108   9.146 -11.856   2.670
  847    HA   ARG 108           HA       ARG 108  11.106 -10.353   4.038
  848   1HB   ARG 108          2HB       ARG 108  11.286 -11.458   1.740
  849   2HB   ARG 108          1HB       ARG 108  10.429 -10.056   1.115
  850   1HG   ARG 108          2HG       ARG 108  12.466  -9.198   0.816
  851   2HG   ARG 108          1HG       ARG 108  12.419  -8.880   2.552
  852   1HD   ARG 108          2HD       ARG 108  13.431 -11.476   1.426
  853   2HD   ARG 108          1HD       ARG 108  14.479 -10.074   1.630
  854    HE   ARG 108           HE       ARG 108  13.355 -10.351   4.070
  855   1HH1  ARG 108          1HH1      ARG 108  15.015 -12.575   1.953
  856   2HH1  ARG 108          2HH1      ARG 108  15.644 -13.535   3.249
  857   1HH2  ARG 108          1HH2      ARG 108  14.182 -11.612   5.776
  858   2HH2  ARG 108          2HH2      ARG 108  15.172 -12.989   5.420
  859    H    PHE 109           H        PHE 109   8.215  -9.442   2.233
  860    HA   PHE 109           HA       PHE 109   8.541  -6.664   2.283
  861   1HB   PHE 109          2HB       PHE 109   6.882  -7.602   0.842
  862   2HB   PHE 109          1HB       PHE 109   6.077  -8.411   2.180
  863    HD1  PHE 109           1HD      PHE 109   7.237  -4.889   1.923
  864    HD2  PHE 109           2HD      PHE 109   3.926  -7.551   2.172
  865    HE1  PHE 109           1HE      PHE 109   5.717  -2.970   2.163
  866    HE2  PHE 109           2HE      PHE 109   2.400  -5.637   2.413
  867    HZ   PHE 109           HZ       PHE 109   3.295  -3.342   2.410
  868    H    LEU 110           H        LEU 110   7.532  -8.904   4.737
  869    HA   LEU 110           HA       LEU 110   6.150  -7.195   6.460
  870   1HB   LEU 110          2HB       LEU 110   6.795  -9.820   6.462
  871   2HB   LEU 110          1HB       LEU 110   7.849  -9.222   7.727
  872    HG   LEU 110           HG       LEU 110   4.919  -8.580   7.750
  873   1HD1  LEU 110          1HD1      LEU 110   4.771 -10.548   9.368
  874   2HD1  LEU 110          2HD1      LEU 110   6.266 -11.113   8.623
  875   3HD1  LEU 110          3HD1      LEU 110   4.813 -10.912   7.643
  876   1HD2  LEU 110          1HD2      LEU 110   7.033  -7.758   9.302
  877   2HD2  LEU 110          2HD2      LEU 110   6.337  -9.074  10.248
  878   3HD2  LEU 110          3HD2      LEU 110   5.331  -7.708   9.764
  879    H    LEU 111           H        LEU 111   9.598  -8.030   6.373
  880    HA   LEU 111           HA       LEU 111  10.481  -6.640   8.581
  881   1HB   LEU 111          2HB       LEU 111  11.863  -7.012   5.928
  882   2HB   LEU 111          1HB       LEU 111  12.656  -6.446   7.386
  883    HG   LEU 111           HG       LEU 111  11.584  -8.751   8.304
  884   1HD1  LEU 111          1HD1      LEU 111  11.749  -8.969   5.364
  885   2HD1  LEU 111          2HD1      LEU 111  10.711  -9.814   6.511
  886   3HD1  LEU 111          3HD1      LEU 111  12.387 -10.323   6.296
  887   1HD2  LEU 111          1HD2      LEU 111  13.786  -8.565   8.791
  888   2HD2  LEU 111          2HD2      LEU 111  14.204  -7.962   7.187
  889   3HD2  LEU 111          3HD2      LEU 111  13.940  -9.687   7.439
  890    H    THR 112           H        THR 112  10.233  -5.410   5.250
  891    HA   THR 112           HA       THR 112  11.098  -2.802   5.801
  892    HB   THR 112           HB       THR 112   9.196  -3.750   3.648
  893    HG1  THR 112           1HG      THR 112  11.119  -4.817   3.439
  894   1HG2  THR 112          1HG2      THR 112  10.425  -1.787   2.433
  895   2HG2  THR 112          2HG2      THR 112  10.595  -1.165   4.074
  896   3HG2  THR 112          3HG2      THR 112   8.992  -1.491   3.417
  897    H    ILE 113           H        ILE 113   7.860  -4.225   5.836
  898    HA   ILE 113           HA       ILE 113   6.300  -1.979   6.107
  899    HB   ILE 113           HB       ILE 113   6.018  -4.782   7.081
  900   1HG1  ILE 113          2HG1      ILE 113   5.453  -4.125   4.763
  901   2HG1  ILE 113          1HG1      ILE 113   4.058  -4.746   5.640
  902   1HG2  ILE 113          1HG2      ILE 113   4.357  -2.473   8.037
  903   2HG2  ILE 113          2HG2      ILE 113   5.089  -3.775   8.974
  904   3HG2  ILE 113          3HG2      ILE 113   3.700  -4.107   7.939
  905   1HD1  ILE 113          1HD1      ILE 113   4.234  -1.899   5.941
  906   2HD1  ILE 113          2HD1      ILE 113   2.933  -2.882   5.268
  907   3HD1  ILE 113          3HD1      ILE 113   4.258  -2.347   4.236
  908    H    LYS 114           H        LYS 114   7.669  -3.859   8.824
  909    HA   LYS 114           HA       LYS 114   6.808  -2.305  10.913
  910   1HB   LYS 114          2HB       LYS 114   8.035  -4.391  11.251
  911   2HB   LYS 114          1HB       LYS 114   9.496  -3.661  10.602
  912   1HG   LYS 114          2HG       LYS 114   8.470  -2.089  12.779
  913   2HG   LYS 114          1HG       LYS 114   8.682  -3.769  13.271
  914   1HD   LYS 114          2HD       LYS 114  10.840  -3.283  13.571
  915   2HD   LYS 114          1HD       LYS 114  10.972  -3.207  11.814
  916   1HE   LYS 114          2HE       LYS 114  11.325  -1.010  11.865
  917   2HE   LYS 114          1HE       LYS 114   9.910  -0.744  12.882
  918   1HZ   LYS 114          1HZ       LYS 114  11.148  -0.689  14.743
  919   2HZ   LYS 114          2HZ       LYS 114  12.398  -0.276  13.679
  920   3HZ   LYS 114          3HZ       LYS 114  12.233  -1.873  14.210
  921    H    HIS 115           H        HIS 115  10.000  -2.035   9.379
  922    HA   HIS 115           HA       HIS 115  10.813   0.338  10.490
  923   1HB   HIS 115          2HB       HIS 115  12.018  -1.285   8.858
  924   2HB   HIS 115          1HB       HIS 115  11.381  -0.226   7.606
  925    HD1  HIS 115           1HD      HIS 115  12.209   2.304   7.701
  926    HD2  HIS 115           2HD      HIS 115  14.247  -0.355  10.157
  927    HE1  HIS 115           1HE      HIS 115  14.330   3.484   8.354
  928    HE2  HIS 115           2HE      HIS 115  15.502   1.894   9.918
  929    H    ALA 116           H        ALA 116   8.541  -0.174   7.858
  930    HA   ALA 116           HA       ALA 116   8.451   2.448   6.851
  931   1HB   ALA 116          1HB       ALA 116   5.911   0.952   6.896
  932   2HB   ALA 116          2HB       ALA 116   7.277   0.123   6.151
  933   3HB   ALA 116          3HB       ALA 116   6.767   1.700   5.547
  934    H    PHE 117           H        PHE 117   6.707   0.880   9.489
  935    HA   PHE 117           HA       PHE 117   5.087   3.163  10.088
  936   1HB   PHE 117          2HB       PHE 117   5.590   0.500  11.366
  937   2HB   PHE 117          1HB       PHE 117   4.767   1.759  12.283
  938    HD1  PHE 117           1HD      PHE 117   2.557   2.475  11.699
  939    HD2  PHE 117           2HD      PHE 117   4.549  -0.509   9.412
  940    HE1  PHE 117           1HE      PHE 117   0.425   1.885  10.627
  941    HE2  PHE 117           2HE      PHE 117   2.420  -1.104   8.334
  942    HZ   PHE 117           HZ       PHE 117   0.354   0.098   8.942
  943    H    GLU 118           H        GLU 118   8.128   1.847  11.252
  944    HA   GLU 118           HA       GLU 118   8.387   3.371  13.585
  945   1HB   GLU 118          2HB       GLU 118   9.983   1.565  12.080
  946   2HB   GLU 118          1HB       GLU 118  10.958   2.974  12.476
  947   1HG   GLU 118          2HG       GLU 118  11.187   1.251  14.163
  948   2HG   GLU 118          1HG       GLU 118  10.426   2.693  14.832
  949    H    GLU 119           H        GLU 119  10.474   3.910  10.770
  950    HA   GLU 119           HA       GLU 119  11.134   6.511  11.414
  951   1HB   GLU 119          2HB       GLU 119  11.549   6.688   8.825
  952   2HB   GLU 119          1HB       GLU 119  12.570   5.685   9.846
  953   1HG   GLU 119          2HG       GLU 119  11.651   3.732   9.082
  954   2HG   GLU 119          1HG       GLU 119  10.158   4.513   8.567
  955    H    TYR 120           H        TYR 120   8.258   5.338  10.026
  956    HA   TYR 120           HA       TYR 120   7.346   8.101   9.604
  957   1HB   TYR 120          2HB       TYR 120   7.554   6.044   7.662
  958   2HB   TYR 120          1HB       TYR 120   5.840   6.300   7.963
  959    HD1  TYR 120           1HD      TYR 120   5.757   9.196   8.506
  960    HD2  TYR 120           2HD      TYR 120   7.951   7.016   5.585
  961    HE1  TYR 120           1HE      TYR 120   5.807  11.187   7.066
  962    HE2  TYR 120           2HE      TYR 120   8.005   9.002   4.135
  963    HH   TYR 120           HH       TYR 120   6.046  11.543   4.422
  964    H    SER 121           H        SER 121   6.958   7.209  12.026
  965    HA   SER 121           HA       SER 121   4.511   5.713  12.308
  966   1HB   SER 121          2HB       SER 121   6.652   6.625  14.046
  967   2HB   SER 121          1HB       SER 121   5.070   6.915  14.769
  968    HG   SER 121           HG       SER 121   5.855   4.430  13.654
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  -1.888   2.471  17.242
    2   2H    MET   1          2HT       MET   1  -3.156   1.631  16.447
    3   3H    MET   1          3HT       MET   1  -1.704   1.993  15.607
    4    HA   MET   1           HA       MET   1  -0.584   0.654  17.423
    5   1HB   MET   1          2HB       MET   1  -3.030   0.628  18.501
    6   2HB   MET   1          1HB       MET   1  -3.171  -0.819  17.513
    7   1HG   MET   1          2HG       MET   1  -1.347  -1.857  18.630
    8   2HG   MET   1          1HG       MET   1  -0.936  -0.361  19.469
    9   1HE   MET   1          1HE       MET   1  -2.243   0.726  21.261
   10   2HE   MET   1          2HE       MET   1  -1.352  -0.545  22.096
   11   3HE   MET   1          3HE       MET   1  -3.042  -0.244  22.498
   12    H    LYS   2           H        LYS   2   0.062   0.688  15.027
   13    HA   LYS   2           HA       LYS   2   0.671  -0.517  13.199
   14   1HB   LYS   2          2HB       LYS   2  -0.615  -2.866  14.598
   15   2HB   LYS   2          1HB       LYS   2   0.543  -2.937  13.276
   16   1HG   LYS   2          2HG       LYS   2   1.268  -1.596  15.844
   17   2HG   LYS   2          1HG       LYS   2   1.348  -3.353  15.693
   18   1HD   LYS   2          2HD       LYS   2   3.183  -3.274  14.400
   19   2HD   LYS   2          1HD       LYS   2   2.584  -1.900  13.469
   20   1HE   LYS   2          2HE       LYS   2   3.464  -0.352  14.938
   21   2HE   LYS   2          1HE       LYS   2   3.484  -1.489  16.285
   22   1HZ   LYS   2          1HZ       LYS   2   5.199  -2.660  14.623
   23   2HZ   LYS   2          2HZ       LYS   2   5.668  -1.547  15.809
   24   3HZ   LYS   2          3HZ       LYS   2   5.462  -1.041  14.209
   25    H    ARG   3           H        ARG   3  -0.515   0.332  11.590
   26    HA   ARG   3           HA       ARG   3  -2.859  -1.155  10.724
   27   1HB   ARG   3          2HB       ARG   3  -2.900   1.828  11.225
   28   2HB   ARG   3          1HB       ARG   3  -4.141   0.953  10.337
   29   1HG   ARG   3          2HG       ARG   3  -5.154   0.905  12.339
   30   2HG   ARG   3          1HG       ARG   3  -4.099  -0.483  12.606
   31   1HD   ARG   3          2HD       ARG   3  -2.864   0.595  14.137
   32   2HD   ARG   3          1HD       ARG   3  -2.868   2.102  13.222
   33    HE   ARG   3           HE       ARG   3  -4.724   1.308  15.296
   34   1HH1  ARG   3          1HH1      ARG   3  -4.092   3.485  12.638
   35   2HH1  ARG   3          2HH1      ARG   3  -5.195   4.692  13.204
   36   1HH2  ARG   3          1HH2      ARG   3  -6.178   2.896  16.035
   37   2HH2  ARG   3          2HH2      ARG   3  -6.379   4.358  15.130
   38    H    VAL   4           H        VAL   4  -2.602  -1.590   8.633
   39    HA   VAL   4           HA       VAL   4  -1.180   0.368   6.952
   40    HB   VAL   4           HB       VAL   4  -0.941  -2.633   6.690
   41   1HG1  VAL   4          1HG1      VAL   4   0.170  -0.312   5.170
   42   2HG1  VAL   4          2HG1      VAL   4  -0.558  -1.799   4.566
   43   3HG1  VAL   4          3HG1      VAL   4   1.066  -1.826   5.252
   44   1HG2  VAL   4          1HG2      VAL   4   1.145  -0.699   7.694
   45   2HG2  VAL   4          2HG2      VAL   4   1.265  -2.456   7.608
   46   3HG2  VAL   4          3HG2      VAL   4   0.144  -1.703   8.741
   47    H    LEU   5           H        LEU   5  -1.725   0.265   4.653
   48    HA   LEU   5           HA       LEU   5  -4.450  -0.773   4.221
   49   1HB   LEU   5          2HB       LEU   5  -4.384   1.666   4.305
   50   2HB   LEU   5          1HB       LEU   5  -3.157   1.690   3.052
   51    HG   LEU   5           HG       LEU   5  -4.823   0.636   1.501
   52   1HD1  LEU   5          1HD1      LEU   5  -6.907   0.089   2.122
   53   2HD1  LEU   5          2HD1      LEU   5  -7.078   1.505   3.160
   54   3HD1  LEU   5          3HD1      LEU   5  -6.234   0.075   3.753
   55   1HD2  LEU   5          1HD2      LEU   5  -6.330   2.844   1.620
   56   2HD2  LEU   5          2HD2      LEU   5  -4.681   2.838   0.996
   57   3HD2  LEU   5          3HD2      LEU   5  -4.995   3.352   2.654
   58    H    VAL   6           H        VAL   6  -4.912  -1.841   2.349
   59    HA   VAL   6           HA       VAL   6  -2.660  -2.349   0.516
   60    HB   VAL   6           HB       VAL   6  -4.869  -4.306   1.135
   61   1HG1  VAL   6          1HG1      VAL   6  -2.553  -4.258  -0.668
   62   2HG1  VAL   6          2HG1      VAL   6  -4.053  -5.180  -0.767
   63   3HG1  VAL   6          3HG1      VAL   6  -2.739  -5.743   0.264
   64   1HG2  VAL   6          1HG2      VAL   6  -3.415  -5.451   2.630
   65   2HG2  VAL   6          2HG2      VAL   6  -3.447  -3.760   3.131
   66   3HG2  VAL   6          3HG2      VAL   6  -2.066  -4.387   2.231
   67    H    VAL   7           H        VAL   7  -3.069  -2.342  -1.661
   68    HA   VAL   7           HA       VAL   7  -5.835  -1.860  -2.530
   69    HB   VAL   7           HB       VAL   7  -3.488  -0.363  -3.698
   70   1HG1  VAL   7          1HG1      VAL   7  -5.904  -0.831  -4.790
   71   2HG1  VAL   7          2HG1      VAL   7  -4.951   0.622  -5.098
   72   3HG1  VAL   7          3HG1      VAL   7  -6.244   0.652  -3.898
   73   1HG2  VAL   7          1HG2      VAL   7  -5.197   0.266  -1.354
   74   2HG2  VAL   7          2HG2      VAL   7  -4.798   1.584  -2.456
   75   3HG2  VAL   7          3HG2      VAL   7  -3.510   0.672  -1.668
   76    H    ASP   8           H        ASP   8  -6.420  -3.301  -4.024
   77    HA   ASP   8           HA       ASP   8  -4.633  -4.039  -6.156
   78   1HB   ASP   8          2HB       ASP   8  -3.758  -5.606  -4.610
   79   2HB   ASP   8          1HB       ASP   8  -5.352  -6.002  -3.979
   80    H    ASP   9           H        ASP   9  -5.702  -5.411  -7.763
   81    HA   ASP   9           HA       ASP   9  -8.533  -4.775  -7.904
   82   1HB   ASP   9          2HB       ASP   9  -7.118  -4.298  -9.850
   83   2HB   ASP   9          1HB       ASP   9  -6.682  -5.999  -9.965
   84    H    GLU  10           H        GLU  10  -8.228  -6.565  -5.950
   85    HA   GLU  10           HA       GLU  10  -9.444  -8.975  -7.087
   86   1HB   GLU  10          2HB       GLU  10  -6.923  -9.215  -6.453
   87   2HB   GLU  10          1HB       GLU  10  -7.519  -9.234  -4.800
   88   1HG   GLU  10          2HG       GLU  10  -9.150 -11.064  -5.889
   89   2HG   GLU  10          1HG       GLU  10  -7.733 -11.267  -6.919
   90    H    GLU  11           H        GLU  11 -11.329  -9.381  -6.138
   91    HA   GLU  11           HA       GLU  11 -12.027  -7.978  -3.693
   92   1HB   GLU  11          2HB       GLU  11 -13.657  -9.695  -5.570
   93   2HB   GLU  11          1HB       GLU  11 -14.308  -8.906  -4.139
   94   1HG   GLU  11          2HG       GLU  11 -14.059  -6.779  -5.046
   95   2HG   GLU  11          1HG       GLU  11 -12.909  -7.330  -6.263
   96    H    SER  12           H        SER  12 -10.155  -9.665  -2.940
   97    HA   SER  12           HA       SER  12 -11.503 -11.406  -1.122
   98   1HB   SER  12          2HB       SER  12  -9.695 -12.741  -3.146
   99   2HB   SER  12          1HB       SER  12 -10.609 -13.521  -1.856
  100    HG   SER  12           HG       SER  12 -12.484 -13.112  -2.934
  101    H    ILE  13           H        ILE  13  -9.722  -9.205  -0.922
  102    HA   ILE  13           HA       ILE  13  -7.880  -8.490   0.188
  103    HB   ILE  13           HB       ILE  13  -8.001 -11.238   1.357
  104   1HG1  ILE  13          2HG1      ILE  13 -10.127  -9.958   1.531
  105   2HG1  ILE  13          1HG1      ILE  13  -9.411 -10.350   3.091
  106   1HG2  ILE  13          1HG2      ILE  13  -5.923 -10.371   1.997
  107   2HG2  ILE  13          2HG2      ILE  13  -6.980 -10.049   3.372
  108   3HG2  ILE  13          3HG2      ILE  13  -6.584  -8.755   2.242
  109   1HD1  ILE  13          1HD1      ILE  13  -8.391  -7.842   2.322
  110   2HD1  ILE  13          2HD1      ILE  13  -9.506  -8.214   3.635
  111   3HD1  ILE  13          3HD1      ILE  13 -10.131  -7.812   2.036
  112    H    THR  14           H        THR  14  -5.538  -8.974   0.608
  113    HA   THR  14           HA       THR  14  -4.381 -10.157  -1.765
  114    HB   THR  14           HB       THR  14  -2.240  -9.228  -0.783
  115    HG1  THR  14           1HG      THR  14  -2.714  -7.616   0.913
  116   1HG2  THR  14          1HG2      THR  14  -2.668  -6.979  -1.344
  117   2HG2  THR  14          2HG2      THR  14  -4.385  -7.137  -0.966
  118   3HG2  THR  14          3HG2      THR  14  -3.714  -7.954  -2.377
  119    H    SER  15           H        SER  15  -3.675 -12.174  -1.842
  120    HA   SER  15           HA       SER  15  -3.874 -14.009   0.211
  121   1HB   SER  15          2HB       SER  15  -3.747 -14.745  -2.076
  122   2HB   SER  15          1HB       SER  15  -2.130 -14.069  -2.256
  123    HG   SER  15           HG       SER  15  -2.706 -16.494  -1.558
  124    H    SER  16           H        SER  16  -2.659 -14.655   1.857
  125    HA   SER  16           HA       SER  16  -0.837 -15.034   3.186
  126   1HB   SER  16          2HB       SER  16   0.491 -15.003   1.009
  127   2HB   SER  16          1HB       SER  16   0.871 -13.325   1.399
  128    HG   SER  16           HG       SER  16   1.586 -14.249   3.503
  129    H    LEU  17           H        LEU  17  -1.993 -11.938   2.317
  130    HA   LEU  17           HA       LEU  17  -0.450 -10.467   4.243
  131   1HB   LEU  17          2HB       LEU  17  -2.413  -9.899   2.194
  132   2HB   LEU  17          1HB       LEU  17  -2.799  -9.031   3.660
  133    HG   LEU  17           HG       LEU  17  -1.041  -8.243   1.646
  134   1HD1  LEU  17          1HD1      LEU  17  -1.114  -6.264   2.718
  135   2HD1  LEU  17          2HD1      LEU  17  -0.773  -6.975   4.296
  136   3HD1  LEU  17          3HD1      LEU  17  -2.399  -7.072   3.617
  137   1HD2  LEU  17          1HD2      LEU  17   1.132  -8.110   2.571
  138   2HD2  LEU  17          2HD2      LEU  17   0.636  -9.797   2.711
  139   3HD2  LEU  17          3HD2      LEU  17   0.589  -8.744   4.124
  140    H    SER  18           H        SER  18  -3.803 -11.638   4.086
  141    HA   SER  18           HA       SER  18  -4.756 -10.665   6.480
  142   1HB   SER  18          2HB       SER  18  -6.259 -11.774   4.979
  143   2HB   SER  18          1HB       SER  18  -5.350 -13.281   5.088
  144    HG   SER  18           HG       SER  18  -7.283 -13.205   6.396
  145    H    ALA  19           H        ALA  19  -3.287 -13.885   5.995
  146    HA   ALA  19           HA       ALA  19  -3.254 -14.664   8.666
  147   1HB   ALA  19          1HB       ALA  19  -2.678 -15.964   6.473
  148   2HB   ALA  19          2HB       ALA  19  -1.952 -16.443   8.008
  149   3HB   ALA  19          3HB       ALA  19  -1.027 -15.479   6.857
  150    H    ILE  20           H        ILE  20  -0.761 -12.966   6.792
  151    HA   ILE  20           HA       ILE  20   1.188 -12.836   8.797
  152    HB   ILE  20           HB       ILE  20   0.637 -11.022   6.450
  153   1HG1  ILE  20          2HG1      ILE  20   2.900 -12.960   6.875
  154   2HG1  ILE  20          1HG1      ILE  20   1.377 -13.429   6.128
  155   1HG2  ILE  20          1HG2      ILE  20   2.693 -10.807   8.588
  156   2HG2  ILE  20          2HG2      ILE  20   1.846  -9.539   7.702
  157   3HG2  ILE  20          3HG2      ILE  20   3.160 -10.427   6.930
  158   1HD1  ILE  20          1HD1      ILE  20   3.422 -11.485   5.115
  159   2HD1  ILE  20          2HD1      ILE  20   1.788 -11.577   4.458
  160   3HD1  ILE  20          3HD1      ILE  20   2.856 -12.978   4.367
  161    H    LEU  21           H        LEU  21  -0.745 -10.048   7.701
  162    HA   LEU  21           HA       LEU  21  -0.264  -8.361   9.803
  163   1HB   LEU  21          2HB       LEU  21  -2.888  -8.661   8.355
  164   2HB   LEU  21          1HB       LEU  21  -2.337  -7.238   9.220
  165    HG   LEU  21           HG       LEU  21  -0.440  -8.082   7.186
  166   1HD1  LEU  21          1HD1      LEU  21  -1.757  -8.459   5.455
  167   2HD1  LEU  21          2HD1      LEU  21  -2.473  -6.861   5.655
  168   3HD1  LEU  21          3HD1      LEU  21  -3.186  -8.255   6.467
  169   1HD2  LEU  21          1HD2      LEU  21  -1.806  -5.594   8.086
  170   2HD2  LEU  21          2HD2      LEU  21  -0.994  -5.618   6.521
  171   3HD2  LEU  21          3HD2      LEU  21  -0.085  -5.967   7.991
  172    H    GLU  22           H        GLU  22  -2.439 -11.092   9.692
  173    HA   GLU  22           HA       GLU  22  -3.839 -10.464  12.103
  174   1HB   GLU  22          2HB       GLU  22  -3.628 -12.905  10.381
  175   2HB   GLU  22          1HB       GLU  22  -4.435 -12.975  11.940
  176   1HG   GLU  22          2HG       GLU  22  -6.104 -11.473  11.270
  177   2HG   GLU  22          1HG       GLU  22  -5.187 -10.958   9.854
  178    H    GLU  23           H        GLU  23  -0.913 -12.199  11.305
  179    HA   GLU  23           HA       GLU  23  -0.664 -13.371  13.932
  180   1HB   GLU  23          2HB       GLU  23   0.234 -14.697  12.201
  181   2HB   GLU  23          1HB       GLU  23   1.054 -13.331  11.461
  182   1HG   GLU  23          2HG       GLU  23   2.879 -13.630  12.687
  183   2HG   GLU  23          1HG       GLU  23   1.953 -13.830  14.172
  184    H    GLU  24           H        GLU  24   0.607 -10.634  12.146
  185    HA   GLU  24           HA       GLU  24   2.563  -9.918  14.106
  186   1HB   GLU  24          2HB       GLU  24   1.370  -8.370  11.805
  187   2HB   GLU  24          1HB       GLU  24   2.691  -7.786  12.808
  188   1HG   GLU  24          2HG       GLU  24   2.979 -10.437  11.501
  189   2HG   GLU  24          1HG       GLU  24   3.124  -8.986  10.510
  190    H    GLY  25           H        GLY  25  -0.777  -9.064  13.470
  191   1HA   GLY  25          2HA       GLY  25  -2.253  -8.319  15.165
  192   2HA   GLY  25          1HA       GLY  25  -0.868  -7.723  16.065
  193    H    TYR  26           H        TYR  26  -1.711  -7.167  12.681
  194    HA   TYR  26           HA       TYR  26  -1.664  -4.280  13.215
  195   1HB   TYR  26          2HB       TYR  26  -1.156  -5.932  10.756
  196   2HB   TYR  26          1HB       TYR  26  -1.521  -4.219  10.628
  197    HD1  TYR  26           1HD      TYR  26   0.461  -3.262   9.900
  198    HD2  TYR  26           2HD      TYR  26   0.564  -5.981  13.169
  199    HE1  TYR  26           1HE      TYR  26   2.827  -2.718  10.264
  200    HE2  TYR  26           2HE      TYR  26   2.935  -5.445  13.543
  201    HH   TYR  26           HH       TYR  26   4.443  -2.807  12.305
  202    H    HIS  27           H        HIS  27  -2.986  -3.190  11.249
  203    HA   HIS  27           HA       HIS  27  -5.679  -4.372  11.209
  204   1HB   HIS  27          2HB       HIS  27  -5.093  -2.183  12.711
  205   2HB   HIS  27          1HB       HIS  27  -5.504  -1.414  11.182
  206    HD1  HIS  27           1HD      HIS  27  -7.963  -1.716  10.334
  207    HD2  HIS  27           2HD      HIS  27  -7.227  -3.253  14.123
  208    HE1  HIS  27           1HE      HIS  27 -10.228  -2.128  11.344
  209    HE2  HIS  27           2HE      HIS  27  -9.758  -2.978  13.669
  210    HA   PRO  28           HA       PRO  28  -4.277  -3.409   6.958
  211   1HB   PRO  28          2HB       PRO  28  -4.815  -5.782   5.853
  212   2HB   PRO  28          1HB       PRO  28  -3.369  -5.524   6.836
  213   1HG   PRO  28          2HG       PRO  28  -5.948  -6.842   7.566
  214   2HG   PRO  28          1HG       PRO  28  -4.293  -7.305   7.993
  215   1HD   PRO  28          2HD       PRO  28  -6.025  -5.914   9.644
  216   2HD   PRO  28          1HD       PRO  28  -4.260  -5.920   9.806
  217    H    ASP  29           H        ASP  29  -5.513  -2.409   5.557
  218    HA   ASP  29           HA       ASP  29  -8.325  -3.215   5.266
  219   1HB   ASP  29          2HB       ASP  29  -7.242  -0.682   5.993
  220   2HB   ASP  29          1HB       ASP  29  -7.987  -0.535   4.406
  221    H    THR  30           H        THR  30  -8.644  -4.116   3.322
  222    HA   THR  30           HA       THR  30  -6.827  -3.347   1.151
  223    HB   THR  30           HB       THR  30  -7.250  -5.468   0.150
  224    HG1  THR  30           1HG      THR  30  -9.449  -5.671   0.500
  225   1HG2  THR  30          1HG2      THR  30  -6.255  -6.881   1.619
  226   2HG2  THR  30          2HG2      THR  30  -7.261  -6.366   2.972
  227   3HG2  THR  30          3HG2      THR  30  -5.928  -5.349   2.428
  228    H    ALA  31           H        ALA  31  -7.516  -2.552  -0.734
  229    HA   ALA  31           HA       ALA  31 -10.391  -1.982  -0.984
  230   1HB   ALA  31          1HB       ALA  31  -9.796   0.105  -1.464
  231   2HB   ALA  31          2HB       ALA  31  -8.858  -0.468  -2.846
  232   3HB   ALA  31          3HB       ALA  31  -8.099  -0.331  -1.260
  233    H    LYS  32           H        LYS  32 -10.422  -1.351  -3.712
  234    HA   LYS  32           HA       LYS  32  -9.596  -3.863  -4.984
  235   1HB   LYS  32          2HB       LYS  32 -12.139  -2.732  -5.952
  236   2HB   LYS  32          1HB       LYS  32 -11.668  -4.409  -5.713
  237   1HG   LYS  32          2HG       LYS  32 -12.194  -4.336  -3.421
  238   2HG   LYS  32          1HG       LYS  32 -12.299  -2.578  -3.428
  239   1HD   LYS  32          2HD       LYS  32 -14.153  -3.242  -5.311
  240   2HD   LYS  32          1HD       LYS  32 -14.294  -4.593  -4.185
  241   1HE   LYS  32          2HE       LYS  32 -14.629  -1.658  -3.611
  242   2HE   LYS  32          1HE       LYS  32 -15.839  -2.934  -3.477
  243   1HZ   LYS  32          1HZ       LYS  32 -14.484  -3.913  -1.685
  244   2HZ   LYS  32          2HZ       LYS  32 -15.041  -2.362  -1.307
  245   3HZ   LYS  32          3HZ       LYS  32 -13.431  -2.591  -1.773
  246    H    THR  33           H        THR  33  -9.466  -0.546  -5.064
  247    HA   THR  33           HA       THR  33  -8.138  -0.481  -7.551
  248    HB   THR  33           HB       THR  33  -9.939   1.315  -8.402
  249    HG1  THR  33           1HG      THR  33 -11.533  -0.660  -7.147
  250   1HG2  THR  33          1HG2      THR  33  -9.118  -1.023  -9.375
  251   2HG2  THR  33          2HG2      THR  33 -10.456  -0.109 -10.070
  252   3HG2  THR  33          3HG2      THR  33 -10.781  -1.453  -8.975
  253    H    LEU  34           H        LEU  34  -7.592   1.846  -8.157
  254    HA   LEU  34           HA       LEU  34  -6.558   3.160  -5.900
  255   1HB   LEU  34          2HB       LEU  34  -7.029   4.223  -8.688
  256   2HB   LEU  34          1HB       LEU  34  -6.061   5.022  -7.464
  257    HG   LEU  34           HG       LEU  34  -5.415   2.246  -8.425
  258   1HD1  LEU  34          1HD1      LEU  34  -3.598   3.679  -9.719
  259   2HD1  LEU  34          2HD1      LEU  34  -4.910   4.859  -9.731
  260   3HD1  LEU  34          3HD1      LEU  34  -5.153   3.263 -10.441
  261   1HD2  LEU  34          1HD2      LEU  34  -4.479   3.445  -6.275
  262   2HD2  LEU  34          2HD2      LEU  34  -3.437   4.246  -7.452
  263   3HD2  LEU  34          3HD2      LEU  34  -3.428   2.489  -7.317
  264    H    ARG  35           H        ARG  35  -9.590   3.439  -7.582
  265    HA   ARG  35           HA       ARG  35 -10.376   5.934  -6.449
  266   1HB   ARG  35          2HB       ARG  35 -12.105   3.704  -7.545
  267   2HB   ARG  35          1HB       ARG  35 -12.619   5.360  -7.249
  268   1HG   ARG  35          2HG       ARG  35 -10.406   5.615  -8.903
  269   2HG   ARG  35          1HG       ARG  35 -11.277   4.219  -9.539
  270   1HD   ARG  35          2HD       ARG  35 -12.505   5.749 -10.628
  271   2HD   ARG  35          1HD       ARG  35 -13.312   5.964  -9.075
  272    HE   ARG  35           HE       ARG  35 -10.980   7.612  -9.414
  273   1HH1  ARG  35          1HH1      ARG  35 -14.417   7.360  -9.968
  274   2HH1  ARG  35          2HH1      ARG  35 -14.655   9.074 -10.052
  275   1HH2  ARG  35          1HH2      ARG  35 -11.292   9.865  -9.525
  276   2HH2  ARG  35          2HH2      ARG  35 -12.881  10.495  -9.800
  277    H    GLU  36           H        GLU  36 -11.005   2.536  -5.669
  278    HA   GLU  36           HA       GLU  36 -12.666   2.996  -3.442
  279   1HB   GLU  36          2HB       GLU  36 -11.281   0.716  -4.646
  280   2HB   GLU  36          1HB       GLU  36 -11.366   0.608  -2.893
  281   1HG   GLU  36          2HG       GLU  36 -13.809   1.243  -4.494
  282   2HG   GLU  36          1HG       GLU  36 -13.248  -0.420  -4.322
  283    H    ALA  37           H        ALA  37  -9.186   2.908  -3.850
  284    HA   ALA  37           HA       ALA  37  -8.563   2.839  -1.067
  285   1HB   ALA  37          1HB       ALA  37  -6.611   4.056  -2.918
  286   2HB   ALA  37          2HB       ALA  37  -7.107   2.405  -3.289
  287   3HB   ALA  37          3HB       ALA  37  -6.397   2.780  -1.719
  288    H    GLU  38           H        GLU  38  -8.610   5.448  -3.499
  289    HA   GLU  38           HA       GLU  38  -7.819   7.578  -1.978
  290   1HB   GLU  38          2HB       GLU  38  -9.974   7.446  -4.082
  291   2HB   GLU  38          1HB       GLU  38  -9.413   8.958  -3.380
  292   1HG   GLU  38          2HG       GLU  38  -7.342   8.811  -4.382
  293   2HG   GLU  38          1HG       GLU  38  -7.456   7.066  -4.600
  294    H    LYS  39           H        LYS  39 -11.087   6.201  -2.158
  295    HA   LYS  39           HA       LYS  39 -12.320   8.004  -0.401
  296   1HB   LYS  39          2HB       LYS  39 -13.623   6.461  -1.760
  297   2HB   LYS  39          1HB       LYS  39 -12.918   5.084  -0.924
  298   1HG   LYS  39          2HG       LYS  39 -14.294   7.061   0.774
  299   2HG   LYS  39          1HG       LYS  39 -15.313   6.125  -0.320
  300   1HD   LYS  39          2HD       LYS  39 -14.715   4.097   0.665
  301   2HD   LYS  39          1HD       LYS  39 -13.267   4.779   1.409
  302   1HE   LYS  39          2HE       LYS  39 -14.518   5.911   3.050
  303   2HE   LYS  39          1HE       LYS  39 -16.029   5.685   2.169
  304   1HZ   LYS  39          1HZ       LYS  39 -14.499   3.718   3.747
  305   2HZ   LYS  39          2HZ       LYS  39 -15.571   3.203   2.543
  306   3HZ   LYS  39          3HZ       LYS  39 -16.139   4.117   3.848
  307    H    LYS  40           H        LYS  40 -10.950   4.778   0.236
  308    HA   LYS  40           HA       LYS  40 -11.253   4.821   3.015
  309   1HB   LYS  40          2HB       LYS  40  -9.209   3.398   1.312
  310   2HB   LYS  40          1HB       LYS  40  -9.462   3.084   3.023
  311   1HG   LYS  40          2HG       LYS  40 -11.916   2.645   2.329
  312   2HG   LYS  40          1HG       LYS  40 -11.242   2.468   0.707
  313   1HD   LYS  40          2HD       LYS  40 -10.191   0.523   1.211
  314   2HD   LYS  40          1HD       LYS  40  -9.854   1.012   2.873
  315   1HE   LYS  40          2HE       LYS  40 -11.404  -0.677   3.164
  316   2HE   LYS  40          1HE       LYS  40 -12.415   0.767   3.196
  317   1HZ   LYS  40          1HZ       LYS  40 -13.046  -1.277   1.724
  318   2HZ   LYS  40          2HZ       LYS  40 -11.967  -0.576   0.628
  319   3HZ   LYS  40          3HZ       LYS  40 -13.312   0.297   1.165
  320    H    ILE  41           H        ILE  41  -8.932   6.394   0.967
  321    HA   ILE  41           HA       ILE  41  -7.187   6.983   3.244
  322    HB   ILE  41           HB       ILE  41  -6.815   7.721   0.345
  323   1HG1  ILE  41          2HG1      ILE  41  -5.285   5.564   1.754
  324   2HG1  ILE  41          1HG1      ILE  41  -6.872   5.206   1.081
  325   1HG2  ILE  41          1HG2      ILE  41  -5.171   8.065   2.804
  326   2HG2  ILE  41          2HG2      ILE  41  -5.421   9.168   1.450
  327   3HG2  ILE  41          3HG2      ILE  41  -4.357   7.773   1.267
  328   1HD1  ILE  41          1HD1      ILE  41  -5.916   4.862  -0.877
  329   2HD1  ILE  41          2HD1      ILE  41  -4.350   5.349  -0.232
  330   3HD1  ILE  41          3HD1      ILE  41  -5.433   6.558  -0.920
  331    H    LYS  42           H        LYS  42  -9.787   8.384   1.564
  332    HA   LYS  42           HA       LYS  42  -9.027  11.123   1.851
  333   1HB   LYS  42          2HB       LYS  42 -10.835   9.924   0.314
  334   2HB   LYS  42          1HB       LYS  42 -11.885  10.375   1.649
  335   1HG   LYS  42          2HG       LYS  42 -10.231  12.597   0.925
  336   2HG   LYS  42          1HG       LYS  42 -11.050  11.963  -0.504
  337   1HD   LYS  42          2HD       LYS  42 -12.788  12.149   1.835
  338   2HD   LYS  42          1HD       LYS  42 -12.127  13.707   1.334
  339   1HE   LYS  42          2HE       LYS  42 -13.312  13.738  -0.583
  340   2HE   LYS  42          1HE       LYS  42 -13.124  12.005  -0.849
  341   1HZ   LYS  42          1HZ       LYS  42 -14.827  12.766   1.376
  342   2HZ   LYS  42          2HZ       LYS  42 -15.032  11.547   0.222
  343   3HZ   LYS  42          3HZ       LYS  42 -15.423  13.147  -0.161
  344    H    GLU  43           H        GLU  43 -10.015   8.807   4.060
  345    HA   GLU  43           HA       GLU  43 -10.711  10.897   5.991
  346   1HB   GLU  43          2HB       GLU  43 -12.145   8.250   5.732
  347   2HB   GLU  43          1HB       GLU  43 -12.446   9.465   6.965
  348   1HG   GLU  43          2HG       GLU  43 -13.791  10.622   5.633
  349   2HG   GLU  43          1HG       GLU  43 -12.642  10.568   4.297
  350    H    LEU  44           H        LEU  44 -10.219   7.366   5.866
  351    HA   LEU  44           HA       LEU  44  -9.103   7.148   8.426
  352   1HB   LEU  44          2HB       LEU  44  -9.574   5.437   6.170
  353   2HB   LEU  44          1HB       LEU  44  -7.972   5.126   6.810
  354    HG   LEU  44           HG       LEU  44  -9.652   3.632   7.783
  355   1HD1  LEU  44          1HD1      LEU  44  -7.651   4.333   9.070
  356   2HD1  LEU  44          2HD1      LEU  44  -9.030   3.906  10.085
  357   3HD1  LEU  44          3HD1      LEU  44  -8.624   5.601   9.818
  358   1HD2  LEU  44          1HD2      LEU  44 -11.642   4.876   7.741
  359   2HD2  LEU  44          2HD2      LEU  44 -10.922   6.219   8.629
  360   3HD2  LEU  44          3HD2      LEU  44 -11.251   4.694   9.451
  361    H    PHE  45           H        PHE  45  -7.311   8.097   9.122
  362    HA   PHE  45           HA       PHE  45  -5.257   9.017   7.374
  363   1HB   PHE  45          2HB       PHE  45  -5.985   9.897   9.735
  364   2HB   PHE  45          1HB       PHE  45  -4.836   8.701  10.326
  365    HD1  PHE  45           1HD      PHE  45  -5.140  12.020   9.740
  366    HD2  PHE  45           2HD      PHE  45  -2.560   8.792   8.723
  367    HE1  PHE  45           1HE      PHE  45  -3.301  13.611   9.366
  368    HE2  PHE  45           2HE      PHE  45  -0.717  10.375   8.349
  369    HZ   PHE  45           HZ       PHE  45  -1.085  12.789   8.668
  370    H    PHE  46           H        PHE  46  -5.051   6.775   6.406
  371    HA   PHE  46           HA       PHE  46  -3.811   4.684   7.812
  372   1HB   PHE  46          2HB       PHE  46  -4.066   5.375   4.904
  373   2HB   PHE  46          1HB       PHE  46  -3.054   4.024   5.405
  374    HD1  PHE  46           1HD      PHE  46  -6.279   4.982   4.438
  375    HD2  PHE  46           2HD      PHE  46  -4.216   2.330   7.050
  376    HE1  PHE  46           1HE      PHE  46  -8.269   3.538   4.535
  377    HE2  PHE  46           2HE      PHE  46  -6.202   0.880   7.151
  378    HZ   PHE  46           HZ       PHE  46  -8.232   1.484   5.893
  379    HA   PRO  47           HA       PRO  47   0.289   6.431   8.008
  380   1HB   PRO  47          2HB       PRO  47   1.370   4.110   9.192
  381   2HB   PRO  47          1HB       PRO  47   0.770   5.544  10.024
  382   1HG   PRO  47          2HG       PRO  47  -0.363   2.959  10.051
  383   2HG   PRO  47          1HG       PRO  47  -1.063   4.437  10.720
  384   1HD   PRO  47          2HD       PRO  47  -1.690   3.026   8.205
  385   2HD   PRO  47          1HD       PRO  47  -2.689   4.133   9.164
  386    H    VAL  48           H        VAL  48  -0.065   3.010   7.073
  387    HA   VAL  48           HA       VAL  48   2.077   3.422   5.095
  388    HB   VAL  48           HB       VAL  48   1.278   0.797   6.347
  389   1HG1  VAL  48          1HG1      VAL  48   3.095   1.581   4.197
  390   2HG1  VAL  48          2HG1      VAL  48   2.388   0.009   4.571
  391   3HG1  VAL  48          3HG1      VAL  48   3.837   0.549   5.419
  392   1HG2  VAL  48          1HG2      VAL  48   2.230   1.812   8.156
  393   2HG2  VAL  48          2HG2      VAL  48   3.249   2.862   7.171
  394   3HG2  VAL  48          3HG2      VAL  48   3.672   1.162   7.376
  395    H    ILE  49           H        ILE  49   1.479   3.322   3.041
  396    HA   ILE  49           HA       ILE  49  -1.059   1.982   2.380
  397    HB   ILE  49           HB       ILE  49   0.369   4.005   0.657
  398   1HG1  ILE  49          2HG1      ILE  49  -0.169   5.076   2.783
  399   2HG1  ILE  49          1HG1      ILE  49  -1.240   5.671   1.518
  400   1HG2  ILE  49          1HG2      ILE  49  -2.488   3.042   0.685
  401   2HG2  ILE  49          2HG2      ILE  49  -1.247   2.549  -0.466
  402   3HG2  ILE  49          3HG2      ILE  49  -1.798   4.224  -0.429
  403   1HD1  ILE  49          1HD1      ILE  49  -2.290   5.167   3.756
  404   2HD1  ILE  49          2HD1      ILE  49  -2.029   3.461   3.387
  405   3HD1  ILE  49          3HD1      ILE  49  -3.063   4.442   2.346
  406    H    VAL  50           H        VAL  50  -1.026   0.229   1.124
  407    HA   VAL  50           HA       VAL  50   1.453  -0.375  -0.353
  408    HB   VAL  50           HB       VAL  50  -0.417  -2.365   0.939
  409   1HG1  VAL  50          1HG1      VAL  50   2.239  -2.820  -0.420
  410   2HG1  VAL  50          2HG1      VAL  50   0.666  -3.166  -1.139
  411   3HG1  VAL  50          3HG1      VAL  50   1.192  -4.047   0.294
  412   1HG2  VAL  50          1HG2      VAL  50   2.380  -2.217   1.807
  413   2HG2  VAL  50          2HG2      VAL  50   0.903  -2.403   2.753
  414   3HG2  VAL  50          3HG2      VAL  50   1.408  -0.802   2.212
  415    H    LEU  51           H        LEU  51   1.037   0.036  -2.407
  416    HA   LEU  51           HA       LEU  51  -1.571  -0.550  -3.557
  417   1HB   LEU  51          2HB       LEU  51  -0.589   1.543  -4.193
  418   2HB   LEU  51          1HB       LEU  51   0.904   0.759  -4.675
  419    HG   LEU  51           HG       LEU  51  -0.447  -0.427  -6.470
  420   1HD1  LEU  51          1HD1      LEU  51  -2.549   0.593  -7.126
  421   2HD1  LEU  51          2HD1      LEU  51  -2.463   1.696  -5.753
  422   3HD1  LEU  51          3HD1      LEU  51  -2.656  -0.036  -5.482
  423   1HD2  LEU  51          1HD2      LEU  51   0.994   1.760  -6.614
  424   2HD2  LEU  51          2HD2      LEU  51  -0.572   2.514  -6.916
  425   3HD2  LEU  51          3HD2      LEU  51   0.011   1.233  -7.980
  426    H    ASP  52           H        ASP  52  -1.839  -1.862  -5.433
  427    HA   ASP  52           HA       ASP  52   0.319  -3.702  -6.104
  428   1HB   ASP  52          2HB       ASP  52  -1.583  -4.454  -4.240
  429   2HB   ASP  52          1HB       ASP  52  -2.207  -5.129  -5.741
  430    H    VAL  53           H        VAL  53   0.455  -3.405  -8.229
  431    HA   VAL  53           HA       VAL  53  -1.907  -2.851  -9.818
  432    HB   VAL  53           HB       VAL  53   1.011  -3.037 -10.584
  433   1HG1  VAL  53          1HG1      VAL  53   0.076  -3.494 -12.613
  434   2HG1  VAL  53          2HG1      VAL  53  -0.023  -1.733 -12.645
  435   3HG1  VAL  53          3HG1      VAL  53  -1.443  -2.691 -12.221
  436   1HG2  VAL  53          1HG2      VAL  53   1.167  -0.806 -10.285
  437   2HG2  VAL  53          2HG2      VAL  53  -0.173  -1.078  -9.170
  438   3HG2  VAL  53          3HG2      VAL  53  -0.491  -0.510 -10.810
  439    H    TRP  54           H        TRP  54  -2.765  -5.057  -9.233
  440    HA   TRP  54           HA       TRP  54  -1.556  -7.369 -10.387
  441   1HB   TRP  54          2HB       TRP  54  -3.025  -7.613  -8.475
  442   2HB   TRP  54          1HB       TRP  54  -4.361  -6.883  -9.358
  443    HD1  TRP  54           HD       TRP  54  -6.065  -8.720  -9.860
  444    HE1  TRP  54           1HE      TRP  54  -5.970 -11.147 -10.708
  445    HE3  TRP  54           3HE      TRP  54  -0.993  -9.301 -10.092
  446    HZ2  TRP  54           2HZ      TRP  54  -4.005 -13.058 -11.385
  447    HZ3  TRP  54           3HZ      TRP  54  -0.085 -11.460 -10.849
  448    HH2  TRP  54           HH       TRP  54  -1.563 -13.298 -11.482
  449    H    MET  55           H        MET  55  -4.851  -6.289 -11.136
  450    HA   MET  55           HA       MET  55  -4.217  -6.032 -13.952
  451   1HB   MET  55          2HB       MET  55  -5.354  -8.449 -12.853
  452   2HB   MET  55          1HB       MET  55  -6.480  -7.702 -13.977
  453   1HG   MET  55          2HG       MET  55  -5.356  -8.743 -15.577
  454   2HG   MET  55          1HG       MET  55  -4.090  -7.546 -15.316
  455   1HE   MET  55          1HE       MET  55  -4.457 -11.779 -14.883
  456   2HE   MET  55          2HE       MET  55  -5.677 -10.665 -14.265
  457   3HE   MET  55          3HE       MET  55  -4.541 -11.435 -13.156
  458    HA   PRO  56           HA       PRO  56  -7.849  -3.506 -12.456
  459   1HB   PRO  56          2HB       PRO  56  -6.378  -1.153 -11.959
  460   2HB   PRO  56          1HB       PRO  56  -7.022  -2.264 -10.752
  461   1HG   PRO  56          2HG       PRO  56  -4.315  -1.783 -11.298
  462   2HG   PRO  56          1HG       PRO  56  -4.971  -3.104 -10.322
  463   1HD   PRO  56          2HD       PRO  56  -4.062  -3.111 -13.161
  464   2HD   PRO  56          1HD       PRO  56  -3.963  -4.392 -11.937
  465    H    ASP  57           H        ASP  57  -7.796  -0.758 -13.083
  466    HA   ASP  57           HA       ASP  57  -6.973  -0.566 -15.872
  467   1HB   ASP  57          2HB       ASP  57  -9.843  -0.201 -14.995
  468   2HB   ASP  57          1HB       ASP  57  -9.216   0.157 -16.601
  469    H    GLY  58           H        GLY  58  -6.033   0.738 -13.520
  470   1HA   GLY  58          2HA       GLY  58  -6.579   3.503 -14.314
  471   2HA   GLY  58          1HA       GLY  58  -6.828   3.073 -12.629
  472    H    ASP  59           H        ASP  59  -4.777   4.667 -14.450
  473    HA   ASP  59           HA       ASP  59  -2.239   3.585 -13.994
  474   1HB   ASP  59          2HB       ASP  59  -3.341   6.128 -14.881
  475   2HB   ASP  59          1HB       ASP  59  -1.880   6.348 -13.922
  476    H    GLY  60           H        GLY  60  -0.744   3.794 -12.363
  477   1HA   GLY  60          2HA       GLY  60  -1.844   4.663  -9.783
  478   2HA   GLY  60          1HA       GLY  60  -0.476   3.583 -10.005
  479    H    VAL  61           H        VAL  61   0.576   5.502 -12.111
  480    HA   VAL  61           HA       VAL  61   2.454   6.830 -10.592
  481    HB   VAL  61           HB       VAL  61   1.442   7.761 -13.276
  482   1HG1  VAL  61          1HG1      VAL  61   4.123   8.008 -11.927
  483   2HG1  VAL  61          2HG1      VAL  61   2.962   9.308 -12.198
  484   3HG1  VAL  61          3HG1      VAL  61   3.753   8.529 -13.570
  485   1HG2  VAL  61          1HG2      VAL  61   3.200   5.458 -12.520
  486   2HG2  VAL  61          2HG2      VAL  61   3.412   6.280 -14.066
  487   3HG2  VAL  61          3HG2      VAL  61   1.870   5.515 -13.678
  488    H    ASN  62           H        ASN  62  -0.587   8.116 -11.930
  489    HA   ASN  62           HA       ASN  62  -0.217  10.710 -10.850
  490   1HB   ASN  62          2HB       ASN  62  -2.553  10.993 -11.621
  491   2HB   ASN  62          1HB       ASN  62  -1.488  10.379 -12.866
  492   1HD2  ASN  62          1HD2      ASN  62  -3.855   9.400 -10.442
  493   2HD2  ASN  62          2HD2      ASN  62  -4.439   8.026 -11.310
  494    H    PHE  63           H        PHE  63  -1.017   7.816  -9.363
  495    HA   PHE  63           HA       PHE  63  -2.989   8.894  -7.543
  496   1HB   PHE  63          2HB       PHE  63  -3.104   6.535  -8.243
  497   2HB   PHE  63          1HB       PHE  63  -1.548   6.236  -7.472
  498    HD1  PHE  63           1HD      PHE  63  -4.444   8.226  -6.268
  499    HD2  PHE  63           2HD      PHE  63  -2.009   4.779  -5.722
  500    HE1  PHE  63           1HE      PHE  63  -5.586   7.763  -4.139
  501    HE2  PHE  63           2HE      PHE  63  -3.149   4.310  -3.591
  502    HZ   PHE  63           HZ       PHE  63  -4.940   5.805  -2.798
  503    H    ILE  64           H        ILE  64   0.449   8.149  -7.509
  504    HA   ILE  64           HA       ILE  64   1.087   8.174  -4.862
  505    HB   ILE  64           HB       ILE  64   2.609   9.593  -7.050
  506   1HG1  ILE  64          2HG1      ILE  64   3.857   7.179  -6.363
  507   2HG1  ILE  64          1HG1      ILE  64   2.140   6.798  -6.449
  508   1HG2  ILE  64          1HG2      ILE  64   4.561   8.944  -5.453
  509   2HG2  ILE  64          2HG2      ILE  64   3.298   8.925  -4.222
  510   3HG2  ILE  64          3HG2      ILE  64   3.615  10.399  -5.136
  511   1HD1  ILE  64          1HD1      ILE  64   3.407   8.353  -8.648
  512   2HD1  ILE  64          2HD1      ILE  64   2.013   7.275  -8.687
  513   3HD1  ILE  64          3HD1      ILE  64   3.639   6.609  -8.559
  514    H    ASP  65           H        ASP  65   0.001  10.890  -6.764
  515    HA   ASP  65           HA       ASP  65   0.809  12.898  -4.905
  516   1HB   ASP  65          2HB       ASP  65   0.324  13.286  -7.353
  517   2HB   ASP  65          1HB       ASP  65  -1.387  13.113  -6.976
  518    H    PHE  66           H        PHE  66  -2.398  11.401  -5.605
  519    HA   PHE  66           HA       PHE  66  -3.890  12.768  -3.751
  520   1HB   PHE  66          2HB       PHE  66  -4.838  11.173  -5.359
  521   2HB   PHE  66          1HB       PHE  66  -4.093   9.838  -4.489
  522    HD1  PHE  66           1HD      PHE  66  -4.769   9.620  -1.973
  523    HD2  PHE  66           2HD      PHE  66  -7.012  11.751  -4.896
  524    HE1  PHE  66           1HE      PHE  66  -6.779   9.421  -0.572
  525    HE2  PHE  66           2HE      PHE  66  -9.027  11.553  -3.498
  526    HZ   PHE  66           HZ       PHE  66  -8.912  10.387  -1.332
  527    H    ILE  67           H        ILE  67  -1.816   9.947  -3.254
  528    HA   ILE  67           HA       ILE  67  -2.476   9.504  -0.550
  529    HB   ILE  67           HB       ILE  67   0.068   8.853  -2.048
  530   1HG1  ILE  67          2HG1      ILE  67  -1.230   6.498  -1.553
  531   2HG1  ILE  67          1HG1      ILE  67  -2.584   7.594  -1.804
  532   1HG2  ILE  67          1HG2      ILE  67   0.883   8.564   0.039
  533   2HG2  ILE  67          2HG2      ILE  67  -0.007   7.044  -0.059
  534   3HG2  ILE  67          3HG2      ILE  67  -0.720   8.432   0.763
  535   1HD1  ILE  67          1HD1      ILE  67  -0.604   8.015  -3.826
  536   2HD1  ILE  67          2HD1      ILE  67  -2.290   7.523  -3.990
  537   3HD1  ILE  67          3HD1      ILE  67  -1.037   6.308  -3.741
  538    H    LYS  68           H        LYS  68   0.228  11.301  -2.040
  539    HA   LYS  68           HA       LYS  68   1.198  12.236   0.481
  540   1HB   LYS  68          2HB       LYS  68   2.685  13.663  -0.858
  541   2HB   LYS  68          1HB       LYS  68   2.703  11.998  -1.423
  542   1HG   LYS  68          2HG       LYS  68   2.530  13.009  -3.410
  543   2HG   LYS  68          1HG       LYS  68   0.817  12.946  -3.010
  544   1HD   LYS  68          2HD       LYS  68   0.661  15.182  -2.776
  545   2HD   LYS  68          1HD       LYS  68   2.230  15.300  -1.977
  546   1HE   LYS  68          2HE       LYS  68   3.259  14.901  -4.262
  547   2HE   LYS  68          1HE       LYS  68   1.646  15.165  -4.925
  548   1HZ   LYS  68          1HZ       LYS  68   1.897  17.307  -3.370
  549   2HZ   LYS  68          2HZ       LYS  68   2.354  17.284  -4.998
  550   3HZ   LYS  68          3HZ       LYS  68   3.519  17.071  -3.789
  551    H    GLU  69           H        GLU  69  -1.355  13.165  -1.553
  552    HA   GLU  69           HA       GLU  69  -1.410  15.952  -0.959
  553   1HB   GLU  69          2HB       GLU  69  -2.515  14.719  -2.924
  554   2HB   GLU  69          1HB       GLU  69  -3.786  14.313  -1.782
  555   1HG   GLU  69          2HG       GLU  69  -3.341  17.077  -1.533
  556   2HG   GLU  69          1HG       GLU  69  -3.385  16.721  -3.260
  557    H    ASN  70           H        ASN  70  -3.315  13.176   0.170
  558    HA   ASN  70           HA       ASN  70  -4.114  14.770   2.511
  559   1HB   ASN  70          2HB       ASN  70  -5.524  12.279   1.570
  560   2HB   ASN  70          1HB       ASN  70  -6.136  13.556   2.618
  561   1HD2  ASN  70          1HD2      ASN  70  -5.020  12.932  -0.676
  562   2HD2  ASN  70          2HD2      ASN  70  -6.053  14.088  -1.436
  563    H    SER  71           H        SER  71  -1.675  13.019   1.969
  564    HA   SER  71           HA       SER  71  -1.556  11.853   4.576
  565   1HB   SER  71          2HB       SER  71  -2.326  10.182   2.328
  566   2HB   SER  71          1HB       SER  71  -0.831   9.613   3.067
  567    HG   SER  71           HG       SER  71  -1.965   9.697   5.101
  568    HA   PRO  72           HA       PRO  72   2.453  13.059   2.514
  569   1HB   PRO  72          2HB       PRO  72   2.770  15.117   4.519
  570   2HB   PRO  72          1HB       PRO  72   2.640  15.299   2.770
  571   1HG   PRO  72          2HG       PRO  72   0.722  16.125   4.541
  572   2HG   PRO  72          1HG       PRO  72   0.396  15.697   2.854
  573   1HD   PRO  72          2HD       PRO  72  -0.033  14.090   5.339
  574   2HD   PRO  72          1HD       PRO  72  -1.042  14.211   3.882
  575    H    ASP  73           H        ASP  73   1.351  12.230   5.609
  576    HA   ASP  73           HA       ASP  73   4.073  11.632   6.539
  577   1HB   ASP  73          2HB       ASP  73   2.110  12.990   7.846
  578   2HB   ASP  73          1HB       ASP  73   1.885  11.359   8.469
  579    H    SER  74           H        SER  74   2.387  10.036   4.658
  580    HA   SER  74           HA       SER  74   2.077   7.587   6.257
  581   1HB   SER  74          2HB       SER  74   0.038   8.308   5.088
  582   2HB   SER  74          1HB       SER  74   0.902   8.265   3.550
  583    HG   SER  74           HG       SER  74  -0.103   6.195   5.086
  584    H    VAL  75           H        VAL  75   2.230   5.632   4.433
  585    HA   VAL  75           HA       VAL  75   4.891   5.954   3.210
  586    HB   VAL  75           HB       VAL  75   3.871   3.400   4.459
  587   1HG1  VAL  75          1HG1      VAL  75   6.425   4.236   3.147
  588   2HG1  VAL  75          2HG1      VAL  75   5.466   2.778   2.899
  589   3HG1  VAL  75          3HG1      VAL  75   6.427   2.963   4.366
  590   1HG2  VAL  75          1HG2      VAL  75   4.248   4.466   6.404
  591   2HG2  VAL  75          2HG2      VAL  75   5.218   5.727   5.644
  592   3HG2  VAL  75          3HG2      VAL  75   5.944   4.166   6.024
  593    H    VAL  76           H        VAL  76   5.345   4.411   1.479
  594    HA   VAL  76           HA       VAL  76   2.976   3.371   0.101
  595    HB   VAL  76           HB       VAL  76   4.983   4.789  -1.582
  596   1HG1  VAL  76          1HG1      VAL  76   3.047   3.359  -2.414
  597   2HG1  VAL  76          2HG1      VAL  76   3.220   4.966  -3.120
  598   3HG1  VAL  76          3HG1      VAL  76   1.998   4.673  -1.881
  599   1HG2  VAL  76          1HG2      VAL  76   2.952   6.114   0.172
  600   2HG2  VAL  76          2HG2      VAL  76   3.381   6.819  -1.387
  601   3HG2  VAL  76          3HG2      VAL  76   4.621   6.582  -0.155
  602    H    ILE  77           H        ILE  77   3.454   1.264   0.064
  603    HA   ILE  77           HA       ILE  77   6.156   0.453  -0.771
  604    HB   ILE  77           HB       ILE  77   4.066  -1.278   0.548
  605   1HG1  ILE  77          2HG1      ILE  77   4.690   0.503   2.081
  606   2HG1  ILE  77          1HG1      ILE  77   5.415  -1.012   2.609
  607   1HG2  ILE  77          1HG2      ILE  77   6.340  -1.983  -0.836
  608   2HG2  ILE  77          2HG2      ILE  77   5.493  -2.982   0.344
  609   3HG2  ILE  77          3HG2      ILE  77   6.869  -2.001   0.846
  610   1HD1  ILE  77          1HD1      ILE  77   7.360   0.076   1.008
  611   2HD1  ILE  77          2HD1      ILE  77   7.306   0.143   2.770
  612   3HD1  ILE  77          3HD1      ILE  77   6.668   1.482   1.817
  613    H    VAL  78           H        VAL  78   4.406   1.363  -2.734
  614    HA   VAL  78           HA       VAL  78   2.752  -0.382  -4.036
  615    HB   VAL  78           HB       VAL  78   4.793   1.415  -5.363
  616   1HG1  VAL  78          1HG1      VAL  78   2.246   0.173  -6.395
  617   2HG1  VAL  78          2HG1      VAL  78   3.888  -0.112  -6.975
  618   3HG1  VAL  78          3HG1      VAL  78   3.126   1.460  -7.219
  619   1HG2  VAL  78          1HG2      VAL  78   2.402   2.713  -5.496
  620   2HG2  VAL  78          2HG2      VAL  78   3.654   3.023  -4.293
  621   3HG2  VAL  78          3HG2      VAL  78   2.308   1.952  -3.908
  622    H    ILE  79           H        ILE  79   3.270  -2.529  -4.004
  623    HA   ILE  79           HA       ILE  79   5.845  -3.530  -4.669
  624    HB   ILE  79           HB       ILE  79   3.259  -5.069  -4.596
  625   1HG1  ILE  79          2HG1      ILE  79   5.225  -4.766  -2.339
  626   2HG1  ILE  79          1HG1      ILE  79   3.828  -3.711  -2.519
  627   1HG2  ILE  79          1HG2      ILE  79   5.095  -6.809  -3.784
  628   2HG2  ILE  79          2HG2      ILE  79   6.126  -5.788  -4.787
  629   3HG2  ILE  79          3HG2      ILE  79   4.711  -6.574  -5.489
  630   1HD1  ILE  79          1HD1      ILE  79   3.444  -5.544  -0.939
  631   2HD1  ILE  79          2HD1      ILE  79   3.704  -6.701  -2.244
  632   3HD1  ILE  79          3HD1      ILE  79   2.336  -5.590  -2.310
  633    H    THR  80           H        THR  80   3.299  -5.148  -6.303
  634    HA   THR  80           HA       THR  80   2.816  -5.516  -8.495
  635    HB   THR  80           HB       THR  80   2.851  -3.763  -9.985
  636    HG1  THR  80           1HG      THR  80   4.593  -2.682 -10.445
  637   1HG2  THR  80          1HG2      THR  80   2.246  -2.982  -7.464
  638   2HG2  THR  80          2HG2      THR  80   2.053  -1.984  -8.903
  639   3HG2  THR  80          3HG2      THR  80   3.493  -1.817  -7.902
  640    H    GLY  81           H        GLY  81   3.718  -6.968  -9.821
  641   1HA   GLY  81          2HA       GLY  81   6.663  -6.952 -10.071
  642   2HA   GLY  81          1HA       GLY  81   5.758  -8.434  -9.806
  643    H    HIS  82           H        HIS  82   5.226  -9.584 -11.535
  644    HA   HIS  82           HA       HIS  82   4.897 -10.215 -13.691
  645   1HB   HIS  82          2HB       HIS  82   3.995  -7.355 -13.772
  646   2HB   HIS  82          1HB       HIS  82   4.090  -8.288 -15.261
  647    HD1  HIS  82           1HD      HIS  82   2.053  -9.574 -15.831
  648    HD2  HIS  82           2HD      HIS  82   2.261  -8.715 -11.771
  649    HE1  HIS  82           1HE      HIS  82  -0.101 -10.425 -14.852
  650    HE2  HIS  82           2HE      HIS  82   0.009  -9.812 -12.411
  651    H    GLY  83           H        GLY  83   6.010  -6.927 -14.439
  652   1HA   GLY  83          2HA       GLY  83   8.708  -7.438 -14.833
  653   2HA   GLY  83          1HA       GLY  83   7.906  -7.866 -16.336
  654    H    SER  84           H        SER  84   7.435  -5.223 -13.992
  655    HA   SER  84           HA       SER  84   7.953  -3.318 -16.175
  656   1HB   SER  84          2HB       SER  84   5.450  -3.744 -15.326
  657   2HB   SER  84          1HB       SER  84   5.946  -2.570 -14.108
  658    HG   SER  84           HG       SER  84   5.031  -1.574 -15.961
  659    H    VAL  85           H        VAL  85  10.090  -3.183 -15.245
  660    HA   VAL  85           HA       VAL  85  10.446  -2.242 -12.562
  661    HB   VAL  85           HB       VAL  85  12.179  -3.578 -13.677
  662   1HG1  VAL  85          1HG1      VAL  85  11.705  -2.128 -15.889
  663   2HG1  VAL  85          2HG1      VAL  85  13.187  -3.046 -15.624
  664   3HG1  VAL  85          3HG1      VAL  85  13.153  -1.313 -15.297
  665   1HG2  VAL  85          1HG2      VAL  85  13.532  -0.970 -13.281
  666   2HG2  VAL  85          2HG2      VAL  85  13.905  -2.556 -12.606
  667   3HG2  VAL  85          3HG2      VAL  85  12.578  -1.605 -11.940
  668    H    ASP  86           H        ASP  86  10.135  -0.774 -15.715
  669    HA   ASP  86           HA       ASP  86  11.111   1.800 -14.995
  670   1HB   ASP  86          2HB       ASP  86  10.053   2.546 -17.098
  671   2HB   ASP  86          1HB       ASP  86  11.021   1.093 -17.330
  672    H    THR  87           H        THR  87   8.239   0.157 -14.232
  673    HA   THR  87           HA       THR  87   6.588   2.518 -14.006
  674    HB   THR  87           HB       THR  87   5.875   0.005 -14.423
  675    HG1  THR  87           1HG      THR  87   4.056   1.007 -14.331
  676   1HG2  THR  87          1HG2      THR  87   6.831  -0.592 -12.071
  677   2HG2  THR  87          2HG2      THR  87   5.313  -1.298 -12.626
  678   3HG2  THR  87          3HG2      THR  87   5.294   0.062 -11.503
  679    H    ALA  88           H        ALA  88   8.545   0.479 -11.953
  680    HA   ALA  88           HA       ALA  88   7.756   1.416  -9.441
  681   1HB   ALA  88          1HB       ALA  88  10.583   0.670 -10.131
  682   2HB   ALA  88          2HB       ALA  88   9.302  -0.535 -10.006
  683   3HB   ALA  88          3HB       ALA  88   9.729   0.446  -8.605
  684    H    VAL  89           H        VAL  89  10.536   2.396 -11.407
  685    HA   VAL  89           HA       VAL  89  11.322   4.569  -9.843
  686    HB   VAL  89           HB       VAL  89  12.618   5.315 -11.752
  687   1HG1  VAL  89          1HG1      VAL  89  13.206   3.193 -10.461
  688   2HG1  VAL  89          2HG1      VAL  89  13.990   3.432 -12.023
  689   3HG1  VAL  89          3HG1      VAL  89  12.632   2.315 -11.879
  690   1HG2  VAL  89          1HG2      VAL  89  12.389   4.310 -13.956
  691   2HG2  VAL  89          2HG2      VAL  89  10.878   5.075 -13.466
  692   3HG2  VAL  89          3HG2      VAL  89  11.046   3.321 -13.383
  693    H    LYS  90           H        LYS  90   8.826   4.275 -12.270
  694    HA   LYS  90           HA       LYS  90   8.472   7.092 -12.654
  695   1HB   LYS  90          2HB       LYS  90   7.843   5.499 -14.393
  696   2HB   LYS  90          1HB       LYS  90   6.661   4.764 -13.318
  697   1HG   LYS  90          2HG       LYS  90   5.275   6.676 -13.377
  698   2HG   LYS  90          1HG       LYS  90   6.533   7.652 -14.139
  699   1HD   LYS  90          2HD       LYS  90   5.327   5.219 -15.441
  700   2HD   LYS  90          1HD       LYS  90   4.683   6.847 -15.661
  701   1HE   LYS  90          2HE       LYS  90   6.885   7.572 -16.504
  702   2HE   LYS  90          1HE       LYS  90   7.469   5.917 -16.345
  703   1HZ   LYS  90          1HZ       LYS  90   6.793   6.411 -18.612
  704   2HZ   LYS  90          2HZ       LYS  90   5.231   6.794 -18.090
  705   3HZ   LYS  90          3HZ       LYS  90   5.807   5.210 -17.945
  706    H    ALA  91           H        ALA  91   7.603   4.963 -10.166
  707    HA   ALA  91           HA       ALA  91   5.480   6.800  -9.265
  708   1HB   ALA  91          1HB       ALA  91   4.650   4.867  -7.912
  709   2HB   ALA  91          2HB       ALA  91   5.823   3.851  -8.751
  710   3HB   ALA  91          3HB       ALA  91   4.534   4.644  -9.657
  711    H    ILE  92           H        ILE  92   8.330   4.967  -8.314
  712    HA   ILE  92           HA       ILE  92   8.240   5.909  -5.595
  713    HB   ILE  92           HB       ILE  92  10.066   4.569  -5.145
  714   1HG1  ILE  92          2HG1      ILE  92  10.855   4.901  -8.044
  715   2HG1  ILE  92          1HG1      ILE  92  11.709   5.495  -6.624
  716   1HG2  ILE  92          1HG2      ILE  92   9.578   2.787  -7.345
  717   2HG2  ILE  92          2HG2      ILE  92   8.063   3.498  -6.791
  718   3HG2  ILE  92          3HG2      ILE  92   9.097   2.638  -5.656
  719   1HD1  ILE  92          1HD1      ILE  92  12.792   3.547  -7.663
  720   2HD1  ILE  92          2HD1      ILE  92  11.351   2.590  -7.324
  721   3HD1  ILE  92          3HD1      ILE  92  12.305   3.248  -5.994
  722    H    LYS  93           H        LYS  93  10.329   6.918  -4.696
  723    HA   LYS  93           HA       LYS  93  11.828   8.628  -4.597
  724   1HB   LYS  93          2HB       LYS  93  11.874   7.917  -7.408
  725   2HB   LYS  93          1HB       LYS  93  12.095   9.647  -7.192
  726   1HG   LYS  93          2HG       LYS  93  14.255   9.008  -7.034
  727   2HG   LYS  93          1HG       LYS  93  13.804   8.795  -5.342
  728   1HD   LYS  93          2HD       LYS  93  13.612   6.468  -5.570
  729   2HD   LYS  93          1HD       LYS  93  13.553   6.560  -7.332
  730   1HE   LYS  93          2HE       LYS  93  15.709   5.765  -6.804
  731   2HE   LYS  93          1HE       LYS  93  15.916   7.465  -7.225
  732   1HZ   LYS  93          1HZ       LYS  93  16.547   7.988  -5.150
  733   2HZ   LYS  93          2HZ       LYS  93  16.916   6.343  -5.022
  734   3HZ   LYS  93          3HZ       LYS  93  15.450   6.928  -4.415
  735    H    LYS  94           H        LYS  94   9.199   9.171  -6.912
  736    HA   LYS  94           HA       LYS  94   9.016  11.950  -6.587
  737   1HB   LYS  94          2HB       LYS  94   7.825  10.135  -8.207
  738   2HB   LYS  94          1HB       LYS  94   6.505  10.515  -7.111
  739   1HG   LYS  94          2HG       LYS  94   7.866  12.900  -8.025
  740   2HG   LYS  94          1HG       LYS  94   7.248  11.933  -9.365
  741   1HD   LYS  94          2HD       LYS  94   5.095  11.836  -7.835
  742   2HD   LYS  94          1HD       LYS  94   5.781  13.324  -7.180
  743   1HE   LYS  94          2HE       LYS  94   4.262  13.893  -8.950
  744   2HE   LYS  94          1HE       LYS  94   5.907  14.220  -9.491
  745   1HZ   LYS  94          1HZ       LYS  94   5.904  12.263 -10.803
  746   2HZ   LYS  94          2HZ       LYS  94   4.462  13.078 -11.147
  747   3HZ   LYS  94          3HZ       LYS  94   4.445  11.722 -10.136
  748    H    GLY  95           H        GLY  95   8.037   9.337  -4.575
  749   1HA   GLY  95          2HA       GLY  95   7.506  10.883  -2.342
  750   2HA   GLY  95          1HA       GLY  95   5.962  10.651  -3.149
  751    H    ALA  96           H        ALA  96   6.740   7.974  -4.137
  752    HA   ALA  96           HA       ALA  96   5.705   6.446  -2.025
  753   1HB   ALA  96          1HB       ALA  96   5.627   4.749  -3.505
  754   2HB   ALA  96          2HB       ALA  96   7.290   4.996  -4.038
  755   3HB   ALA  96          3HB       ALA  96   5.999   6.020  -4.669
  756    H    TYR  97           H        TYR  97   6.928   4.310  -1.389
  757    HA   TYR  97           HA       TYR  97   9.471   5.164  -0.193
  758   1HB   TYR  97          2HB       TYR  97   7.554   4.451   1.281
  759   2HB   TYR  97          1HB       TYR  97   7.741   2.830   0.618
  760    HD1  TYR  97           1HD      TYR  97   9.163   1.328   1.666
  761    HD2  TYR  97           2HD      TYR  97   9.688   5.491   2.366
  762    HE1  TYR  97           1HE      TYR  97  10.867   0.821   3.365
  763    HE2  TYR  97           2HE      TYR  97  11.394   4.996   4.065
  764    HH   TYR  97           HH       TYR  97  12.926   2.140   4.357
  765    H    GLU  98           H        GLU  98   9.127   4.107  -2.923
  766    HA   GLU  98           HA       GLU  98  10.463   2.886  -4.321
  767   1HB   GLU  98          2HB       GLU  98  12.473   2.249  -3.566
  768   2HB   GLU  98          1HB       GLU  98  11.957   2.862  -2.003
  769   1HG   GLU  98          2HG       GLU  98  11.112   0.574  -1.471
  770   2HG   GLU  98          1HG       GLU  98  11.845   0.017  -2.974
  771    H    PHE  99           H        PHE  99  10.151   0.987  -5.425
  772    HA   PHE  99           HA       PHE  99   7.851  -0.511  -4.793
  773   1HB   PHE  99          2HB       PHE  99   9.909  -0.523  -6.902
  774   2HB   PHE  99          1HB       PHE  99   9.151  -2.081  -6.611
  775    HD1  PHE  99           1HD      PHE  99   8.097  -2.180  -8.758
  776    HD2  PHE  99           2HD      PHE  99   7.354   1.085  -6.130
  777    HE1  PHE  99           1HE      PHE  99   6.180  -1.504 -10.145
  778    HE2  PHE  99           2HE      PHE  99   5.434   1.764  -7.512
  779    HZ   PHE  99           HZ       PHE  99   4.844   0.468  -9.520
  780    H    LEU 100           H        LEU 100   7.619  -2.684  -4.172
  781    HA   LEU 100           HA       LEU 100   9.611  -3.580  -2.296
  782   1HB   LEU 100          2HB       LEU 100   7.060  -3.671  -2.030
  783   2HB   LEU 100          1HB       LEU 100   7.119  -5.060  -3.097
  784    HG   LEU 100           HG       LEU 100   7.021  -5.775  -0.784
  785   1HD1  LEU 100          1HD1      LEU 100   8.383  -7.015  -2.501
  786   2HD1  LEU 100          2HD1      LEU 100   8.796  -7.332  -0.816
  787   3HD1  LEU 100          3HD1      LEU 100   9.810  -6.265  -1.787
  788   1HD2  LEU 100          1HD2      LEU 100   9.696  -4.893  -0.028
  789   2HD2  LEU 100          2HD2      LEU 100   8.188  -4.852   0.884
  790   3HD2  LEU 100          3HD2      LEU 100   8.563  -3.562  -0.256
  791    H    GLU 101           H        GLU 101  11.389  -4.411  -3.246
  792    HA   GLU 101           HA       GLU 101  11.578  -5.745  -5.660
  793   1HB   GLU 101          2HB       GLU 101  13.278  -6.141  -3.192
  794   2HB   GLU 101          1HB       GLU 101  13.717  -6.646  -4.817
  795   1HG   GLU 101          2HG       GLU 101  13.024  -3.794  -4.374
  796   2HG   GLU 101          1HG       GLU 101  14.577  -4.384  -3.782
  797    H    LYS 102           H        LYS 102  11.884  -7.975  -6.183
  798    HA   LYS 102           HA       LYS 102  11.282 -10.166  -6.211
  799   1HB   LYS 102          2HB       LYS 102  12.524  -9.816  -3.835
  800   2HB   LYS 102          1HB       LYS 102  10.948 -10.362  -3.276
  801   1HG   LYS 102          2HG       LYS 102  12.158 -12.325  -3.453
  802   2HG   LYS 102          1HG       LYS 102  11.252 -12.279  -4.967
  803   1HD   LYS 102          2HD       LYS 102  13.267 -12.679  -5.894
  804   2HD   LYS 102          1HD       LYS 102  13.493 -10.941  -5.683
  805   1HE   LYS 102          2HE       LYS 102  15.408 -11.724  -4.703
  806   2HE   LYS 102          1HE       LYS 102  14.336 -11.668  -3.304
  807   1HZ   LYS 102          1HZ       LYS 102  13.851 -14.123  -4.201
  808   2HZ   LYS 102          2HZ       LYS 102  15.045 -13.773  -3.056
  809   3HZ   LYS 102          3HZ       LYS 102  15.463 -13.959  -4.685
  810    HA   PRO 103           HA       PRO 103   6.843  -8.965  -5.479
  811   1HB   PRO 103          2HB       PRO 103   6.013  -9.297  -8.030
  812   2HB   PRO 103          1HB       PRO 103   6.746  -7.793  -7.460
  813   1HG   PRO 103          2HG       PRO 103   7.991 -10.046  -8.991
  814   2HG   PRO 103          1HG       PRO 103   8.168  -8.298  -9.233
  815   1HD   PRO 103          2HD       PRO 103  10.018  -9.804  -7.932
  816   2HD   PRO 103          1HD       PRO 103   9.722  -8.096  -7.549
  817    H    PHE 104           H        PHE 104   7.596 -11.263  -4.489
  818    HA   PHE 104           HA       PHE 104   5.678 -13.164  -5.577
  819   1HB   PHE 104          2HB       PHE 104   8.509 -14.036  -4.983
  820   2HB   PHE 104          1HB       PHE 104   7.213 -15.002  -5.684
  821    HD1  PHE 104           1HD      PHE 104  10.076 -13.104  -6.380
  822    HD2  PHE 104           2HD      PHE 104   6.234 -14.069  -7.935
  823    HE1  PHE 104           1HE      PHE 104  10.834 -12.474  -8.634
  824    HE2  PHE 104           2HE      PHE 104   6.985 -13.442 -10.192
  825    HZ   PHE 104           HZ       PHE 104   9.288 -12.643 -10.544
  826    H    SER 105           H        SER 105   8.117 -12.553  -3.067
  827    HA   SER 105           HA       SER 105   6.523 -14.083  -1.152
  828   1HB   SER 105          2HB       SER 105   8.578 -13.515   0.347
  829   2HB   SER 105          1HB       SER 105   8.759 -14.715  -0.932
  830    HG   SER 105           HG       SER 105  10.371 -12.884  -0.698
  831    H    VAL 106           H        VAL 106   5.464 -13.189   0.533
  832    HA   VAL 106           HA       VAL 106   5.352 -10.259   0.615
  833    HB   VAL 106           HB       VAL 106   3.217 -11.399   0.298
  834   1HG1  VAL 106          1HG1      VAL 106   4.097 -12.898   2.712
  835   2HG1  VAL 106          2HG1      VAL 106   3.292 -13.475   1.252
  836   3HG1  VAL 106          3HG1      VAL 106   2.373 -12.604   2.480
  837   1HG2  VAL 106          1HG2      VAL 106   2.697 -10.519   3.010
  838   2HG2  VAL 106          2HG2      VAL 106   2.187  -9.813   1.475
  839   3HG2  VAL 106          3HG2      VAL 106   3.767  -9.411   2.151
  840    H    GLU 107           H        GLU 107   6.608 -12.916   2.357
  841    HA   GLU 107           HA       GLU 107   6.430 -11.935   4.993
  842   1HB   GLU 107          2HB       GLU 107   7.202 -14.262   4.037
  843   2HB   GLU 107          1HB       GLU 107   8.794 -13.516   4.088
  844   1HG   GLU 107          2HG       GLU 107   7.825 -12.919   6.558
  845   2HG   GLU 107          1HG       GLU 107   7.101 -14.497   6.255
  846    H    ARG 108           H        ARG 108   8.706 -11.421   2.367
  847    HA   ARG 108           HA       ARG 108  10.644  -9.982   3.844
  848   1HB   ARG 108          2HB       ARG 108  10.241 -10.779   1.133
  849   2HB   ARG 108          1HB       ARG 108  10.574  -9.054   1.146
  850   1HG   ARG 108          2HG       ARG 108  12.731  -9.456   1.401
  851   2HG   ARG 108          1HG       ARG 108  12.408 -10.318   2.906
  852   1HD   ARG 108          2HD       ARG 108  12.487 -12.365   1.912
  853   2HD   ARG 108          1HD       ARG 108  11.879 -11.760   0.371
  854    HE   ARG 108           HE       ARG 108  14.352 -10.652   0.577
  855   1HH1  ARG 108          1HH1      ARG 108  13.134 -13.918   0.754
  856   2HH1  ARG 108          2HH1      ARG 108  14.586 -14.626   0.129
  857   1HH2  ARG 108          1HH2      ARG 108  16.262 -11.581  -0.245
  858   2HH2  ARG 108          2HH2      ARG 108  16.362 -13.300  -0.438
  859    H    PHE 109           H        PHE 109   7.701  -9.101   2.157
  860    HA   PHE 109           HA       PHE 109   7.979  -6.313   2.180
  861   1HB   PHE 109          2HB       PHE 109   6.220  -7.079   0.850
  862   2HB   PHE 109          1HB       PHE 109   5.645  -8.199   2.076
  863    HD1  PHE 109           1HD      PHE 109   6.080  -4.519   1.608
  864    HD2  PHE 109           2HD      PHE 109   3.680  -7.687   3.128
  865    HE1  PHE 109           1HE      PHE 109   4.368  -2.889   2.289
  866    HE2  PHE 109           2HE      PHE 109   1.962  -6.064   3.811
  867    HZ   PHE 109           HZ       PHE 109   2.306  -3.661   3.394
  868    H    LEU 110           H        LEU 110   6.863  -8.601   4.594
  869    HA   LEU 110           HA       LEU 110   5.765  -6.868   6.472
  870   1HB   LEU 110          2HB       LEU 110   6.287  -9.549   6.320
  871   2HB   LEU 110          1HB       LEU 110   7.315  -9.026   7.641
  872    HG   LEU 110           HG       LEU 110   4.331  -8.627   7.453
  873   1HD1  LEU 110          1HD1      LEU 110   4.351 -10.138   9.435
  874   2HD1  LEU 110          2HD1      LEU 110   6.054 -10.454   9.103
  875   3HD1  LEU 110          3HD1      LEU 110   4.826 -10.904   7.919
  876   1HD2  LEU 110          1HD2      LEU 110   5.708  -6.814   8.609
  877   2HD2  LEU 110          2HD2      LEU 110   6.075  -8.039   9.825
  878   3HD2  LEU 110          3HD2      LEU 110   4.403  -7.556   9.535
  879    H    LEU 111           H        LEU 111   9.123  -7.873   6.009
  880    HA   LEU 111           HA       LEU 111  10.269  -6.713   8.250
  881   1HB   LEU 111          2HB       LEU 111  11.313  -7.263   5.501
  882   2HB   LEU 111          1HB       LEU 111  12.320  -6.482   6.706
  883    HG   LEU 111           HG       LEU 111  11.335  -8.695   8.045
  884   1HD1  LEU 111          1HD1      LEU 111  11.999  -9.451   5.204
  885   2HD1  LEU 111          2HD1      LEU 111  10.443  -9.651   6.012
  886   3HD1  LEU 111          3HD1      LEU 111  11.842 -10.583   6.547
  887   1HD2  LEU 111          1HD2      LEU 111  13.685  -7.597   7.805
  888   2HD2  LEU 111          2HD2      LEU 111  13.921  -8.822   6.557
  889   3HD2  LEU 111          3HD2      LEU 111  13.551  -9.308   8.211
  890    H    THR 112           H        THR 112   9.726  -5.261   5.048
  891    HA   THR 112           HA       THR 112  10.880  -2.761   5.682
  892    HB   THR 112           HB       THR 112   8.794  -3.448   3.602
  893    HG1  THR 112           1HG      THR 112  10.501  -4.557   2.967
  894   1HG2  THR 112          1HG2      THR 112  10.427  -1.415   2.646
  895   2HG2  THR 112          2HG2      THR 112   9.999  -0.927   4.286
  896   3HG2  THR 112          3HG2      THR 112   8.731  -1.291   3.115
  897    H    ILE 113           H        ILE 113   7.568  -3.984   5.818
  898    HA   ILE 113           HA       ILE 113   6.105  -1.743   6.305
  899    HB   ILE 113           HB       ILE 113   5.876  -4.555   7.237
  900   1HG1  ILE 113          2HG1      ILE 113   5.033  -3.874   5.046
  901   2HG1  ILE 113          1HG1      ILE 113   3.709  -4.383   6.087
  902   1HG2  ILE 113          1HG2      ILE 113   4.417  -2.267   8.505
  903   2HG2  ILE 113          2HG2      ILE 113   5.184  -3.659   9.267
  904   3HG2  ILE 113          3HG2      ILE 113   3.674  -3.862   8.379
  905   1HD1  ILE 113          1HD1      ILE 113   4.446  -1.617   5.217
  906   2HD1  ILE 113          2HD1      ILE 113   3.399  -1.907   6.607
  907   3HD1  ILE 113          3HD1      ILE 113   2.923  -2.477   5.007
  908    H    LYS 114           H        LYS 114   7.744  -3.646   8.843
  909    HA   LYS 114           HA       LYS 114   7.103  -2.132  11.039
  910   1HB   LYS 114          2HB       LYS 114   8.356  -4.224  11.196
  911   2HB   LYS 114          1HB       LYS 114   9.749  -3.468  10.436
  912   1HG   LYS 114          2HG       LYS 114   8.720  -2.173  12.882
  913   2HG   LYS 114          1HG       LYS 114   9.490  -3.749  13.078
  914   1HD   LYS 114          2HD       LYS 114  11.522  -2.880  12.778
  915   2HD   LYS 114          1HD       LYS 114  11.017  -2.045  11.308
  916   1HE   LYS 114          2HE       LYS 114  10.512  -0.108  12.417
  917   2HE   LYS 114          1HE       LYS 114  10.135  -0.941  13.924
  918   1HZ   LYS 114          1HZ       LYS 114  12.207   0.383  13.997
  919   2HZ   LYS 114          2HZ       LYS 114  12.879  -0.647  12.834
  920   3HZ   LYS 114          3HZ       LYS 114  12.447  -1.253  14.353
  921    H    HIS 115           H        HIS 115  10.040  -1.755   9.061
  922    HA   HIS 115           HA       HIS 115  10.899   0.630  10.250
  923   1HB   HIS 115          2HB       HIS 115  12.335  -0.806   8.852
  924   2HB   HIS 115          1HB       HIS 115  11.404  -0.343   7.432
  925    HD1  HIS 115           1HD      HIS 115  13.894   0.447   6.645
  926    HD2  HIS 115           2HD      HIS 115  12.046   2.698   9.608
  927    HE1  HIS 115           1HE      HIS 115  15.124   2.639   6.690
  928    HE2  HIS 115           2HE      HIS 115  13.936   4.016   8.433
  929    H    ALA 116           H        ALA 116   8.563   0.014   7.719
  930    HA   ALA 116           HA       ALA 116   8.431   2.576   6.590
  931   1HB   ALA 116          1HB       ALA 116   5.845   1.606   6.450
  932   2HB   ALA 116          2HB       ALA 116   6.838   0.151   6.537
  933   3HB   ALA 116          3HB       ALA 116   7.128   1.341   5.269
  934    H    PHE 117           H        PHE 117   6.842   1.187   9.415
  935    HA   PHE 117           HA       PHE 117   5.145   3.405   9.926
  936   1HB   PHE 117          2HB       PHE 117   6.015   0.994  11.463
  937   2HB   PHE 117          1HB       PHE 117   5.203   2.303  12.318
  938    HD1  PHE 117           1HD      PHE 117   2.879   2.746  11.984
  939    HD2  PHE 117           2HD      PHE 117   4.847  -0.281   9.736
  940    HE1  PHE 117           1HE      PHE 117   0.699   1.876  11.258
  941    HE2  PHE 117           2HE      PHE 117   2.671  -1.156   9.002
  942    HZ   PHE 117           HZ       PHE 117   0.594  -0.079   9.764
  943    H    GLU 118           H        GLU 118   8.489   2.944  10.352
  944    HA   GLU 118           HA       GLU 118   9.101   4.303  12.670
  945   1HB   GLU 118          2HB       GLU 118  10.629   3.131  10.953
  946   2HB   GLU 118          1HB       GLU 118  10.704   4.705  10.173
  947   1HG   GLU 118          2HG       GLU 118  11.201   4.847  13.028
  948   2HG   GLU 118          1HG       GLU 118  12.341   3.799  12.186
  949    H    GLU 119           H        GLU 119   7.866   5.563   9.687
  950    HA   GLU 119           HA       GLU 119   8.484   8.313  10.454
  951   1HB   GLU 119          2HB       GLU 119   6.995   7.420   7.990
  952   2HB   GLU 119          1HB       GLU 119   7.828   8.945   8.257
  953   1HG   GLU 119          2HG       GLU 119   9.542   8.058   7.170
  954   2HG   GLU 119          1HG       GLU 119   9.812   7.061   8.600
  955    H    TYR 120           H        TYR 120   6.716   6.995  12.171
  956    HA   TYR 120           HA       TYR 120   4.524   8.815  12.154
  957   1HB   TYR 120          2HB       TYR 120   3.875   6.956  10.491
  958   2HB   TYR 120          1HB       TYR 120   3.713   5.927  11.909
  959    HD1  TYR 120           1HD      TYR 120   1.827   6.106  13.352
  960    HD2  TYR 120           2HD      TYR 120   2.395   8.941  10.231
  961    HE1  TYR 120           1HE      TYR 120  -0.458   6.945  13.706
  962    HE2  TYR 120           2HE      TYR 120   0.113   9.788  10.577
  963    HH   TYR 120           HH       TYR 120  -2.177   8.154  12.543
  964    H    SER 121           H        SER 121   6.673   7.971  13.904
  965    HA   SER 121           HA       SER 121   5.283   6.613  16.089
  966   1HB   SER 121          2HB       SER 121   7.608   5.926  15.429
  967   2HB   SER 121          1HB       SER 121   8.172   7.503  15.981
  968    HG   SER 121           HG       SER 121   6.746   5.669  17.608
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  -1.222   0.830  17.133
    2   2H    MET   1          2HT       MET   1  -2.106   1.638  18.362
    3   3H    MET   1          3HT       MET   1  -0.719   2.376  17.674
    4    HA   MET   1           HA       MET   1  -3.327   1.863  16.425
    5   1HB   MET   1          2HB       MET   1  -1.714   4.271  17.232
    6   2HB   MET   1          1HB       MET   1  -2.972   4.396  16.010
    7   1HG   MET   1          2HG       MET   1  -4.631   4.246  17.511
    8   2HG   MET   1          1HG       MET   1  -3.781   3.053  18.490
    9   1HE   MET   1          1HE       MET   1  -4.869   4.854  20.870
   10   2HE   MET   1          2HE       MET   1  -3.222   4.840  21.503
   11   3HE   MET   1          3HE       MET   1  -3.828   3.458  20.591
   12    H    LYS   2           H        LYS   2  -1.540   0.349  15.226
   13    HA   LYS   2           HA       LYS   2  -0.463   1.911  12.982
   14   1HB   LYS   2          2HB       LYS   2   0.495  -0.433  14.446
   15   2HB   LYS   2          1HB       LYS   2   0.619  -0.575  12.699
   16   1HG   LYS   2          2HG       LYS   2   2.666   0.308  13.707
   17   2HG   LYS   2          1HG       LYS   2   1.925   1.455  12.589
   18   1HD   LYS   2          2HD       LYS   2   0.759   2.142  14.964
   19   2HD   LYS   2          1HD       LYS   2   2.375   1.657  15.478
   20   1HE   LYS   2          2HE       LYS   2   3.340   3.450  14.533
   21   2HE   LYS   2          1HE       LYS   2   2.337   3.347  13.088
   22   1HZ   LYS   2          1HZ       LYS   2   2.029   5.376  14.518
   23   2HZ   LYS   2          2HZ       LYS   2   1.303   4.369  15.667
   24   3HZ   LYS   2          3HZ       LYS   2   0.615   4.532  14.130
   25    H    ARG   3           H        ARG   3  -1.153   1.557  10.948
   26    HA   ARG   3           HA       ARG   3  -2.742  -0.816  10.348
   27   1HB   ARG   3          2HB       ARG   3  -3.794   1.899   9.589
   28   2HB   ARG   3          1HB       ARG   3  -4.632   0.354   9.553
   29   1HG   ARG   3          2HG       ARG   3  -5.564   1.242  11.422
   30   2HG   ARG   3          1HG       ARG   3  -4.169   0.446  12.153
   31   1HD   ARG   3          2HD       ARG   3  -3.043   2.430  12.488
   32   2HD   ARG   3          1HD       ARG   3  -3.914   3.262  11.199
   33    HE   ARG   3           HE       ARG   3  -5.771   2.637  13.163
   34   1HH1  ARG   3          1HH1      ARG   3  -2.904   4.600  12.848
   35   2HH1  ARG   3          2HH1      ARG   3  -3.417   5.761  14.026
   36   1HH2  ARG   3          1HH2      ARG   3  -6.448   4.161  14.714
   37   2HH2  ARG   3          2HH2      ARG   3  -5.428   5.511  15.086
   38    H    VAL   4           H        VAL   4  -2.881  -1.294   8.111
   39    HA   VAL   4           HA       VAL   4  -1.217   0.369   6.351
   40    HB   VAL   4           HB       VAL   4  -1.070  -2.649   6.403
   41   1HG1  VAL   4          1HG1      VAL   4   0.004  -0.534   4.648
   42   2HG1  VAL   4          2HG1      VAL   4  -0.410  -2.210   4.286
   43   3HG1  VAL   4          3HG1      VAL   4   1.120  -1.832   5.078
   44   1HG2  VAL   4          1HG2      VAL   4   0.889  -0.612   7.476
   45   2HG2  VAL   4          2HG2      VAL   4   1.206  -2.340   7.318
   46   3HG2  VAL   4          3HG2      VAL   4  -0.044  -1.770   8.424
   47    H    LEU   5           H        LEU   5  -1.859   0.445   4.208
   48    HA   LEU   5           HA       LEU   5  -4.495  -0.728   3.656
   49   1HB   LEU   5          2HB       LEU   5  -4.330   1.739   3.606
   50   2HB   LEU   5          1HB       LEU   5  -3.132   1.618   2.333
   51    HG   LEU   5           HG       LEU   5  -4.815   0.589   0.854
   52   1HD1  LEU   5          1HD1      LEU   5  -6.738  -0.216   1.609
   53   2HD1  LEU   5          2HD1      LEU   5  -7.163   1.337   2.328
   54   3HD1  LEU   5          3HD1      LEU   5  -6.210   0.171   3.246
   55   1HD2  LEU   5          1HD2      LEU   5  -6.409   2.729   0.984
   56   2HD2  LEU   5          2HD2      LEU   5  -4.765   2.798   0.349
   57   3HD2  LEU   5          3HD2      LEU   5  -5.091   3.299   2.009
   58    H    VAL   6           H        VAL   6  -4.734  -2.198   2.091
   59    HA   VAL   6           HA       VAL   6  -2.451  -2.636   0.269
   60    HB   VAL   6           HB       VAL   6  -4.428  -4.739   1.134
   61   1HG1  VAL   6          1HG1      VAL   6  -3.420  -5.336  -0.917
   62   2HG1  VAL   6          2HG1      VAL   6  -2.562  -6.241   0.330
   63   3HG1  VAL   6          3HG1      VAL   6  -1.828  -4.801  -0.376
   64   1HG2  VAL   6          1HG2      VAL   6  -3.287  -5.153   3.000
   65   2HG2  VAL   6          2HG2      VAL   6  -2.538  -3.572   2.774
   66   3HG2  VAL   6          3HG2      VAL   6  -1.734  -5.021   2.174
   67    H    VAL   7           H        VAL   7  -3.213  -1.412  -1.463
   68    HA   VAL   7           HA       VAL   7  -5.869  -1.879  -2.510
   69    HB   VAL   7           HB       VAL   7  -3.595  -0.326  -3.765
   70   1HG1  VAL   7          1HG1      VAL   7  -5.884  -1.160  -4.960
   71   2HG1  VAL   7          2HG1      VAL   7  -4.996   0.297  -5.409
   72   3HG1  VAL   7          3HG1      VAL   7  -6.383   0.410  -4.326
   73   1HG2  VAL   7          1HG2      VAL   7  -5.520   0.360  -1.629
   74   2HG2  VAL   7          2HG2      VAL   7  -5.252   1.580  -2.873
   75   3HG2  VAL   7          3HG2      VAL   7  -3.893   0.967  -1.931
   76    H    ASP   8           H        ASP   8  -6.356  -3.558  -3.775
   77    HA   ASP   8           HA       ASP   8  -4.524  -4.397  -5.850
   78   1HB   ASP   8          2HB       ASP   8  -3.681  -5.693  -3.970
   79   2HB   ASP   8          1HB       ASP   8  -5.301  -6.275  -3.605
   80    H    ASP   9           H        ASP   9  -5.498  -5.676  -7.455
   81    HA   ASP   9           HA       ASP   9  -8.396  -5.430  -7.518
   82   1HB   ASP   9          2HB       ASP   9  -7.146  -4.658  -9.465
   83   2HB   ASP   9          1HB       ASP   9  -6.422  -6.249  -9.665
   84    H    GLU  10           H        GLU  10  -7.835  -7.228  -5.663
   85    HA   GLU  10           HA       GLU  10  -8.025  -9.883  -6.891
   86   1HB   GLU  10          2HB       GLU  10  -6.568  -9.003  -4.733
   87   2HB   GLU  10          1HB       GLU  10  -7.966  -9.737  -3.959
   88   1HG   GLU  10          2HG       GLU  10  -7.254 -11.586  -5.872
   89   2HG   GLU  10          1HG       GLU  10  -5.706 -10.975  -5.291
   90    H    GLU  11           H        GLU  11  -9.354 -11.228  -4.852
   91    HA   GLU  11           HA       GLU  11 -12.078 -10.247  -5.274
   92   1HB   GLU  11          2HB       GLU  11 -10.931 -12.789  -5.415
   93   2HB   GLU  11          1HB       GLU  11 -11.882 -12.816  -3.936
   94   1HG   GLU  11          2HG       GLU  11 -13.204 -11.670  -6.309
   95   2HG   GLU  11          1HG       GLU  11 -12.869 -13.400  -6.357
   96    H    SER  12           H        SER  12 -10.447 -11.959  -2.600
   97    HA   SER  12           HA       SER  12 -11.687 -10.048  -0.736
   98   1HB   SER  12          2HB       SER  12 -11.396 -13.006  -0.181
   99   2HB   SER  12          1HB       SER  12 -12.251 -11.810   0.794
  100    HG   SER  12           HG       SER  12 -13.929 -12.306  -0.352
  101    H    ILE  13           H        ILE  13  -9.981  -8.908  -0.032
  102    HA   ILE  13           HA       ILE  13  -7.995  -8.354   0.907
  103    HB   ILE  13           HB       ILE  13  -8.199 -11.113   2.038
  104   1HG1  ILE  13          2HG1      ILE  13 -10.216  -9.662   2.395
  105   2HG1  ILE  13          1HG1      ILE  13  -9.436 -10.220   3.871
  106   1HG2  ILE  13          1HG2      ILE  13  -6.028 -10.388   2.514
  107   2HG2  ILE  13          2HG2      ILE  13  -6.942 -10.022   3.977
  108   3HG2  ILE  13          3HG2      ILE  13  -6.562  -8.738   2.830
  109   1HD1  ILE  13          1HD1      ILE  13  -8.255  -8.006   3.953
  110   2HD1  ILE  13          2HD1      ILE  13 -10.000  -7.952   4.196
  111   3HD1  ILE  13          3HD1      ILE  13  -9.313  -7.485   2.642
  112    H    THR  14           H        THR  14  -5.658  -9.030   1.099
  113    HA   THR  14           HA       THR  14  -4.860 -10.313  -1.384
  114    HB   THR  14           HB       THR  14  -2.596  -9.438  -0.809
  115    HG1  THR  14           1HG      THR  14  -3.905  -8.152   1.347
  116   1HG2  THR  14          1HG2      THR  14  -2.990  -7.303  -1.492
  117   2HG2  THR  14          2HG2      THR  14  -4.399  -7.108  -0.450
  118   3HG2  THR  14          3HG2      THR  14  -4.524  -8.050  -1.936
  119    H    SER  15           H        SER  15  -4.043 -12.299  -1.507
  120    HA   SER  15           HA       SER  15  -4.154 -14.094   0.621
  121   1HB   SER  15          2HB       SER  15  -4.284 -14.995  -1.559
  122   2HB   SER  15          1HB       SER  15  -2.781 -14.219  -2.058
  123    HG   SER  15           HG       SER  15  -3.167 -16.614  -0.845
  124    H    SER  16           H        SER  16  -2.730 -14.892   2.056
  125    HA   SER  16           HA       SER  16  -0.814 -15.220   3.244
  126   1HB   SER  16          2HB       SER  16   0.731 -13.654   1.185
  127   2HB   SER  16          1HB       SER  16   1.317 -14.915   2.269
  128    HG   SER  16           HG       SER  16   1.022 -15.725   0.169
  129    H    LEU  17           H        LEU  17  -2.244 -12.304   2.689
  130    HA   LEU  17           HA       LEU  17  -0.342 -10.712   4.216
  131   1HB   LEU  17          2HB       LEU  17  -2.297 -10.158   2.276
  132   2HB   LEU  17          1HB       LEU  17  -2.921  -9.463   3.753
  133    HG   LEU  17           HG       LEU  17  -0.798  -8.515   1.998
  134   1HD1  LEU  17          1HD1      LEU  17  -2.391  -6.956   2.261
  135   2HD1  LEU  17          2HD1      LEU  17  -1.370  -6.478   3.618
  136   3HD1  LEU  17          3HD1      LEU  17  -2.798  -7.477   3.894
  137   1HD2  LEU  17          1HD2      LEU  17   0.424  -7.472   4.029
  138   2HD2  LEU  17          2HD2      LEU  17   0.845  -9.109   3.525
  139   3HD2  LEU  17          3HD2      LEU  17  -0.211  -8.858   4.915
  140    H    SER  18           H        SER  18  -3.755 -11.700   4.494
  141    HA   SER  18           HA       SER  18  -4.421 -10.674   6.927
  142   1HB   SER  18          2HB       SER  18  -5.286 -12.979   5.339
  143   2HB   SER  18          1HB       SER  18  -5.565 -13.182   7.068
  144    HG   SER  18           HG       SER  18  -6.315 -10.830   5.692
  145    H    ALA  19           H        ALA  19  -3.033 -13.930   6.480
  146    HA   ALA  19           HA       ALA  19  -2.683 -14.629   9.120
  147   1HB   ALA  19          1HB       ALA  19  -1.322 -15.359   6.586
  148   2HB   ALA  19          2HB       ALA  19  -2.200 -16.371   7.733
  149   3HB   ALA  19          3HB       ALA  19  -0.558 -15.843   8.101
  150    H    ILE  20           H        ILE  20  -0.613 -12.649   7.075
  151    HA   ILE  20           HA       ILE  20   1.532 -12.410   8.912
  152    HB   ILE  20           HB       ILE  20   0.711 -10.734   6.536
  153   1HG1  ILE  20          2HG1      ILE  20   2.984 -12.680   6.974
  154   2HG1  ILE  20          1HG1      ILE  20   1.514 -13.006   6.061
  155   1HG2  ILE  20          1HG2      ILE  20   3.368 -10.167   7.018
  156   2HG2  ILE  20          2HG2      ILE  20   2.643 -10.130   8.625
  157   3HG2  ILE  20          3HG2      ILE  20   2.002  -9.102   7.344
  158   1HD1  ILE  20          1HD1      ILE  20   3.847 -12.153   4.990
  159   2HD1  ILE  20          2HD1      ILE  20   2.983 -10.629   5.193
  160   3HD1  ILE  20          3HD1      ILE  20   2.263 -11.931   4.250
  161    H    LEU  21           H        LEU  21  -0.631  -9.776   7.858
  162    HA   LEU  21           HA       LEU  21  -0.076  -8.007   9.885
  163   1HB   LEU  21          2HB       LEU  21  -2.786  -8.403   8.631
  164   2HB   LEU  21          1HB       LEU  21  -2.167  -6.932   9.364
  165    HG   LEU  21           HG       LEU  21  -0.446  -7.910   7.230
  166   1HD1  LEU  21          1HD1      LEU  21  -1.988  -8.493   5.747
  167   2HD1  LEU  21          2HD1      LEU  21  -2.455  -6.792   5.703
  168   3HD1  LEU  21          3HD1      LEU  21  -3.303  -7.913   6.769
  169   1HD2  LEU  21          1HD2      LEU  21  -1.650  -5.374   8.176
  170   2HD2  LEU  21          2HD2      LEU  21  -1.127  -5.456   6.495
  171   3HD2  LEU  21          3HD2      LEU  21   0.026  -5.764   7.794
  172    H    GLU  22           H        GLU  22  -2.116 -10.834   9.978
  173    HA   GLU  22           HA       GLU  22  -3.417 -10.178  12.438
  174   1HB   GLU  22          2HB       GLU  22  -3.201 -12.659  10.779
  175   2HB   GLU  22          1HB       GLU  22  -3.887 -12.728  12.395
  176   1HG   GLU  22          2HG       GLU  22  -5.267 -10.653  11.367
  177   2HG   GLU  22          1HG       GLU  22  -4.994 -11.612   9.915
  178    H    GLU  23           H        GLU  23  -0.416 -11.684  11.540
  179    HA   GLU  23           HA       GLU  23   0.038 -12.843  14.145
  180   1HB   GLU  23          2HB       GLU  23   1.016 -14.055  12.377
  181   2HB   GLU  23          1HB       GLU  23   1.655 -12.605  11.619
  182   1HG   GLU  23          2HG       GLU  23   3.544 -12.700  12.779
  183   2HG   GLU  23          1HG       GLU  23   2.703 -13.026  14.293
  184    H    GLU  24           H        GLU  24   0.946  -9.969  12.356
  185    HA   GLU  24           HA       GLU  24   2.824  -9.072  14.346
  186   1HB   GLU  24          2HB       GLU  24   1.723  -7.909  11.817
  187   2HB   GLU  24          1HB       GLU  24   2.639  -6.908  12.936
  188   1HG   GLU  24          2HG       GLU  24   3.781  -9.503  12.019
  189   2HG   GLU  24          1HG       GLU  24   3.824  -8.102  10.949
  190    H    GLY  25           H        GLY  25  -0.523  -8.462  13.498
  191   1HA   GLY  25          2HA       GLY  25  -2.158  -7.728  15.028
  192   2HA   GLY  25          1HA       GLY  25  -0.877  -7.098  16.052
  193    H    TYR  26           H        TYR  26  -1.815  -6.582  12.659
  194    HA   TYR  26           HA       TYR  26  -1.723  -3.681  13.170
  195   1HB   TYR  26          2HB       TYR  26  -1.112  -5.327  10.732
  196   2HB   TYR  26          1HB       TYR  26  -1.517  -3.627  10.585
  197    HD1  TYR  26           1HD      TYR  26   1.118  -5.367  10.058
  198    HD2  TYR  26           2HD      TYR  26  -0.117  -2.575  13.020
  199    HE1  TYR  26           1HE      TYR  26   3.466  -4.773  10.466
  200    HE2  TYR  26           2HE      TYR  26   2.228  -1.971  13.435
  201    HH   TYR  26           HH       TYR  26   4.842  -3.797  12.220
  202    H    HIS  27           H        HIS  27  -2.997  -2.616  11.168
  203    HA   HIS  27           HA       HIS  27  -5.694  -3.795  11.142
  204   1HB   HIS  27          2HB       HIS  27  -4.965  -1.371  12.293
  205   2HB   HIS  27          1HB       HIS  27  -5.607  -0.902  10.723
  206    HD1  HIS  27           1HD      HIS  27  -8.076  -2.131  10.229
  207    HD2  HIS  27           2HD      HIS  27  -6.888  -1.579  14.173
  208    HE1  HIS  27           1HE      HIS  27 -10.183  -2.275  11.592
  209    HE2  HIS  27           2HE      HIS  27  -9.453  -1.842  13.964
  210    HA   PRO  28           HA       PRO  28  -4.191  -3.370   6.836
  211   1HB   PRO  28          2HB       PRO  28  -4.825  -5.836   5.998
  212   2HB   PRO  28          1HB       PRO  28  -3.366  -5.508   6.937
  213   1HG   PRO  28          2HG       PRO  28  -5.963  -6.676   7.820
  214   2HG   PRO  28          1HG       PRO  28  -4.315  -7.106   8.309
  215   1HD   PRO  28          2HD       PRO  28  -6.041  -5.499   9.765
  216   2HD   PRO  28          1HD       PRO  28  -4.278  -5.521   9.948
  217    H    ASP  29           H        ASP  29  -5.382  -2.415   5.373
  218    HA   ASP  29           HA       ASP  29  -8.193  -3.212   5.047
  219   1HB   ASP  29          2HB       ASP  29  -7.123  -0.652   5.698
  220   2HB   ASP  29          1HB       ASP  29  -7.818  -0.574   4.083
  221    H    THR  30           H        THR  30  -8.392  -4.250   3.163
  222    HA   THR  30           HA       THR  30  -6.464  -3.677   1.053
  223    HB   THR  30           HB       THR  30  -7.121  -5.744   0.053
  224    HG1  THR  30           1HG      THR  30  -9.201  -6.071   0.173
  225   1HG2  THR  30          1HG2      THR  30  -6.361  -7.230   1.579
  226   2HG2  THR  30          2HG2      THR  30  -7.375  -6.594   2.873
  227   3HG2  THR  30          3HG2      THR  30  -5.906  -5.738   2.403
  228    H    ALA  31           H        ALA  31  -6.932  -2.589  -0.734
  229    HA   ALA  31           HA       ALA  31  -9.704  -1.739  -1.163
  230   1HB   ALA  31          1HB       ALA  31  -7.472  -0.237  -1.098
  231   2HB   ALA  31          2HB       ALA  31  -8.911   0.197  -2.020
  232   3HB   ALA  31          3HB       ALA  31  -7.553  -0.588  -2.824
  233    H    LYS  32           H        LYS  32 -10.437  -1.586  -3.455
  234    HA   LYS  32           HA       LYS  32  -9.462  -3.913  -4.966
  235   1HB   LYS  32          2HB       LYS  32 -12.117  -2.842  -5.662
  236   2HB   LYS  32          1HB       LYS  32 -11.584  -4.508  -5.486
  237   1HG   LYS  32          2HG       LYS  32 -11.918  -4.486  -3.167
  238   2HG   LYS  32          1HG       LYS  32 -12.013  -2.726  -3.118
  239   1HD   LYS  32          2HD       LYS  32 -14.086  -2.962  -4.585
  240   2HD   LYS  32          1HD       LYS  32 -14.039  -4.678  -4.178
  241   1HE   LYS  32          2HE       LYS  32 -14.505  -4.295  -1.942
  242   2HE   LYS  32          1HE       LYS  32 -13.941  -2.625  -2.007
  243   1HZ   LYS  32          1HZ       LYS  32 -16.500  -3.740  -2.970
  244   2HZ   LYS  32          2HZ       LYS  32 -15.918  -2.263  -3.554
  245   3HZ   LYS  32          3HZ       LYS  32 -16.241  -2.452  -1.905
  246    H    THR  33           H        THR  33  -9.551  -0.578  -4.970
  247    HA   THR  33           HA       THR  33  -8.394  -0.364  -7.534
  248    HB   THR  33           HB       THR  33 -10.681   1.338  -7.819
  249    HG1  THR  33           1HG      THR  33 -11.710  -0.272  -6.506
  250   1HG2  THR  33          1HG2      THR  33  -9.464   0.655  -9.735
  251   2HG2  THR  33          2HG2      THR  33 -11.078  -0.046  -9.855
  252   3HG2  THR  33          3HG2      THR  33  -9.715  -1.051  -9.363
  253    H    LEU  34           H        LEU  34  -7.621   1.785  -7.946
  254    HA   LEU  34           HA       LEU  34  -6.774   3.179  -5.714
  255   1HB   LEU  34          2HB       LEU  34  -7.198   4.242  -8.509
  256   2HB   LEU  34          1HB       LEU  34  -6.256   5.041  -7.263
  257    HG   LEU  34           HG       LEU  34  -5.550   2.258  -8.114
  258   1HD1  LEU  34          1HD1      LEU  34  -4.411   4.691  -9.449
  259   2HD1  LEU  34          2HD1      LEU  34  -5.787   3.813 -10.118
  260   3HD1  LEU  34          3HD1      LEU  34  -4.238   2.996  -9.906
  261   1HD2  LEU  34          1HD2      LEU  34  -4.581   3.611  -6.105
  262   2HD2  LEU  34          2HD2      LEU  34  -3.655   4.438  -7.358
  263   3HD2  LEU  34          3HD2      LEU  34  -3.501   2.692  -7.154
  264    H    ARG  35           H        ARG  35  -9.800   3.356  -7.390
  265    HA   ARG  35           HA       ARG  35 -10.630   5.866  -6.296
  266   1HB   ARG  35          2HB       ARG  35 -11.882   3.687  -7.880
  267   2HB   ARG  35          1HB       ARG  35 -12.966   4.694  -6.930
  268   1HG   ARG  35          2HG       ARG  35 -12.519   6.580  -8.161
  269   2HG   ARG  35          1HG       ARG  35 -10.938   5.995  -8.682
  270   1HD   ARG  35          2HD       ARG  35 -13.031   4.251  -9.621
  271   2HD   ARG  35          1HD       ARG  35 -13.342   5.914 -10.110
  272    HE   ARG  35           HE       ARG  35 -11.412   5.885 -11.409
  273   1HH1  ARG  35          1HH1      ARG  35 -11.777   2.878  -9.664
  274   2HH1  ARG  35          2HH1      ARG  35 -10.603   2.041 -10.622
  275   1HH2  ARG  35          1HH2      ARG  35  -9.871   4.780 -12.662
  276   2HH2  ARG  35          2HH2      ARG  35  -9.521   3.117 -12.321
  277    H    GLU  36           H        GLU  36 -11.148   2.458  -5.502
  278    HA   GLU  36           HA       GLU  36 -12.875   2.897  -3.304
  279   1HB   GLU  36          2HB       GLU  36 -11.492   0.637  -4.524
  280   2HB   GLU  36          1HB       GLU  36 -11.525   0.517  -2.771
  281   1HG   GLU  36          2HG       GLU  36 -13.445  -0.588  -3.408
  282   2HG   GLU  36          1HG       GLU  36 -14.036   1.021  -2.996
  283    H    ALA  37           H        ALA  37  -9.389   2.782  -3.680
  284    HA   ALA  37           HA       ALA  37  -8.809   2.763  -0.881
  285   1HB   ALA  37          1HB       ALA  37  -6.543   3.738  -1.994
  286   2HB   ALA  37          2HB       ALA  37  -7.274   2.944  -3.389
  287   3HB   ALA  37          3HB       ALA  37  -6.947   2.022  -1.922
  288    H    GLU  38           H        GLU  38  -8.781   5.292  -3.393
  289    HA   GLU  38           HA       GLU  38  -7.928   7.439  -1.929
  290   1HB   GLU  38          2HB       GLU  38  -9.015   7.112  -4.410
  291   2HB   GLU  38          1HB       GLU  38 -10.251   8.063  -3.599
  292   1HG   GLU  38          2HG       GLU  38  -8.585   9.748  -3.029
  293   2HG   GLU  38          1HG       GLU  38  -7.342   8.793  -3.834
  294    H    LYS  39           H        LYS  39 -11.245   6.182  -2.118
  295    HA   LYS  39           HA       LYS  39 -12.432   8.056  -0.410
  296   1HB   LYS  39          2HB       LYS  39 -13.754   6.506  -1.762
  297   2HB   LYS  39          1HB       LYS  39 -13.128   5.143  -0.844
  298   1HG   LYS  39          2HG       LYS  39 -14.500   7.283   0.673
  299   2HG   LYS  39          1HG       LYS  39 -15.492   6.239  -0.347
  300   1HD   LYS  39          2HD       LYS  39 -13.501   4.862   1.332
  301   2HD   LYS  39          1HD       LYS  39 -14.812   5.659   2.204
  302   1HE   LYS  39          2HE       LYS  39 -16.405   4.477   0.647
  303   2HE   LYS  39          1HE       LYS  39 -15.025   3.536   0.080
  304   1HZ   LYS  39          1HZ       LYS  39 -16.006   3.649   2.882
  305   2HZ   LYS  39          2HZ       LYS  39 -14.684   2.744   2.337
  306   3HZ   LYS  39          3HZ       LYS  39 -16.244   2.366   1.803
  307    H    LYS  40           H        LYS  40 -11.200   4.787   0.319
  308    HA   LYS  40           HA       LYS  40 -11.516   4.922   3.091
  309   1HB   LYS  40          2HB       LYS  40  -9.426   3.404   1.521
  310   2HB   LYS  40          1HB       LYS  40  -9.865   3.100   3.196
  311   1HG   LYS  40          2HG       LYS  40 -12.022   3.020   1.160
  312   2HG   LYS  40          1HG       LYS  40 -10.871   1.682   1.216
  313   1HD   LYS  40          2HD       LYS  40 -11.355   1.542   3.696
  314   2HD   LYS  40          1HD       LYS  40 -12.691   2.658   3.408
  315   1HE   LYS  40          2HE       LYS  40 -13.590   1.048   1.738
  316   2HE   LYS  40          1HE       LYS  40 -12.319  -0.081   2.203
  317   1HZ   LYS  40          1HZ       LYS  40 -14.742   0.669   3.619
  318   2HZ   LYS  40          2HZ       LYS  40 -13.363   0.482   4.579
  319   3HZ   LYS  40          3HZ       LYS  40 -13.902  -0.798   3.613
  320    H    ILE  41           H        ILE  41  -9.113   6.325   1.008
  321    HA   ILE  41           HA       ILE  41  -7.329   6.943   3.227
  322    HB   ILE  41           HB       ILE  41  -7.109   7.742   0.329
  323   1HG1  ILE  41          2HG1      ILE  41  -5.380   5.663   1.593
  324   2HG1  ILE  41          1HG1      ILE  41  -7.013   5.211   1.114
  325   1HG2  ILE  41          1HG2      ILE  41  -5.470   8.256   2.724
  326   2HG2  ILE  41          2HG2      ILE  41  -5.643   9.196   1.242
  327   3HG2  ILE  41          3HG2      ILE  41  -4.590   7.782   1.270
  328   1HD1  ILE  41          1HD1      ILE  41  -6.523   5.951  -1.173
  329   2HD1  ILE  41          2HD1      ILE  41  -5.438   4.671  -0.632
  330   3HD1  ILE  41          3HD1      ILE  41  -4.876   6.342  -0.676
  331    H    LYS  42           H        LYS  42 -10.027   8.328   1.712
  332    HA   LYS  42           HA       LYS  42  -9.251  11.054   2.432
  333   1HB   LYS  42          2HB       LYS  42 -11.480   9.913   0.779
  334   2HB   LYS  42          1HB       LYS  42 -11.519  11.578   1.344
  335   1HG   LYS  42          2HG       LYS  42  -9.489  12.080   0.153
  336   2HG   LYS  42          1HG       LYS  42  -9.312  10.390  -0.322
  337   1HD   LYS  42          2HD       LYS  42 -10.898  10.538  -1.937
  338   2HD   LYS  42          1HD       LYS  42 -11.869  11.695  -1.026
  339   1HE   LYS  42          2HE       LYS  42  -9.285  12.762  -1.861
  340   2HE   LYS  42          1HE       LYS  42 -10.303  12.268  -3.214
  341   1HZ   LYS  42          1HZ       LYS  42 -11.313  13.993  -1.031
  342   2HZ   LYS  42          2HZ       LYS  42 -11.990  13.736  -2.559
  343   3HZ   LYS  42          3HZ       LYS  42 -10.561  14.629  -2.405
  344    H    GLU  43           H        GLU  43 -10.018   8.792   4.305
  345    HA   GLU  43           HA       GLU  43 -11.909  10.366   5.882
  346   1HB   GLU  43          2HB       GLU  43 -12.209   7.400   5.390
  347   2HB   GLU  43          1HB       GLU  43 -13.196   8.362   6.481
  348   1HG   GLU  43          2HG       GLU  43 -14.051   9.648   4.609
  349   2HG   GLU  43          1HG       GLU  43 -13.024   8.741   3.500
  350    H    LEU  44           H        LEU  44  -9.924   7.405   5.893
  351    HA   LEU  44           HA       LEU  44  -9.296   7.884   8.710
  352   1HB   LEU  44          2HB       LEU  44  -9.913   5.675   8.529
  353   2HB   LEU  44          1HB       LEU  44  -9.262   5.511   6.910
  354    HG   LEU  44           HG       LEU  44  -7.361   5.858   9.182
  355   1HD1  LEU  44          1HD1      LEU  44  -7.358   3.292   9.268
  356   2HD1  LEU  44          2HD1      LEU  44  -8.984   3.414   8.594
  357   3HD1  LEU  44          3HD1      LEU  44  -8.616   4.161  10.149
  358   1HD2  LEU  44          1HD2      LEU  44  -6.998   3.934   6.969
  359   2HD2  LEU  44          2HD2      LEU  44  -5.837   5.021   7.732
  360   3HD2  LEU  44          3HD2      LEU  44  -6.986   5.647   6.549
  361    H    PHE  45           H        PHE  45  -7.084   7.763   9.437
  362    HA   PHE  45           HA       PHE  45  -5.276   9.049   7.560
  363   1HB   PHE  45          2HB       PHE  45  -5.551   9.940   9.857
  364   2HB   PHE  45          1HB       PHE  45  -4.896   8.438  10.500
  365    HD1  PHE  45           1HD      PHE  45  -3.972  11.010   7.953
  366    HD2  PHE  45           2HD      PHE  45  -2.696   8.475  11.124
  367    HE1  PHE  45           1HE      PHE  45  -1.698  11.931   7.768
  368    HE2  PHE  45           2HE      PHE  45  -0.420   9.392  10.946
  369    HZ   PHE  45           HZ       PHE  45   0.081  11.122   9.267
  370    H    PHE  46           H        PHE  46  -5.001   7.120   6.229
  371    HA   PHE  46           HA       PHE  46  -3.835   4.749   7.224
  372   1HB   PHE  46          2HB       PHE  46  -4.212   5.951   4.518
  373   2HB   PHE  46          1HB       PHE  46  -3.100   4.596   4.690
  374    HD1  PHE  46           1HD      PHE  46  -6.338   5.433   3.892
  375    HD2  PHE  46           2HD      PHE  46  -4.149   2.629   6.224
  376    HE1  PHE  46           1HE      PHE  46  -8.241   3.880   3.802
  377    HE2  PHE  46           2HE      PHE  46  -6.050   1.067   6.137
  378    HZ   PHE  46           HZ       PHE  46  -8.102   1.695   4.928
  379    HA   PRO  47           HA       PRO  47   0.287   6.466   7.628
  380   1HB   PRO  47          2HB       PRO  47   1.251   4.099   8.822
  381   2HB   PRO  47          1HB       PRO  47   0.699   5.553   9.646
  382   1HG   PRO  47          2HG       PRO  47  -0.548   3.024   9.666
  383   2HG   PRO  47          1HG       PRO  47  -1.203   4.538  10.297
  384   1HD   PRO  47          2HD       PRO  47  -1.805   3.135   7.767
  385   2HD   PRO  47          1HD       PRO  47  -2.801   4.266   8.701
  386    H    VAL  48           H        VAL  48  -0.129   3.038   6.699
  387    HA   VAL  48           HA       VAL  48   2.062   3.398   4.763
  388    HB   VAL  48           HB       VAL  48   1.114   0.799   5.971
  389   1HG1  VAL  48          1HG1      VAL  48   3.071   1.522   3.895
  390   2HG1  VAL  48          2HG1      VAL  48   2.164   0.029   4.133
  391   3HG1  VAL  48          3HG1      VAL  48   3.617   0.339   5.083
  392   1HG2  VAL  48          1HG2      VAL  48   2.300   2.601   7.460
  393   2HG2  VAL  48          2HG2      VAL  48   3.744   2.030   6.627
  394   3HG2  VAL  48          3HG2      VAL  48   2.761   0.903   7.561
  395    H    ILE  49           H        ILE  49   1.546   3.303   2.683
  396    HA   ILE  49           HA       ILE  49  -1.008   2.039   1.920
  397    HB   ILE  49           HB       ILE  49   0.484   4.177   0.390
  398   1HG1  ILE  49          2HG1      ILE  49  -0.378   5.005   2.567
  399   2HG1  ILE  49          1HG1      ILE  49  -1.184   5.750   1.190
  400   1HG2  ILE  49          1HG2      ILE  49  -1.922   2.558  -0.117
  401   2HG2  ILE  49          2HG2      ILE  49  -0.805   3.323  -1.248
  402   3HG2  ILE  49          3HG2      ILE  49  -2.069   4.279  -0.474
  403   1HD1  ILE  49          1HD1      ILE  49  -2.240   3.716   3.111
  404   2HD1  ILE  49          2HD1      ILE  49  -2.980   3.955   1.528
  405   3HD1  ILE  49          3HD1      ILE  49  -2.904   5.291   2.677
  406    H    VAL  50           H        VAL  50  -0.873   0.252   0.706
  407    HA   VAL  50           HA       VAL  50   1.568  -0.154  -0.894
  408    HB   VAL  50           HB       VAL  50   0.121  -2.308   0.645
  409   1HG1  VAL  50          1HG1      VAL  50   2.701  -2.421  -0.916
  410   2HG1  VAL  50          2HG1      VAL  50   1.154  -3.074  -1.456
  411   3HG1  VAL  50          3HG1      VAL  50   1.949  -3.750  -0.035
  412   1HG2  VAL  50          1HG2      VAL  50   2.878  -1.847   1.368
  413   2HG2  VAL  50          2HG2      VAL  50   1.443  -1.907   2.390
  414   3HG2  VAL  50          3HG2      VAL  50   1.905  -0.398   1.603
  415    H    LEU  51           H        LEU  51   0.973   0.004  -2.926
  416    HA   LEU  51           HA       LEU  51  -1.641  -0.838  -3.835
  417   1HB   LEU  51          2HB       LEU  51  -0.624   1.186  -4.751
  418   2HB   LEU  51          1HB       LEU  51   0.733   0.253  -5.352
  419    HG   LEU  51           HG       LEU  51  -0.886  -0.995  -6.819
  420   1HD1  LEU  51          1HD1      LEU  51  -3.023  -0.763  -6.138
  421   2HD1  LEU  51          2HD1      LEU  51  -2.974   0.660  -7.179
  422   3HD1  LEU  51          3HD1      LEU  51  -2.741   0.831  -5.439
  423   1HD2  LEU  51          1HD2      LEU  51  -0.359   1.940  -7.094
  424   2HD2  LEU  51          2HD2      LEU  51  -1.247   1.057  -8.335
  425   3HD2  LEU  51          3HD2      LEU  51   0.404   0.587  -7.930
  426    H    ASP  52           H        ASP  52  -1.933  -2.348  -5.612
  427    HA   ASP  52           HA       ASP  52   0.207  -4.320  -5.949
  428   1HB   ASP  52          2HB       ASP  52  -1.937  -4.750  -4.221
  429   2HB   ASP  52          1HB       ASP  52  -2.385  -5.615  -5.688
  430    H    VAL  53           H        VAL  53   0.456  -3.618  -8.053
  431    HA   VAL  53           HA       VAL  53  -1.662  -3.348  -9.912
  432    HB   VAL  53           HB       VAL  53   1.250  -3.895 -10.505
  433   1HG1  VAL  53          1HG1      VAL  53   0.875  -3.092 -12.658
  434   2HG1  VAL  53          2HG1      VAL  53  -0.656  -2.338 -12.214
  435   3HG1  VAL  53          3HG1      VAL  53  -0.542  -4.093 -12.339
  436   1HG2  VAL  53          1HG2      VAL  53   1.472  -1.985  -9.282
  437   2HG2  VAL  53          2HG2      VAL  53  -0.172  -1.445  -9.620
  438   3HG2  VAL  53          3HG2      VAL  53   1.082  -1.272 -10.847
  439    H    TRP  54           H        TRP  54  -2.639  -5.507  -9.125
  440    HA   TRP  54           HA       TRP  54  -1.452  -7.906 -10.179
  441   1HB   TRP  54          2HB       TRP  54  -2.788  -8.057  -8.164
  442   2HB   TRP  54          1HB       TRP  54  -4.181  -7.363  -8.986
  443    HD1  TRP  54           HD       TRP  54  -5.917  -9.214  -9.280
  444    HE1  TRP  54           1HE      TRP  54  -5.885 -11.680 -10.019
  445    HE3  TRP  54           3HE      TRP  54  -0.873  -9.828  -9.841
  446    HZ2  TRP  54           2HZ      TRP  54  -3.974 -13.627 -10.744
  447    HZ3  TRP  54           3HZ      TRP  54  -0.025 -12.024 -10.560
  448    HH2  TRP  54           HH       TRP  54  -1.544 -13.883 -11.002
  449    H    MET  55           H        MET  55  -4.791  -6.857 -10.757
  450    HA   MET  55           HA       MET  55  -4.329  -6.836 -13.631
  451   1HB   MET  55          2HB       MET  55  -5.022  -9.191 -12.705
  452   2HB   MET  55          1HB       MET  55  -6.625  -8.474 -12.628
  453   1HG   MET  55          2HG       MET  55  -5.806  -7.796 -15.146
  454   2HG   MET  55          1HG       MET  55  -5.080  -9.388 -14.926
  455   1HE   MET  55          1HE       MET  55  -6.736 -11.574 -15.848
  456   2HE   MET  55          2HE       MET  55  -7.865 -11.802 -14.512
  457   3HE   MET  55          3HE       MET  55  -6.189 -11.361 -14.185
  458    HA   PRO  56           HA       PRO  56  -7.706  -3.952 -12.192
  459   1HB   PRO  56          2HB       PRO  56  -6.339  -1.722 -11.505
  460   2HB   PRO  56          1HB       PRO  56  -6.651  -3.034 -10.370
  461   1HG   PRO  56          2HG       PRO  56  -4.135  -2.224 -11.622
  462   2HG   PRO  56          1HG       PRO  56  -4.401  -3.241 -10.201
  463   1HD   PRO  56          2HD       PRO  56  -3.823  -4.041 -12.924
  464   2HD   PRO  56          1HD       PRO  56  -3.934  -5.045 -11.470
  465    H    ASP  57           H        ASP  57  -7.719  -1.338 -12.844
  466    HA   ASP  57           HA       ASP  57  -6.647  -1.096 -15.558
  467   1HB   ASP  57          2HB       ASP  57  -8.813  -0.297 -16.406
  468   2HB   ASP  57          1HB       ASP  57  -8.928  -1.953 -15.817
  469    H    GLY  58           H        GLY  58  -5.946   0.120 -12.994
  470   1HA   GLY  58          2HA       GLY  58  -6.762   2.913 -13.451
  471   2HA   GLY  58          1HA       GLY  58  -6.133   2.277 -11.939
  472    H    ASP  59           H        ASP  59  -3.837   1.491 -12.017
  473    HA   ASP  59           HA       ASP  59  -1.630   1.969 -12.297
  474   1HB   ASP  59          2HB       ASP  59  -2.765   1.756 -14.959
  475   2HB   ASP  59          1HB       ASP  59  -1.394   2.859 -14.940
  476    H    GLY  60           H        GLY  60  -3.437   4.071 -11.435
  477   1HA   GLY  60          2HA       GLY  60  -2.718   6.536 -12.665
  478   2HA   GLY  60          1HA       GLY  60  -3.507   6.345 -11.108
  479    H    VAL  61           H        VAL  61  -0.462   6.671 -12.769
  480    HA   VAL  61           HA       VAL  61   1.308   6.265 -10.656
  481    HB   VAL  61           HB       VAL  61   1.576   8.204 -12.959
  482   1HG1  VAL  61          1HG1      VAL  61   3.686   6.932 -11.228
  483   2HG1  VAL  61          2HG1      VAL  61   3.173   8.618 -11.157
  484   3HG1  VAL  61          3HG1      VAL  61   3.969   7.999 -12.603
  485   1HG2  VAL  61          1HG2      VAL  61   2.955   5.602 -13.023
  486   2HG2  VAL  61          2HG2      VAL  61   2.168   6.503 -14.318
  487   3HG2  VAL  61          3HG2      VAL  61   1.201   5.542 -13.199
  488    H    ASN  62           H        ASN  62  -0.502   9.125 -11.651
  489    HA   ASN  62           HA       ASN  62   0.712  10.943  -9.865
  490   1HB   ASN  62          2HB       ASN  62  -1.167  11.099 -11.900
  491   2HB   ASN  62          1HB       ASN  62  -2.079  11.543 -10.461
  492   1HD2  ASN  62          1HD2      ASN  62   1.113  12.157 -11.888
  493   2HD2  ASN  62          2HD2      ASN  62   1.116  13.854 -11.567
  494    H    PHE  63           H        PHE  63  -1.468   8.378  -9.310
  495    HA   PHE  63           HA       PHE  63  -3.066   9.295  -7.248
  496   1HB   PHE  63          2HB       PHE  63  -3.197   7.028  -8.314
  497   2HB   PHE  63          1HB       PHE  63  -1.800   6.552  -7.353
  498    HD1  PHE  63           1HD      PHE  63  -5.142   8.132  -6.884
  499    HD2  PHE  63           2HD      PHE  63  -2.200   5.458  -5.365
  500    HE1  PHE  63           1HE      PHE  63  -6.635   7.555  -5.022
  501    HE2  PHE  63           2HE      PHE  63  -3.693   4.877  -3.496
  502    HZ   PHE  63           HZ       PHE  63  -5.913   5.929  -3.322
  503    H    ILE  64           H        ILE  64   0.213   7.945  -7.049
  504    HA   ILE  64           HA       ILE  64   0.610   7.869  -4.343
  505    HB   ILE  64           HB       ILE  64   2.658   8.921  -6.296
  506   1HG1  ILE  64          2HG1      ILE  64   2.895   6.109  -5.673
  507   2HG1  ILE  64          1HG1      ILE  64   1.314   6.451  -6.368
  508   1HG2  ILE  64          1HG2      ILE  64   4.209   8.659  -4.696
  509   2HG2  ILE  64          2HG2      ILE  64   3.480   7.170  -4.094
  510   3HG2  ILE  64          3HG2      ILE  64   2.838   8.733  -3.589
  511   1HD1  ILE  64          1HD1      ILE  64   3.885   6.295  -7.641
  512   2HD1  ILE  64          2HD1      ILE  64   3.112   7.847  -7.963
  513   3HD1  ILE  64          3HD1      ILE  64   2.274   6.345  -8.356
  514    H    ASP  65           H        ASP  65   0.362  10.677  -6.389
  515    HA   ASP  65           HA       ASP  65   1.474  12.569  -4.606
  516   1HB   ASP  65          2HB       ASP  65   0.519  12.638  -7.195
  517   2HB   ASP  65          1HB       ASP  65  -0.685  13.578  -6.319
  518    H    PHE  66           H        PHE  66  -1.920  11.592  -5.224
  519    HA   PHE  66           HA       PHE  66  -3.149  13.284  -3.408
  520   1HB   PHE  66          2HB       PHE  66  -4.709  12.178  -4.677
  521   2HB   PHE  66          1HB       PHE  66  -3.813  10.666  -4.657
  522    HD1  PHE  66           1HD      PHE  66  -4.485   8.925  -3.278
  523    HD2  PHE  66           2HD      PHE  66  -5.923  12.856  -2.522
  524    HE1  PHE  66           1HE      PHE  66  -6.025   8.030  -1.581
  525    HE2  PHE  66           2HE      PHE  66  -7.467  11.970  -0.825
  526    HZ   PHE  66           HZ       PHE  66  -7.517   9.555  -0.351
  527    H    ILE  67           H        ILE  67  -1.639  10.129  -2.899
  528    HA   ILE  67           HA       ILE  67  -2.371   9.810  -0.198
  529    HB   ILE  67           HB       ILE  67  -0.119   8.687  -1.850
  530   1HG1  ILE  67          2HG1      ILE  67  -1.490   6.566  -1.013
  531   2HG1  ILE  67          1HG1      ILE  67  -2.765   7.766  -0.824
  532   1HG2  ILE  67          1HG2      ILE  67   0.859   8.832   0.319
  533   2HG2  ILE  67          2HG2      ILE  67   0.350   7.159   0.082
  534   3HG2  ILE  67          3HG2      ILE  67  -0.615   8.241   1.088
  535   1HD1  ILE  67          1HD1      ILE  67  -1.627   8.177  -3.366
  536   2HD1  ILE  67          2HD1      ILE  67  -3.228   7.557  -2.971
  537   3HD1  ILE  67          3HD1      ILE  67  -1.879   6.442  -3.181
  538    H    LYS  68           H        LYS  68   0.475  11.301  -1.715
  539    HA   LYS  68           HA       LYS  68   1.625  12.017   0.825
  540   1HB   LYS  68          2HB       LYS  68   3.459  12.819  -0.365
  541   2HB   LYS  68          1HB       LYS  68   2.879  11.491  -1.355
  542   1HG   LYS  68          2HG       LYS  68   2.790  12.858  -3.078
  543   2HG   LYS  68          1HG       LYS  68   1.545  13.792  -2.251
  544   1HD   LYS  68          2HD       LYS  68   3.138  15.266  -1.312
  545   2HD   LYS  68          1HD       LYS  68   4.480  14.211  -1.757
  546   1HE   LYS  68          2HE       LYS  68   4.663  15.723  -3.443
  547   2HE   LYS  68          1HE       LYS  68   3.491  14.636  -4.188
  548   1HZ   LYS  68          1HZ       LYS  68   1.726  16.084  -3.609
  549   2HZ   LYS  68          2HZ       LYS  68   2.926  17.047  -4.312
  550   3HZ   LYS  68          3HZ       LYS  68   2.721  17.040  -2.632
  551    H    GLU  69           H        GLU  69  -0.696  13.362  -1.267
  552    HA   GLU  69           HA       GLU  69  -0.289  16.115  -0.677
  553   1HB   GLU  69          2HB       GLU  69  -1.568  15.078  -2.642
  554   2HB   GLU  69          1HB       GLU  69  -2.902  14.901  -1.511
  555   1HG   GLU  69          2HG       GLU  69  -2.331  17.483  -1.108
  556   2HG   GLU  69          1HG       GLU  69  -1.800  17.321  -2.781
  557    H    ASN  70           H        ASN  70  -2.480  13.631   0.576
  558    HA   ASN  70           HA       ASN  70  -3.149  15.440   2.802
  559   1HB   ASN  70          2HB       ASN  70  -4.758  13.023   1.993
  560   2HB   ASN  70          1HB       ASN  70  -5.259  14.384   2.994
  561   1HD2  ASN  70          1HD2      ASN  70  -4.159  13.596  -0.273
  562   2HD2  ASN  70          2HD2      ASN  70  -5.119  14.783  -1.074
  563    H    SER  71           H        SER  71  -1.023  13.138   2.209
  564    HA   SER  71           HA       SER  71  -0.909  12.301   4.965
  565   1HB   SER  71          2HB       SER  71  -1.961  10.538   2.899
  566   2HB   SER  71          1HB       SER  71  -0.547   9.847   3.693
  567    HG   SER  71           HG       SER  71  -1.601   9.787   5.565
  568    HA   PRO  72           HA       PRO  72   3.121  12.907   2.639
  569   1HB   PRO  72          2HB       PRO  72   3.708  14.818   4.781
  570   2HB   PRO  72          1HB       PRO  72   3.784  15.045   3.032
  571   1HG   PRO  72          2HG       PRO  72   1.884  16.209   4.549
  572   2HG   PRO  72          1HG       PRO  72   1.576  15.681   2.884
  573   1HD   PRO  72          2HD       PRO  72   0.837  14.353   5.463
  574   2HD   PRO  72          1HD       PRO  72  -0.110  14.524   3.970
  575    H    ASP  73           H        ASP  73   2.140  12.328   5.865
  576    HA   ASP  73           HA       ASP  73   4.757  11.290   6.637
  577   1HB   ASP  73          2HB       ASP  73   2.548  12.461   8.046
  578   2HB   ASP  73          1HB       ASP  73   2.938  10.887   8.731
  579    H    SER  74           H        SER  74   2.863  10.011   4.676
  580    HA   SER  74           HA       SER  74   2.347   7.482   6.073
  581   1HB   SER  74          2HB       SER  74   0.386   8.379   4.965
  582   2HB   SER  74          1HB       SER  74   1.276   8.557   3.453
  583    HG   SER  74           HG       SER  74   0.764   6.578   3.025
  584    H    VAL  75           H        VAL  75   2.430   5.608   4.212
  585    HA   VAL  75           HA       VAL  75   5.099   5.833   2.986
  586    HB   VAL  75           HB       VAL  75   3.932   3.309   4.169
  587   1HG1  VAL  75          1HG1      VAL  75   5.437   2.746   2.433
  588   2HG1  VAL  75          2HG1      VAL  75   6.341   2.563   3.936
  589   3HG1  VAL  75          3HG1      VAL  75   6.589   3.987   2.926
  590   1HG2  VAL  75          1HG2      VAL  75   4.492   4.198   6.145
  591   2HG2  VAL  75          2HG2      VAL  75   5.401   5.512   5.397
  592   3HG2  VAL  75          3HG2      VAL  75   6.162   3.939   5.642
  593    H    VAL  76           H        VAL  76   5.466   4.499   1.139
  594    HA   VAL  76           HA       VAL  76   3.120   3.417  -0.216
  595    HB   VAL  76           HB       VAL  76   4.821   5.172  -1.900
  596   1HG1  VAL  76          1HG1      VAL  76   2.666   3.639  -2.397
  597   2HG1  VAL  76          2HG1      VAL  76   3.101   5.060  -3.348
  598   3HG1  VAL  76          3HG1      VAL  76   1.884   5.187  -2.078
  599   1HG2  VAL  76          1HG2      VAL  76   2.667   6.250  -0.087
  600   2HG2  VAL  76          2HG2      VAL  76   3.472   7.147  -1.374
  601   3HG2  VAL  76          3HG2      VAL  76   4.391   6.599   0.028
  602    H    ILE  77           H        ILE  77   3.835   1.385  -0.463
  603    HA   ILE  77           HA       ILE  77   6.583   0.885  -1.277
  604    HB   ILE  77           HB       ILE  77   4.394  -1.119  -0.723
  605   1HG1  ILE  77          2HG1      ILE  77   4.816   0.222   1.268
  606   2HG1  ILE  77          1HG1      ILE  77   5.484  -1.393   1.482
  607   1HG2  ILE  77          1HG2      ILE  77   6.385  -1.825  -2.112
  608   2HG2  ILE  77          2HG2      ILE  77   6.091  -2.763  -0.647
  609   3HG2  ILE  77          3HG2      ILE  77   7.370  -1.549  -0.676
  610   1HD1  ILE  77          1HD1      ILE  77   7.708  -0.429   0.792
  611   2HD1  ILE  77          2HD1      ILE  77   7.073   0.116   2.345
  612   3HD1  ILE  77          3HD1      ILE  77   6.959   1.161   0.928
  613    H    VAL  78           H        VAL  78   3.290   0.397  -2.492
  614    HA   VAL  78           HA       VAL  78   2.496  -0.247  -4.542
  615    HB   VAL  78           HB       VAL  78   4.813   1.450  -5.494
  616   1HG1  VAL  78          1HG1      VAL  78   2.164   0.929  -6.836
  617   2HG1  VAL  78          2HG1      VAL  78   3.650   0.063  -7.223
  618   3HG1  VAL  78          3HG1      VAL  78   3.549   1.804  -7.492
  619   1HG2  VAL  78          1HG2      VAL  78   2.249   2.110  -4.193
  620   2HG2  VAL  78          2HG2      VAL  78   2.676   3.080  -5.603
  621   3HG2  VAL  78          3HG2      VAL  78   3.773   2.998  -4.222
  622    H    ILE  79           H        ILE  79   2.944  -2.463  -4.461
  623    HA   ILE  79           HA       ILE  79   5.417  -3.359  -5.773
  624    HB   ILE  79           HB       ILE  79   3.537  -5.291  -4.493
  625   1HG1  ILE  79          2HG1      ILE  79   5.498  -3.629  -2.905
  626   2HG1  ILE  79          1HG1      ILE  79   3.755  -3.385  -2.894
  627   1HG2  ILE  79          1HG2      ILE  79   6.043  -5.958  -3.721
  628   2HG2  ILE  79          2HG2      ILE  79   6.370  -5.146  -5.251
  629   3HG2  ILE  79          3HG2      ILE  79   5.276  -6.528  -5.201
  630   1HD1  ILE  79          1HD1      ILE  79   4.387  -4.632  -0.954
  631   2HD1  ILE  79          2HD1      ILE  79   5.247  -5.814  -1.941
  632   3HD1  ILE  79          3HD1      ILE  79   3.491  -5.693  -2.041
  633    H    THR  80           H        THR  80   4.862  -5.690  -6.873
  634    HA   THR  80           HA       THR  80   3.775  -6.863  -8.504
  635    HB   THR  80           HB       THR  80   1.543  -4.947  -8.829
  636    HG1  THR  80           1HG      THR  80   0.624  -5.955  -6.841
  637   1HG2  THR  80          1HG2      THR  80   0.180  -6.957  -8.709
  638   2HG2  THR  80          2HG2      THR  80   1.620  -7.915  -8.368
  639   3HG2  THR  80          3HG2      THR  80   1.449  -7.102  -9.924
  640    H    GLY  81           H        GLY  81   3.870  -6.843 -10.724
  641   1HA   GLY  81          2HA       GLY  81   3.893  -4.367 -12.204
  642   2HA   GLY  81          1HA       GLY  81   5.480  -5.106 -12.047
  643    H    HIS  82           H        HIS  82   6.053  -6.381 -13.667
  644    HA   HIS  82           HA       HIS  82   4.530  -8.458 -14.725
  645   1HB   HIS  82          2HB       HIS  82   3.701  -5.963 -15.739
  646   2HB   HIS  82          1HB       HIS  82   4.634  -6.721 -17.026
  647    HD1  HIS  82           1HD      HIS  82   3.647  -9.678 -16.100
  648    HD2  HIS  82           2HD      HIS  82   1.294  -6.404 -17.107
  649    HE1  HIS  82           1HE      HIS  82   1.431 -10.634 -16.804
  650    HE2  HIS  82           2HE      HIS  82   0.050  -8.640 -17.485
  651    H    GLY  83           H        GLY  83   6.819  -5.942 -15.783
  652   1HA   GLY  83          2HA       GLY  83   8.969  -7.794 -15.999
  653   2HA   GLY  83          1HA       GLY  83   8.303  -7.432 -17.584
  654    H    SER  84           H        SER  84   7.646  -4.731 -17.184
  655    HA   SER  84           HA       SER  84  10.265  -3.561 -17.478
  656   1HB   SER  84          2HB       SER  84   8.685  -2.750 -19.033
  657   2HB   SER  84          1HB       SER  84   7.457  -2.512 -17.790
  658    HG   SER  84           HG       SER  84   8.624  -0.584 -18.585
  659    H    VAL  85           H        VAL  85  11.396  -2.595 -15.934
  660    HA   VAL  85           HA       VAL  85  10.241  -2.225 -13.309
  661    HB   VAL  85           HB       VAL  85  13.036  -1.521 -14.202
  662   1HG1  VAL  85          1HG1      VAL  85  12.773  -0.539 -12.135
  663   2HG1  VAL  85          2HG1      VAL  85  13.387  -2.132 -11.691
  664   3HG1  VAL  85          3HG1      VAL  85  11.662  -1.785 -11.565
  665   1HG2  VAL  85          1HG2      VAL  85  11.776  -4.131 -13.631
  666   2HG2  VAL  85          2HG2      VAL  85  13.353  -3.846 -12.896
  667   3HG2  VAL  85          3HG2      VAL  85  13.163  -3.736 -14.646
  668    H    ASP  86           H        ASP  86  10.368  -0.347 -16.056
  669    HA   ASP  86           HA       ASP  86  11.055   2.191 -15.059
  670   1HB   ASP  86          2HB       ASP  86   9.150   1.511 -17.309
  671   2HB   ASP  86          1HB       ASP  86   9.912   3.075 -17.035
  672    H    THR  87           H        THR  87   8.299   0.249 -14.490
  673    HA   THR  87           HA       THR  87   6.459   2.387 -13.982
  674    HB   THR  87           HB       THR  87   5.973  -0.136 -14.513
  675    HG1  THR  87           1HG      THR  87   4.461   1.177 -12.512
  676   1HG2  THR  87          1HG2      THR  87   7.188  -0.761 -12.266
  677   2HG2  THR  87          2HG2      THR  87   5.768  -1.646 -12.823
  678   3HG2  THR  87          3HG2      THR  87   5.603  -0.405 -11.581
  679    H    ALA  88           H        ALA  88   8.736   0.510 -12.114
  680    HA   ALA  88           HA       ALA  88   7.941   1.276  -9.534
  681   1HB   ALA  88          1HB       ALA  88  10.336   0.771  -8.936
  682   2HB   ALA  88          2HB       ALA  88  10.626   0.489 -10.651
  683   3HB   ALA  88          3HB       ALA  88   9.482  -0.525  -9.773
  684    H    VAL  89           H        VAL  89  10.577   2.548 -11.540
  685    HA   VAL  89           HA       VAL  89  11.180   4.754  -9.932
  686    HB   VAL  89           HB       VAL  89  12.386   5.653 -11.836
  687   1HG1  VAL  89          1HG1      VAL  89  12.953   3.347 -10.583
  688   2HG1  VAL  89          2HG1      VAL  89  13.995   4.062 -11.814
  689   3HG1  VAL  89          3HG1      VAL  89  12.875   2.771 -12.248
  690   1HG2  VAL  89          1HG2      VAL  89  12.273   4.312 -14.015
  691   2HG2  VAL  89          2HG2      VAL  89  10.938   5.411 -13.665
  692   3HG2  VAL  89          3HG2      VAL  89  10.747   3.679 -13.398
  693    H    LYS  90           H        LYS  90   8.641   4.236 -12.245
  694    HA   LYS  90           HA       LYS  90   8.048   7.009 -12.665
  695   1HB   LYS  90          2HB       LYS  90   7.453   5.388 -14.361
  696   2HB   LYS  90          1HB       LYS  90   6.454   4.502 -13.218
  697   1HG   LYS  90          2HG       LYS  90   4.861   6.275 -13.123
  698   2HG   LYS  90          1HG       LYS  90   5.912   7.340 -14.055
  699   1HD   LYS  90          2HD       LYS  90   4.811   4.740 -15.107
  700   2HD   LYS  90          1HD       LYS  90   4.030   6.304 -15.353
  701   1HE   LYS  90          2HE       LYS  90   6.698   5.363 -16.368
  702   2HE   LYS  90          1HE       LYS  90   5.303   5.911 -17.298
  703   1HZ   LYS  90          1HZ       LYS  90   6.868   7.659 -17.305
  704   2HZ   LYS  90          2HZ       LYS  90   7.128   7.553 -15.637
  705   3HZ   LYS  90          3HZ       LYS  90   5.653   8.133 -16.228
  706    H    ALA  91           H        ALA  91   7.379   4.771 -10.165
  707    HA   ALA  91           HA       ALA  91   5.192   6.472  -9.166
  708   1HB   ALA  91          1HB       ALA  91   4.685   4.460  -7.698
  709   2HB   ALA  91          2HB       ALA  91   5.802   3.564  -8.727
  710   3HB   ALA  91          3HB       ALA  91   4.354   4.293  -9.422
  711    H    ILE  92           H        ILE  92   8.198   4.840  -8.233
  712    HA   ILE  92           HA       ILE  92   8.118   5.786  -5.546
  713    HB   ILE  92           HB       ILE  92  10.168   4.762  -5.194
  714   1HG1  ILE  92          2HG1      ILE  92  10.718   5.043  -8.154
  715   2HG1  ILE  92          1HG1      ILE  92  11.509   5.923  -6.851
  716   1HG2  ILE  92          1HG2      ILE  92   9.695   2.940  -7.401
  717   2HG2  ILE  92          2HG2      ILE  92   8.207   3.389  -6.567
  718   3HG2  ILE  92          3HG2      ILE  92   9.545   2.680  -5.664
  719   1HD1  ILE  92          1HD1      ILE  92  12.447   3.809  -6.023
  720   2HD1  ILE  92          2HD1      ILE  92  12.950   4.174  -7.674
  721   3HD1  ILE  92          3HD1      ILE  92  11.698   2.967  -7.380
  722    H    LYS  93           H        LYS  93   9.149   7.168  -8.529
  723    HA   LYS  93           HA       LYS  93  10.999   9.053  -7.482
  724   1HB   LYS  93          2HB       LYS  93   9.479   8.775 -10.044
  725   2HB   LYS  93          1HB       LYS  93  10.273  10.301  -9.685
  726   1HG   LYS  93          2HG       LYS  93  11.740   7.687  -9.587
  727   2HG   LYS  93          1HG       LYS  93  11.562   8.615 -11.077
  728   1HD   LYS  93          2HD       LYS  93  12.471  10.585  -9.640
  729   2HD   LYS  93          1HD       LYS  93  13.059   9.304  -8.580
  730   1HE   LYS  93          2HE       LYS  93  14.668   8.679 -10.022
  731   2HE   LYS  93          1HE       LYS  93  13.626   8.891 -11.429
  732   1HZ   LYS  93          1HZ       LYS  93  15.294  10.498 -11.634
  733   2HZ   LYS  93          2HZ       LYS  93  15.212  10.943 -10.004
  734   3HZ   LYS  93          3HZ       LYS  93  13.956  11.357 -11.058
  735    H    LYS  94           H        LYS  94   7.531   8.952  -7.808
  736    HA   LYS  94           HA       LYS  94   6.987  11.694  -7.459
  737   1HB   LYS  94          2HB       LYS  94   5.404   9.186  -7.064
  738   2HB   LYS  94          1HB       LYS  94   4.744  10.738  -6.566
  739   1HG   LYS  94          2HG       LYS  94   5.834  10.512  -9.315
  740   2HG   LYS  94          1HG       LYS  94   4.292   9.728  -8.961
  741   1HD   LYS  94          2HD       LYS  94   3.687  11.864  -9.693
  742   2HD   LYS  94          1HD       LYS  94   3.610  11.978  -7.933
  743   1HE   LYS  94          2HE       LYS  94   5.639  13.163  -7.818
  744   2HE   LYS  94          1HE       LYS  94   6.073  12.742  -9.474
  745   1HZ   LYS  94          1HZ       LYS  94   5.307  15.051  -9.232
  746   2HZ   LYS  94          2HZ       LYS  94   3.793  14.491  -8.723
  747   3HZ   LYS  94          3HZ       LYS  94   4.335  14.160 -10.291
  748    H    GLY  95           H        GLY  95   6.808   9.022  -5.096
  749   1HA   GLY  95          2HA       GLY  95   8.117  10.342  -3.027
  750   2HA   GLY  95          1HA       GLY  95   6.413  10.736  -2.871
  751    H    ALA  96           H        ALA  96   7.679   7.647  -4.036
  752    HA   ALA  96           HA       ALA  96   6.228   6.320  -1.894
  753   1HB   ALA  96          1HB       ALA  96   6.077   4.509  -3.244
  754   2HB   ALA  96          2HB       ALA  96   7.713   4.703  -3.869
  755   3HB   ALA  96          3HB       ALA  96   6.404   5.703  -4.498
  756    H    TYR  97           H        TYR  97   7.640   3.989  -1.589
  757    HA   TYR  97           HA       TYR  97  10.041   4.942  -0.197
  758   1HB   TYR  97          2HB       TYR  97   8.417   4.029   1.326
  759   2HB   TYR  97          1HB       TYR  97   8.239   2.581   0.346
  760    HD1  TYR  97           1HD      TYR  97  10.803   4.466   2.295
  761    HD2  TYR  97           2HD      TYR  97   9.445   0.681   0.908
  762    HE1  TYR  97           1HE      TYR  97  12.533   3.357   3.645
  763    HE2  TYR  97           2HE      TYR  97  11.171  -0.439   2.253
  764    HH   TYR  97           HH       TYR  97  13.733   1.283   3.760
  765    H    GLU  98           H        GLU  98   8.960   2.971  -2.726
  766    HA   GLU  98           HA       GLU  98  11.038   2.458  -4.200
  767   1HB   GLU  98          2HB       GLU  98  12.203   0.400  -3.414
  768   2HB   GLU  98          1HB       GLU  98  12.493   1.791  -2.383
  769   1HG   GLU  98          2HG       GLU  98  10.400   0.735  -1.096
  770   2HG   GLU  98          1HG       GLU  98  11.059  -0.729  -1.824
  771    H    PHE  99           H        PHE  99  11.189  -0.131  -4.922
  772    HA   PHE  99           HA       PHE  99   8.379  -0.979  -5.180
  773   1HB   PHE  99          2HB       PHE  99  10.086  -0.125  -7.223
  774   2HB   PHE  99          1HB       PHE  99  10.052  -1.879  -7.369
  775    HD1  PHE  99           1HD      PHE  99   8.468  -2.753  -8.768
  776    HD2  PHE  99           2HD      PHE  99   7.642   0.910  -6.764
  777    HE1  PHE  99           1HE      PHE  99   6.303  -2.612  -9.928
  778    HE2  PHE  99           2HE      PHE  99   5.475   1.057  -7.921
  779    HZ   PHE  99           HZ       PHE  99   4.803  -0.705  -9.504
  780    H    LEU 100           H        LEU 100   8.419  -2.542  -3.606
  781    HA   LEU 100           HA       LEU 100  10.428  -4.366  -3.055
  782   1HB   LEU 100          2HB       LEU 100   8.165  -3.847  -1.874
  783   2HB   LEU 100          1HB       LEU 100   7.537  -5.126  -2.890
  784    HG   LEU 100           HG       LEU 100   9.014  -6.741  -1.885
  785   1HD1  LEU 100          1HD1      LEU 100  11.018  -5.602  -1.490
  786   2HD1  LEU 100          2HD1      LEU 100  10.393  -5.954   0.122
  787   3HD1  LEU 100          3HD1      LEU 100  10.219  -4.336  -0.556
  788   1HD2  LEU 100          1HD2      LEU 100   7.995  -5.204   0.460
  789   2HD2  LEU 100          2HD2      LEU 100   7.934  -6.937   0.137
  790   3HD2  LEU 100          3HD2      LEU 100   6.859  -5.841  -0.730
  791    H    GLU 101           H        GLU 101  10.990  -6.372  -3.821
  792    HA   GLU 101           HA       GLU 101   9.990  -7.037  -6.478
  793   1HB   GLU 101          2HB       GLU 101  12.293  -8.223  -4.922
  794   2HB   GLU 101          1HB       GLU 101  11.907  -8.555  -6.604
  795   1HG   GLU 101          2HG       GLU 101  13.393  -6.959  -7.055
  796   2HG   GLU 101          1HG       GLU 101  12.102  -5.843  -6.617
  797    H    LYS 102           H        LYS 102   8.644  -7.622  -3.749
  798    HA   LYS 102           HA       LYS 102   7.441  -9.285  -2.766
  799   1HB   LYS 102          2HB       LYS 102   6.656  -9.119  -5.308
  800   2HB   LYS 102          1HB       LYS 102   7.273 -10.764  -5.343
  801   1HG   LYS 102          2HG       LYS 102   5.753 -11.448  -3.634
  802   2HG   LYS 102          1HG       LYS 102   5.243  -9.782  -3.353
  803   1HD   LYS 102          2HD       LYS 102   3.858  -9.771  -5.136
  804   2HD   LYS 102          1HD       LYS 102   4.960 -10.734  -6.123
  805   1HE   LYS 102          2HE       LYS 102   4.183 -12.750  -5.232
  806   2HE   LYS 102          1HE       LYS 102   3.451 -11.956  -3.839
  807   1HZ   LYS 102          1HZ       LYS 102   1.585 -11.512  -4.970
  808   2HZ   LYS 102          2HZ       LYS 102   2.098 -12.748  -6.007
  809   3HZ   LYS 102          3HZ       LYS 102   2.398 -11.131  -6.404
  810    HA   PRO 103           HA       PRO 103  11.258 -12.151  -2.957
  811   1HB   PRO 103          2HB       PRO 103  11.416 -11.346  -0.113
  812   2HB   PRO 103          1HB       PRO 103  12.703 -11.487  -1.314
  813   1HG   PRO 103          2HG       PRO 103  11.832  -9.098  -0.490
  814   2HG   PRO 103          1HG       PRO 103  12.316  -9.377  -2.172
  815   1HD   PRO 103          2HD       PRO 103   9.575  -9.187  -0.992
  816   2HD   PRO 103          1HD       PRO 103  10.183  -8.575  -2.542
  817    H    PHE 104           H        PHE 104  11.046 -14.252  -2.419
  818    HA   PHE 104           HA       PHE 104  10.191 -16.178  -1.570
  819   1HB   PHE 104          2HB       PHE 104   9.902 -14.273   0.689
  820   2HB   PHE 104          1HB       PHE 104   8.977 -15.767   0.789
  821    HD1  PHE 104           1HD      PHE 104  12.156 -14.232   1.251
  822    HD2  PHE 104           2HD      PHE 104  10.242 -17.962   0.522
  823    HE1  PHE 104           1HE      PHE 104  14.163 -15.412   2.048
  824    HE2  PHE 104           2HE      PHE 104  12.246 -19.149   1.318
  825    HZ   PHE 104           HZ       PHE 104  14.210 -17.874   2.081
  826    H    SER 105           H        SER 105   7.770 -13.958  -0.217
  827    HA   SER 105           HA       SER 105   5.835 -14.489  -2.240
  828   1HB   SER 105          2HB       SER 105   4.273 -15.826  -0.958
  829   2HB   SER 105          1HB       SER 105   5.823 -16.663  -1.022
  830    HG   SER 105           HG       SER 105   6.212 -15.580   1.086
  831    H    VAL 106           H        VAL 106   6.448 -13.464   1.087
  832    HA   VAL 106           HA       VAL 106   5.318 -10.920   0.713
  833    HB   VAL 106           HB       VAL 106   3.187 -12.101   0.652
  834   1HG1  VAL 106          1HG1      VAL 106   4.056 -13.172   3.326
  835   2HG1  VAL 106          2HG1      VAL 106   3.633 -14.081   1.875
  836   3HG1  VAL 106          3HG1      VAL 106   2.384 -13.210   2.764
  837   1HG2  VAL 106          1HG2      VAL 106   3.683 -10.454   3.127
  838   2HG2  VAL 106          2HG2      VAL 106   2.075 -10.911   2.564
  839   3HG2  VAL 106          3HG2      VAL 106   3.107  -9.898   1.555
  840    H    GLU 107           H        GLU 107   6.370 -13.461   2.894
  841    HA   GLU 107           HA       GLU 107   6.402 -12.238   5.333
  842   1HB   GLU 107          2HB       GLU 107   7.281 -14.552   4.618
  843   2HB   GLU 107          1HB       GLU 107   8.812 -13.730   4.351
  844   1HG   GLU 107          2HG       GLU 107   7.755 -13.033   6.922
  845   2HG   GLU 107          1HG       GLU 107   7.822 -14.785   6.743
  846    H    ARG 108           H        ARG 108   8.536 -11.637   2.605
  847    HA   ARG 108           HA       ARG 108  10.371  -9.970   3.996
  848   1HB   ARG 108          2HB       ARG 108  10.315 -11.101   1.508
  849   2HB   ARG 108          1HB       ARG 108   9.978  -9.417   1.130
  850   1HG   ARG 108          2HG       ARG 108  12.293 -10.222   2.859
  851   2HG   ARG 108          1HG       ARG 108  12.408 -10.164   1.100
  852   1HD   ARG 108          2HD       ARG 108  12.277  -7.890   1.028
  853   2HD   ARG 108          1HD       ARG 108  11.280  -7.794   2.479
  854    HE   ARG 108           HE       ARG 108  13.185  -7.530   3.702
  855   1HH1  ARG 108          1HH1      ARG 108  14.041  -8.961   0.635
  856   2HH1  ARG 108          2HH1      ARG 108  15.746  -8.878   0.931
  857   1HH2  ARG 108          1HH2      ARG 108  15.426  -7.420   4.093
  858   2HH2  ARG 108          2HH2      ARG 108  16.532  -8.003   2.894
  859    H    PHE 109           H        PHE 109   7.411  -9.408   2.179
  860    HA   PHE 109           HA       PHE 109   7.437  -6.623   2.052
  861   1HB   PHE 109          2HB       PHE 109   5.786  -7.847   0.813
  862   2HB   PHE 109          1HB       PHE 109   5.158  -8.603   2.271
  863    HD1  PHE 109           1HD      PHE 109   5.871  -5.062   1.340
  864    HD2  PHE 109           2HD      PHE 109   3.005  -7.923   2.648
  865    HE1  PHE 109           1HE      PHE 109   4.186  -3.282   1.526
  866    HE2  PHE 109           2HE      PHE 109   1.314  -6.148   2.835
  867    HZ   PHE 109           HZ       PHE 109   1.902  -3.825   2.274
  868    H    LEU 110           H        LEU 110   6.704  -8.808   4.667
  869    HA   LEU 110           HA       LEU 110   5.389  -7.073   6.424
  870   1HB   LEU 110          2HB       LEU 110   6.004  -9.663   6.483
  871   2HB   LEU 110          1HB       LEU 110   7.259  -9.058   7.547
  872    HG   LEU 110           HG       LEU 110   4.324  -8.510   7.950
  873   1HD1  LEU 110          1HD1      LEU 110   4.329 -10.224   9.623
  874   2HD1  LEU 110          2HD1      LEU 110   6.044 -10.542   9.353
  875   3HD1  LEU 110          3HD1      LEU 110   4.868 -10.921   8.094
  876   1HD2  LEU 110          1HD2      LEU 110   6.762  -7.553   9.182
  877   2HD2  LEU 110          2HD2      LEU 110   5.708  -8.345  10.354
  878   3HD2  LEU 110          3HD2      LEU 110   5.100  -7.000   9.389
  879    H    LEU 111           H        LEU 111   8.830  -7.933   6.249
  880    HA   LEU 111           HA       LEU 111   9.853  -6.434   8.286
  881   1HB   LEU 111          2HB       LEU 111  10.995  -7.019   5.572
  882   2HB   LEU 111          1HB       LEU 111  11.911  -6.192   6.816
  883    HG   LEU 111           HG       LEU 111  10.955  -8.463   8.099
  884   1HD1  LEU 111          1HD1      LEU 111  11.611  -9.039   5.234
  885   2HD1  LEU 111          2HD1      LEU 111  10.268  -9.634   6.210
  886   3HD1  LEU 111          3HD1      LEU 111  11.900 -10.235   6.498
  887   1HD2  LEU 111          1HD2      LEU 111  13.268  -7.214   7.962
  888   2HD2  LEU 111          2HD2      LEU 111  13.635  -8.495   6.806
  889   3HD2  LEU 111          3HD2      LEU 111  13.172  -8.904   8.458
  890    H    THR 112           H        THR 112   9.010  -5.291   5.040
  891    HA   THR 112           HA       THR 112  10.050  -2.689   5.330
  892    HB   THR 112           HB       THR 112   7.797  -3.706   3.584
  893    HG1  THR 112           1HG      THR 112   9.393  -3.893   2.038
  894   1HG2  THR 112          1HG2      THR 112   8.234  -1.807   2.140
  895   2HG2  THR 112          2HG2      THR 112   9.409  -1.182   3.296
  896   3HG2  THR 112          3HG2      THR 112   7.704  -1.277   3.737
  897    H    ILE 113           H        ILE 113   6.748  -3.949   5.739
  898    HA   ILE 113           HA       ILE 113   5.370  -1.681   6.346
  899    HB   ILE 113           HB       ILE 113   5.101  -4.509   7.179
  900   1HG1  ILE 113          2HG1      ILE 113   2.920  -4.282   6.158
  901   2HG1  ILE 113          1HG1      ILE 113   3.086  -2.531   6.100
  902   1HG2  ILE 113          1HG2      ILE 113   3.749  -2.263   8.642
  903   2HG2  ILE 113          2HG2      ILE 113   4.639  -3.633   9.307
  904   3HG2  ILE 113          3HG2      ILE 113   3.062  -3.886   8.559
  905   1HD1  ILE 113          1HD1      ILE 113   4.367  -4.612   4.403
  906   2HD1  ILE 113          2HD1      ILE 113   5.165  -3.057   4.627
  907   3HD1  ILE 113          3HD1      ILE 113   3.546  -3.122   3.938
  908    H    LYS 114           H        LYS 114   7.126  -3.655   8.754
  909    HA   LYS 114           HA       LYS 114   6.602  -2.167  11.004
  910   1HB   LYS 114          2HB       LYS 114   8.022  -4.337  10.649
  911   2HB   LYS 114          1HB       LYS 114   9.366  -3.208  10.562
  912   1HG   LYS 114          2HG       LYS 114   7.447  -3.138  12.856
  913   2HG   LYS 114          1HG       LYS 114   8.794  -4.278  12.825
  914   1HD   LYS 114          2HD       LYS 114   9.083  -1.293  12.508
  915   2HD   LYS 114          1HD       LYS 114   9.288  -2.155  14.033
  916   1HE   LYS 114          2HE       LYS 114  10.841  -3.332  11.878
  917   2HE   LYS 114          1HE       LYS 114  11.253  -1.640  12.154
  918   1HZ   LYS 114          1HZ       LYS 114  12.092  -2.081  14.190
  919   2HZ   LYS 114          2HZ       LYS 114  12.347  -3.612  13.516
  920   3HZ   LYS 114          3HZ       LYS 114  11.006  -3.337  14.510
  921    H    HIS 115           H        HIS 115   9.467  -1.824   8.920
  922    HA   HIS 115           HA       HIS 115  10.401   0.540  10.082
  923   1HB   HIS 115          2HB       HIS 115  11.052  -1.099   7.813
  924   2HB   HIS 115          1HB       HIS 115  11.174   0.606   7.392
  925    HD1  HIS 115           1HD      HIS 115  13.503   1.362   7.649
  926    HD2  HIS 115           2HD      HIS 115  12.453  -1.391  10.579
  927    HE1  HIS 115           1HE      HIS 115  15.538   1.124   9.108
  928    HE2  HIS 115           2HE      HIS 115  14.903  -0.603  10.829
  929    H    ALA 116           H        ALA 116   7.987  -0.027   7.609
  930    HA   ALA 116           HA       ALA 116   7.833   2.550   6.524
  931   1HB   ALA 116          1HB       ALA 116   5.663   1.928   5.707
  932   2HB   ALA 116          2HB       ALA 116   5.538   0.631   6.895
  933   3HB   ALA 116          3HB       ALA 116   6.727   0.526   5.597
  934    H    PHE 117           H        PHE 117   6.667   1.243   9.527
  935    HA   PHE 117           HA       PHE 117   4.963   3.520  10.078
  936   1HB   PHE 117          2HB       PHE 117   5.660   1.002  11.572
  937   2HB   PHE 117          1HB       PHE 117   4.769   2.306  12.345
  938    HD1  PHE 117           1HD      PHE 117   4.093  -0.711  11.435
  939    HD2  PHE 117           2HD      PHE 117   3.059   3.190  10.083
  940    HE1  PHE 117           1HE      PHE 117   1.993  -1.587  10.501
  941    HE2  PHE 117           2HE      PHE 117   0.965   2.313   9.148
  942    HZ   PHE 117           HZ       PHE 117   0.429  -0.076   9.364
  943    H    GLU 118           H        GLU 118   7.809   2.040  11.642
  944    HA   GLU 118           HA       GLU 118   8.270   4.117  13.461
  945   1HB   GLU 118          2HB       GLU 118   9.839   1.839  12.412
  946   2HB   GLU 118          1HB       GLU 118  10.731   3.125  13.214
  947   1HG   GLU 118          2HG       GLU 118   8.434   2.421  14.771
  948   2HG   GLU 118          1HG       GLU 118   9.369   0.976  14.388
  949    H    GLU 119           H        GLU 119   9.763   3.500  10.291
  950    HA   GLU 119           HA       GLU 119  11.340   5.881  10.385
  951   1HB   GLU 119          2HB       GLU 119  10.666   4.144   8.009
  952   2HB   GLU 119          1HB       GLU 119  11.952   5.339   8.088
  953   1HG   GLU 119          2HG       GLU 119  12.204   3.467  10.249
  954   2HG   GLU 119          1HG       GLU 119  12.101   2.619   8.706
  955    H    TYR 120           H        TYR 120   8.079   5.462   9.905
  956    HA   TYR 120           HA       TYR 120   7.895   8.071   8.599
  957   1HB   TYR 120          2HB       TYR 120   7.334   5.672   7.270
  958   2HB   TYR 120          1HB       TYR 120   5.761   6.337   7.694
  959    HD1  TYR 120           1HD      TYR 120   6.195   9.219   7.449
  960    HD2  TYR 120           2HD      TYR 120   7.604   6.041   4.996
  961    HE1  TYR 120           1HE      TYR 120   6.338  10.763   5.540
  962    HE2  TYR 120           2HE      TYR 120   7.753   7.577   3.082
  963    HH   TYR 120           HH       TYR 120   6.834   9.678   2.331
  964    H    SER 121           H        SER 121   7.610   7.461  11.329
  965    HA   SER 121           HA       SER 121   5.217   8.755  11.947
  966   1HB   SER 121          2HB       SER 121   4.594   6.213  11.258
  967   2HB   SER 121          1HB       SER 121   4.898   5.998  12.982
  968    HG   SER 121           HG       SER 121   2.718   6.535  12.571
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1   0.857  -0.607  18.455
    2   2H    MET   1          2HT       MET   1  -0.621  -0.493  19.320
    3   3H    MET   1          3HT       MET   1  -0.091   0.817  18.347
    4    HA   MET   1           HA       MET   1  -0.642  -1.849  17.259
    5   1HB   MET   1          2HB       MET   1  -2.532  -0.442  18.547
    6   2HB   MET   1          1HB       MET   1  -2.609   0.362  16.985
    7   1HG   MET   1          2HG       MET   1  -3.542  -1.410  15.966
    8   2HG   MET   1          1HG       MET   1  -2.604  -2.576  16.897
    9   1HE   MET   1          1HE       MET   1  -5.977  -2.721  16.163
   10   2HE   MET   1          2HE       MET   1  -6.262  -3.696  17.605
   11   3HE   MET   1          3HE       MET   1  -4.808  -3.951  16.641
   12    H    LYS   2           H        LYS   2  -1.085  -1.699  14.946
   13    HA   LYS   2           HA       LYS   2   0.048   0.696  13.672
   14   1HB   LYS   2          2HB       LYS   2   0.680  -2.147  12.865
   15   2HB   LYS   2          1HB       LYS   2   1.305  -0.686  12.113
   16   1HG   LYS   2          2HG       LYS   2   1.817  -0.847  14.985
   17   2HG   LYS   2          1HG       LYS   2   2.567  -2.138  14.044
   18   1HD   LYS   2          2HD       LYS   2   3.568  -0.443  12.562
   19   2HD   LYS   2          1HD       LYS   2   2.854   0.827  13.557
   20   1HE   LYS   2          2HE       LYS   2   4.641  -1.261  14.755
   21   2HE   LYS   2          1HE       LYS   2   5.312   0.165  13.967
   22   1HZ   LYS   2          1HZ       LYS   2   3.229   0.523  16.002
   23   2HZ   LYS   2          2HZ       LYS   2   4.506   1.550  15.578
   24   3HZ   LYS   2          3HZ       LYS   2   4.804   0.168  16.508
   25    H    ARG   3           H        ARG   3  -0.500   0.869  11.357
   26    HA   ARG   3           HA       ARG   3  -2.853  -0.650  10.524
   27   1HB   ARG   3          2HB       ARG   3  -2.916   2.337  10.256
   28   2HB   ARG   3          1HB       ARG   3  -4.249   1.192  10.198
   29   1HG   ARG   3          2HG       ARG   3  -4.560   2.207  12.240
   30   2HG   ARG   3          1HG       ARG   3  -3.656   0.757  12.682
   31   1HD   ARG   3          2HD       ARG   3  -1.781   1.922  13.225
   32   2HD   ARG   3          1HD       ARG   3  -2.081   3.176  12.022
   33    HE   ARG   3           HE       ARG   3  -4.037   3.402  13.995
   34   1HH1  ARG   3          1HH1      ARG   3  -0.582   3.764  13.675
   35   2HH1  ARG   3          2HH1      ARG   3  -0.464   4.954  14.928
   36   1HH2  ARG   3          1HH2      ARG   3  -3.885   4.968  15.643
   37   2HH2  ARG   3          2HH2      ARG   3  -2.339   5.637  16.046
   38    H    VAL   4           H        VAL   4  -2.578  -1.296   8.496
   39    HA   VAL   4           HA       VAL   4  -1.039   0.413   6.659
   40    HB   VAL   4           HB       VAL   4  -0.846  -2.601   6.798
   41   1HG1  VAL   4          1HG1      VAL   4   0.383  -0.543   4.990
   42   2HG1  VAL   4          2HG1      VAL   4  -0.504  -2.005   4.560
   43   3HG1  VAL   4          3HG1      VAL   4   1.120  -2.126   5.234
   44   1HG2  VAL   4          1HG2      VAL   4   1.225  -0.535   7.551
   45   2HG2  VAL   4          2HG2      VAL   4   1.397  -2.287   7.646
   46   3HG2  VAL   4          3HG2      VAL   4   0.254  -1.456   8.700
   47    H    LEU   5           H        LEU   5  -1.738   0.441   4.513
   48    HA   LEU   5           HA       LEU   5  -4.382  -0.772   4.090
   49   1HB   LEU   5          2HB       LEU   5  -4.256   1.691   3.977
   50   2HB   LEU   5          1HB       LEU   5  -3.109   1.556   2.657
   51    HG   LEU   5           HG       LEU   5  -4.859   0.418   1.304
   52   1HD1  LEU   5          1HD1      LEU   5  -7.100   0.288   2.007
   53   2HD1  LEU   5          2HD1      LEU   5  -6.801   1.297   3.421
   54   3HD1  LEU   5          3HD1      LEU   5  -6.149  -0.340   3.351
   55   1HD2  LEU   5          1HD2      LEU   5  -6.392   2.586   1.314
   56   2HD2  LEU   5          2HD2      LEU   5  -4.752   2.597   0.666
   57   3HD2  LEU   5          3HD2      LEU   5  -5.061   3.205   2.292
   58    H    VAL   6           H        VAL   6  -4.822  -2.024   2.347
   59    HA   VAL   6           HA       VAL   6  -2.553  -2.698   0.585
   60    HB   VAL   6           HB       VAL   6  -4.822  -4.550   1.313
   61   1HG1  VAL   6          1HG1      VAL   6  -3.938  -5.363  -0.653
   62   2HG1  VAL   6          2HG1      VAL   6  -2.978  -6.222   0.552
   63   3HG1  VAL   6          3HG1      VAL   6  -2.305  -4.815  -0.271
   64   1HG2  VAL   6          1HG2      VAL   6  -3.760  -5.277   3.149
   65   2HG2  VAL   6          2HG2      VAL   6  -2.942  -3.717   3.095
   66   3HG2  VAL   6          3HG2      VAL   6  -2.168  -5.141   2.403
   67    H    VAL   7           H        VAL   7  -2.848  -2.366  -1.528
   68    HA   VAL   7           HA       VAL   7  -5.611  -2.059  -2.513
   69    HB   VAL   7           HB       VAL   7  -3.147  -0.732  -3.660
   70   1HG1  VAL   7          1HG1      VAL   7  -5.137  -1.242  -5.163
   71   2HG1  VAL   7          2HG1      VAL   7  -4.584   0.431  -5.108
   72   3HG1  VAL   7          3HG1      VAL   7  -6.020  -0.054  -4.206
   73   1HG2  VAL   7          1HG2      VAL   7  -4.312  -0.056  -1.294
   74   2HG2  VAL   7          2HG2      VAL   7  -5.205   0.953  -2.431
   75   3HG2  VAL   7          3HG2      VAL   7  -3.447   1.063  -2.348
   76    H    ASP   8           H        ASP   8  -6.206  -3.713  -3.754
   77    HA   ASP   8           HA       ASP   8  -4.286  -4.777  -5.688
   78   1HB   ASP   8          2HB       ASP   8  -3.987  -6.396  -4.039
   79   2HB   ASP   8          1HB       ASP   8  -5.660  -6.317  -3.508
   80    H    ASP   9           H        ASP   9  -5.352  -6.128  -7.356
   81    HA   ASP   9           HA       ASP   9  -7.560  -4.788  -8.454
   82   1HB   ASP   9          2HB       ASP   9  -6.025  -5.843  -9.936
   83   2HB   ASP   9          1HB       ASP   9  -6.231  -7.403  -9.158
   84    H    GLU  10           H        GLU  10  -7.712  -8.307  -8.120
   85    HA   GLU  10           HA       GLU  10 -10.325  -7.982  -6.797
   86   1HB   GLU  10          2HB       GLU  10  -9.725  -9.150  -9.325
   87   2HB   GLU  10          1HB       GLU  10 -10.256 -10.435  -8.250
   88   1HG   GLU  10          2HG       GLU  10 -11.832  -7.912  -8.396
   89   2HG   GLU  10          1HG       GLU  10 -11.973  -9.102  -9.689
   90    H    GLU  11           H        GLU  11 -10.891 -10.670  -6.398
   91    HA   GLU  11           HA       GLU  11 -10.477 -12.477  -5.074
   92   1HB   GLU  11          2HB       GLU  11  -7.617 -11.565  -4.796
   93   2HB   GLU  11          1HB       GLU  11  -8.260 -13.186  -4.585
   94   1HG   GLU  11          2HG       GLU  11  -8.967 -12.700  -7.146
   95   2HG   GLU  11          1HG       GLU  11  -7.477 -11.764  -7.029
   96    H    SER  12           H        SER  12 -11.158 -12.608  -3.047
   97    HA   SER  12           HA       SER  12 -11.386 -10.435  -1.341
   98   1HB   SER  12          2HB       SER  12 -12.839 -12.252  -0.943
   99   2HB   SER  12          1HB       SER  12 -11.508 -13.405  -0.848
  100    HG   SER  12           HG       SER  12 -11.908 -13.068   1.228
  101    H    ILE  13           H        ILE  13  -9.753  -9.302  -0.510
  102    HA   ILE  13           HA       ILE  13  -7.853  -8.722   0.563
  103    HB   ILE  13           HB       ILE  13  -8.046 -11.481   1.682
  104   1HG1  ILE  13          2HG1      ILE  13 -10.127 -10.176   1.980
  105   2HG1  ILE  13          1HG1      ILE  13  -9.339 -10.558   3.508
  106   1HG2  ILE  13          1HG2      ILE  13  -5.923 -10.696   2.259
  107   2HG2  ILE  13          2HG2      ILE  13  -6.912 -10.354   3.677
  108   3HG2  ILE  13          3HG2      ILE  13  -6.517  -9.060   2.545
  109   1HD1  ILE  13          1HD1      ILE  13  -8.291  -8.246   3.350
  110   2HD1  ILE  13          2HD1      ILE  13 -10.015  -8.336   3.709
  111   3HD1  ILE  13          3HD1      ILE  13  -9.474  -7.931   2.081
  112    H    THR  14           H        THR  14  -5.537  -9.303   0.837
  113    HA   THR  14           HA       THR  14  -4.578 -10.614  -1.576
  114    HB   THR  14           HB       THR  14  -2.391  -9.621  -0.959
  115    HG1  THR  14           1HG      THR  14  -3.785  -8.418   1.192
  116   1HG2  THR  14          1HG2      THR  14  -2.861  -7.407  -1.477
  117   2HG2  THR  14          2HG2      THR  14  -4.421  -7.445  -0.657
  118   3HG2  THR  14          3HG2      THR  14  -4.209  -8.294  -2.187
  119    H    SER  15           H        SER  15  -4.041 -12.698  -1.526
  120    HA   SER  15           HA       SER  15  -4.039 -14.340   0.670
  121   1HB   SER  15          2HB       SER  15  -2.796 -15.968  -0.719
  122   2HB   SER  15          1HB       SER  15  -4.111 -15.199  -1.609
  123    HG   SER  15           HG       SER  15  -2.678 -14.047  -2.764
  124    H    SER  16           H        SER  16  -2.615 -15.054   2.158
  125    HA   SER  16           HA       SER  16  -0.693 -15.311   3.358
  126   1HB   SER  16          2HB       SER  16   0.834 -13.709   1.317
  127   2HB   SER  16          1HB       SER  16   1.434 -14.958   2.408
  128    HG   SER  16           HG       SER  16   0.479 -15.222  -0.076
  129    H    LEU  17           H        LEU  17  -2.217 -12.455   2.706
  130    HA   LEU  17           HA       LEU  17  -0.423 -10.773   4.263
  131   1HB   LEU  17          2HB       LEU  17  -2.172 -10.256   2.208
  132   2HB   LEU  17          1HB       LEU  17  -3.093  -9.731   3.596
  133    HG   LEU  17           HG       LEU  17  -0.930  -8.406   2.207
  134   1HD1  LEU  17          1HD1      LEU  17  -2.766  -7.100   2.474
  135   2HD1  LEU  17          2HD1      LEU  17  -1.831  -6.574   3.875
  136   3HD1  LEU  17          3HD1      LEU  17  -3.136  -7.745   4.074
  137   1HD2  LEU  17          1HD2      LEU  17  -0.004  -7.445   4.429
  138   2HD2  LEU  17          2HD2      LEU  17   0.645  -8.963   3.810
  139   3HD2  LEU  17          3HD2      LEU  17  -0.535  -8.978   5.120
  140    H    SER  18           H        SER  18  -3.825 -11.825   4.444
  141    HA   SER  18           HA       SER  18  -4.544 -10.791   6.870
  142   1HB   SER  18          2HB       SER  18  -5.732 -12.475   5.106
  143   2HB   SER  18          1HB       SER  18  -5.426 -13.581   6.446
  144    HG   SER  18           HG       SER  18  -6.840 -11.122   6.552
  145    H    ALA  19           H        ALA  19  -3.274 -14.100   6.438
  146    HA   ALA  19           HA       ALA  19  -3.009 -14.808   9.085
  147   1HB   ALA  19          1HB       ALA  19  -1.683 -15.626   6.570
  148   2HB   ALA  19          2HB       ALA  19  -2.556 -16.592   7.761
  149   3HB   ALA  19          3HB       ALA  19  -0.893 -16.095   8.076
  150    H    ILE  20           H        ILE  20  -0.787 -12.947   7.082
  151    HA   ILE  20           HA       ILE  20   1.344 -12.817   8.920
  152    HB   ILE  20           HB       ILE  20   0.551 -11.110   6.571
  153   1HG1  ILE  20          2HG1      ILE  20   2.945 -12.884   7.075
  154   2HG1  ILE  20          1HG1      ILE  20   1.496 -13.372   6.200
  155   1HG2  ILE  20          1HG2      ILE  20   2.622 -10.547   8.626
  156   2HG2  ILE  20          2HG2      ILE  20   1.624  -9.436   7.690
  157   3HG2  ILE  20          3HG2      ILE  20   3.011 -10.221   6.937
  158   1HD1  ILE  20          1HD1      ILE  20   3.548 -11.338   5.403
  159   2HD1  ILE  20          2HD1      ILE  20   1.970 -11.462   4.625
  160   3HD1  ILE  20          3HD1      ILE  20   3.088 -12.823   4.568
  161    H    LEU  21           H        LEU  21  -0.875 -10.152   8.043
  162    HA   LEU  21           HA       LEU  21  -0.219  -8.435  10.094
  163   1HB   LEU  21          2HB       LEU  21  -2.998  -8.806   8.995
  164   2HB   LEU  21          1HB       LEU  21  -2.322  -7.349   9.703
  165    HG   LEU  21           HG       LEU  21  -0.764  -8.310   7.437
  166   1HD1  LEU  21          1HD1      LEU  21  -3.367  -8.809   7.039
  167   2HD1  LEU  21          2HD1      LEU  21  -2.260  -8.314   5.759
  168   3HD1  LEU  21          3HD1      LEU  21  -3.301  -7.120   6.535
  169   1HD2  LEU  21          1HD2      LEU  21  -1.867  -5.775   8.506
  170   2HD2  LEU  21          2HD2      LEU  21  -1.449  -5.838   6.793
  171   3HD2  LEU  21          3HD2      LEU  21  -0.223  -6.182   8.014
  172    H    GLU  22           H        GLU  22  -2.197 -11.299  10.194
  173    HA   GLU  22           HA       GLU  22  -3.431 -10.762  12.705
  174   1HB   GLU  22          2HB       GLU  22  -3.945 -12.520  10.748
  175   2HB   GLU  22          1HB       GLU  22  -3.056 -13.563  11.847
  176   1HG   GLU  22          2HG       GLU  22  -4.633 -12.821  13.653
  177   2HG   GLU  22          1HG       GLU  22  -5.589 -12.047  12.389
  178    H    GLU  23           H        GLU  23  -0.399 -12.132  11.688
  179    HA   GLU  23           HA       GLU  23   0.192 -13.293  14.264
  180   1HB   GLU  23          2HB       GLU  23   1.139 -14.459  12.449
  181   2HB   GLU  23          1HB       GLU  23   1.704 -12.982  11.681
  182   1HG   GLU  23          2HG       GLU  23   3.636 -13.024  12.776
  183   2HG   GLU  23          1HG       GLU  23   2.859 -13.396  14.314
  184    H    GLU  24           H        GLU  24   0.935 -10.379  12.467
  185    HA   GLU  24           HA       GLU  24   2.863  -9.437  14.385
  186   1HB   GLU  24          2HB       GLU  24   1.581  -8.210  11.959
  187   2HB   GLU  24          1HB       GLU  24   2.644  -7.292  13.017
  188   1HG   GLU  24          2HG       GLU  24   3.596  -9.895  11.940
  189   2HG   GLU  24          1HG       GLU  24   3.558  -8.489  10.874
  190    H    GLY  25           H        GLY  25  -0.513  -8.777  13.589
  191   1HA   GLY  25          2HA       GLY  25  -2.136  -8.110  15.161
  192   2HA   GLY  25          1HA       GLY  25  -0.846  -7.574  16.226
  193    H    TYR  26           H        TYR  26  -1.680  -6.820  12.856
  194    HA   TYR  26           HA       TYR  26  -1.458  -3.965  13.512
  195   1HB   TYR  26          2HB       TYR  26  -1.132  -5.545  10.983
  196   2HB   TYR  26          1HB       TYR  26  -1.479  -3.827  10.905
  197    HD1  TYR  26           1HD      TYR  26   0.539  -3.121   9.905
  198    HD2  TYR  26           2HD      TYR  26   0.647  -5.421  13.481
  199    HE1  TYR  26           1HE      TYR  26   2.931  -2.618  10.145
  200    HE2  TYR  26           2HE      TYR  26   3.041  -4.925  13.732
  201    HH   TYR  26           HH       TYR  26   4.638  -2.549  11.841
  202    H    HIS  27           H        HIS  27  -2.804  -2.735  11.646
  203    HA   HIS  27           HA       HIS  27  -5.573  -3.729  11.751
  204   1HB   HIS  27          2HB       HIS  27  -4.574  -1.415  13.002
  205   2HB   HIS  27          1HB       HIS  27  -5.416  -0.836  11.570
  206    HD1  HIS  27           1HD      HIS  27  -7.149   0.221  13.285
  207    HD2  HIS  27           2HD      HIS  27  -7.036  -3.930  13.176
  208    HE1  HIS  27           1HE      HIS  27  -9.257  -0.537  14.427
  209    HE2  HIS  27           2HE      HIS  27  -9.210  -3.051  14.269
  210    HA   PRO  28           HA       PRO  28  -4.290  -2.891   7.431
  211   1HB   PRO  28          2HB       PRO  28  -4.729  -5.314   6.397
  212   2HB   PRO  28          1HB       PRO  28  -3.275  -4.947   7.330
  213   1HG   PRO  28          2HG       PRO  28  -5.726  -6.434   8.144
  214   2HG   PRO  28          1HG       PRO  28  -4.035  -6.723   8.590
  215   1HD   PRO  28          2HD       PRO  28  -5.939  -5.391  10.145
  216   2HD   PRO  28          1HD       PRO  28  -4.184  -5.337  10.386
  217    H    ASP  29           H        ASP  29  -5.424  -2.625   5.558
  218    HA   ASP  29           HA       ASP  29  -8.254  -3.345   5.475
  219   1HB   ASP  29          2HB       ASP  29  -8.210  -1.059   6.373
  220   2HB   ASP  29          1HB       ASP  29  -7.197  -0.539   5.030
  221    H    THR  30           H        THR  30  -8.905  -3.888   3.408
  222    HA   THR  30           HA       THR  30  -6.834  -3.593   1.333
  223    HB   THR  30           HB       THR  30  -7.504  -5.668   0.395
  224    HG1  THR  30           1HG      THR  30  -9.609  -5.895   0.476
  225   1HG2  THR  30          1HG2      THR  30  -6.952  -7.207   2.016
  226   2HG2  THR  30          2HG2      THR  30  -7.788  -6.320   3.291
  227   3HG2  THR  30          3HG2      THR  30  -6.257  -5.717   2.655
  228    H    ALA  31           H        ALA  31  -7.363  -2.974  -0.701
  229    HA   ALA  31           HA       ALA  31 -10.129  -2.058  -1.142
  230   1HB   ALA  31          1HB       ALA  31  -8.199  -0.319  -0.845
  231   2HB   ALA  31          2HB       ALA  31  -9.403  -0.095  -2.114
  232   3HB   ALA  31          3HB       ALA  31  -7.815  -0.754  -2.511
  233    H    LYS  32           H        LYS  32 -10.120  -1.489  -3.765
  234    HA   LYS  32           HA       LYS  32  -9.298  -4.023  -5.027
  235   1HB   LYS  32          2HB       LYS  32 -11.549  -2.445  -6.176
  236   2HB   LYS  32          1HB       LYS  32 -11.289  -4.183  -6.164
  237   1HG   LYS  32          2HG       LYS  32 -12.036  -4.371  -3.925
  238   2HG   LYS  32          1HG       LYS  32 -12.008  -2.622  -3.702
  239   1HD   LYS  32          2HD       LYS  32 -14.270  -3.102  -4.019
  240   2HD   LYS  32          1HD       LYS  32 -13.733  -2.559  -5.610
  241   1HE   LYS  32          2HE       LYS  32 -13.244  -5.238  -5.742
  242   2HE   LYS  32          1HE       LYS  32 -14.690  -5.188  -4.733
  243   1HZ   LYS  32          1HZ       LYS  32 -15.929  -4.224  -6.407
  244   2HZ   LYS  32          2HZ       LYS  32 -14.948  -5.297  -7.274
  245   3HZ   LYS  32          3HZ       LYS  32 -14.576  -3.647  -7.243
  246    H    THR  33           H        THR  33  -9.221  -0.586  -5.182
  247    HA   THR  33           HA       THR  33  -7.267  -0.621  -7.252
  248    HB   THR  33           HB       THR  33  -8.871   1.095  -8.578
  249    HG1  THR  33           1HG      THR  33 -10.620   0.511  -7.114
  250   1HG2  THR  33          1HG2      THR  33  -7.682  -1.049  -9.375
  251   2HG2  THR  33          2HG2      THR  33  -9.090  -0.465 -10.259
  252   3HG2  THR  33          3HG2      THR  33  -9.254  -1.811  -9.133
  253    H    LEU  34           H        LEU  34  -6.619   1.671  -7.840
  254    HA   LEU  34           HA       LEU  34  -6.045   3.120  -5.546
  255   1HB   LEU  34          2HB       LEU  34  -6.207   4.178  -8.371
  256   2HB   LEU  34          1HB       LEU  34  -5.348   4.930  -7.039
  257    HG   LEU  34           HG       LEU  34  -4.639   2.146  -7.886
  258   1HD1  LEU  34          1HD1      LEU  34  -2.785   3.578  -9.187
  259   2HD1  LEU  34          2HD1      LEU  34  -4.180   4.637  -9.396
  260   3HD1  LEU  34          3HD1      LEU  34  -4.251   2.964  -9.950
  261   1HD2  LEU  34          1HD2      LEU  34  -3.776   3.775  -5.861
  262   2HD2  LEU  34          2HD2      LEU  34  -2.563   4.047  -7.113
  263   3HD2  LEU  34          3HD2      LEU  34  -2.878   2.412  -6.532
  264    H    ARG  35           H        ARG  35  -8.804   3.308  -7.686
  265    HA   ARG  35           HA       ARG  35  -9.824   5.772  -6.732
  266   1HB   ARG  35          2HB       ARG  35 -12.018   4.901  -7.664
  267   2HB   ARG  35          1HB       ARG  35 -10.683   5.019  -8.803
  268   1HG   ARG  35          2HG       ARG  35 -11.101   2.920  -9.365
  269   2HG   ARG  35          1HG       ARG  35 -10.494   2.445  -7.780
  270   1HD   ARG  35          2HD       ARG  35 -12.544   1.954  -7.009
  271   2HD   ARG  35          1HD       ARG  35 -13.269   3.374  -7.762
  272    HE   ARG  35           HE       ARG  35 -13.152   0.707  -8.833
  273   1HH1  ARG  35          1HH1      ARG  35 -13.470   4.095  -9.610
  274   2HH1  ARG  35          2HH1      ARG  35 -14.281   3.802 -11.112
  275   1HH2  ARG  35          1HH2      ARG  35 -14.218   0.321 -10.808
  276   2HH2  ARG  35          2HH2      ARG  35 -14.706   1.660 -11.792
  277    H    GLU  36           H        GLU  36 -10.481   2.393  -5.874
  278    HA   GLU  36           HA       GLU  36 -12.404   2.936  -3.886
  279   1HB   GLU  36          2HB       GLU  36 -10.887   0.619  -4.824
  280   2HB   GLU  36          1HB       GLU  36 -11.176   0.582  -3.090
  281   1HG   GLU  36          2HG       GLU  36 -13.503   1.268  -4.752
  282   2HG   GLU  36          1HG       GLU  36 -12.886  -0.373  -4.932
  283    H    ALA  37           H        ALA  37  -8.896   2.771  -3.861
  284    HA   ALA  37           HA       ALA  37  -8.535   2.785  -1.060
  285   1HB   ALA  37          1HB       ALA  37  -6.337   4.109  -2.093
  286   2HB   ALA  37          2HB       ALA  37  -6.870   3.085  -3.425
  287   3HB   ALA  37          3HB       ALA  37  -6.491   2.368  -1.860
  288    H    GLU  38           H        GLU  38  -8.333   5.465  -3.422
  289    HA   GLU  38           HA       GLU  38  -7.940   7.575  -1.736
  290   1HB   GLU  38          2HB       GLU  38  -9.786   7.528  -4.129
  291   2HB   GLU  38          1HB       GLU  38  -9.126   8.976  -3.383
  292   1HG   GLU  38          2HG       GLU  38  -7.050   8.651  -4.256
  293   2HG   GLU  38          1HG       GLU  38  -7.222   6.897  -4.303
  294    H    LYS  39           H        LYS  39 -11.014   5.982  -2.472
  295    HA   LYS  39           HA       LYS  39 -12.707   7.703  -1.055
  296   1HB   LYS  39          2HB       LYS  39 -13.620   6.022  -2.535
  297   2HB   LYS  39          1HB       LYS  39 -12.917   4.730  -1.573
  298   1HG   LYS  39          2HG       LYS  39 -14.772   6.560  -0.179
  299   2HG   LYS  39          1HG       LYS  39 -15.471   5.471  -1.380
  300   1HD   LYS  39          2HD       LYS  39 -14.629   3.552  -0.240
  301   2HD   LYS  39          1HD       LYS  39 -13.651   4.548   0.839
  302   1HE   LYS  39          2HE       LYS  39 -16.414   5.339   0.971
  303   2HE   LYS  39          1HE       LYS  39 -16.258   3.608   1.266
  304   1HZ   LYS  39          1HZ       LYS  39 -16.004   5.354   3.190
  305   2HZ   LYS  39          2HZ       LYS  39 -14.404   5.406   2.640
  306   3HZ   LYS  39          3HZ       LYS  39 -15.072   3.943   3.160
  307    H    LYS  40           H        LYS  40 -10.944   4.809  -0.018
  308    HA   LYS  40           HA       LYS  40 -11.853   4.915   2.678
  309   1HB   LYS  40          2HB       LYS  40  -9.765   3.391   1.196
  310   2HB   LYS  40          1HB       LYS  40  -9.727   3.398   2.954
  311   1HG   LYS  40          2HG       LYS  40 -12.199   2.666   1.421
  312   2HG   LYS  40          1HG       LYS  40 -10.949   1.483   1.815
  313   1HD   LYS  40          2HD       LYS  40 -11.242   1.885   4.172
  314   2HD   LYS  40          1HD       LYS  40 -12.365   3.207   3.847
  315   1HE   LYS  40          2HE       LYS  40 -14.042   1.758   3.110
  316   2HE   LYS  40          1HE       LYS  40 -12.909   0.432   2.851
  317   1HZ   LYS  40          1HZ       LYS  40 -14.221   1.301   5.296
  318   2HZ   LYS  40          2HZ       LYS  40 -12.612   0.804   5.457
  319   3HZ   LYS  40          3HZ       LYS  40 -13.764  -0.251   4.805
  320    H    ILE  41           H        ILE  41  -8.923   5.998   1.019
  321    HA   ILE  41           HA       ILE  41  -7.604   6.892   3.382
  322    HB   ILE  41           HB       ILE  41  -7.090   7.779   0.544
  323   1HG1  ILE  41          2HG1      ILE  41  -5.776   5.520   2.067
  324   2HG1  ILE  41          1HG1      ILE  41  -7.045   5.290   0.869
  325   1HG2  ILE  41          1HG2      ILE  41  -5.753   8.228   3.127
  326   2HG2  ILE  41          2HG2      ILE  41  -5.749   9.205   1.659
  327   3HG2  ILE  41          3HG2      ILE  41  -4.693   7.798   1.784
  328   1HD1  ILE  41          1HD1      ILE  41  -5.155   6.845  -0.426
  329   2HD1  ILE  41          2HD1      ILE  41  -5.431   5.116  -0.636
  330   3HD1  ILE  41          3HD1      ILE  41  -4.213   5.682   0.506
  331    H    LYS  42           H        LYS  42 -10.042   8.247   1.363
  332    HA   LYS  42           HA       LYS  42  -9.574  10.982   1.754
  333   1HB   LYS  42          2HB       LYS  42 -11.644   9.335   0.660
  334   2HB   LYS  42          1HB       LYS  42 -12.354  10.611   1.638
  335   1HG   LYS  42          2HG       LYS  42 -11.757  12.232   0.200
  336   2HG   LYS  42          1HG       LYS  42 -10.219  11.461  -0.197
  337   1HD   LYS  42          2HD       LYS  42 -11.571   9.752  -1.495
  338   2HD   LYS  42          1HD       LYS  42 -12.952  10.833  -1.291
  339   1HE   LYS  42          2HE       LYS  42 -11.193  12.602  -2.216
  340   2HE   LYS  42          1HE       LYS  42 -10.511  11.149  -2.947
  341   1HZ   LYS  42          1HZ       LYS  42 -12.921  10.735  -3.704
  342   2HZ   LYS  42          2HZ       LYS  42 -11.997  11.885  -4.532
  343   3HZ   LYS  42          3HZ       LYS  42 -13.148  12.382  -3.396
  344    H    GLU  43           H        GLU  43 -10.718   8.564   3.905
  345    HA   GLU  43           HA       GLU  43 -11.352  10.641   5.881
  346   1HB   GLU  43          2HB       GLU  43 -12.701   7.948   5.653
  347   2HB   GLU  43          1HB       GLU  43 -13.067   9.201   6.831
  348   1HG   GLU  43          2HG       GLU  43 -13.787  10.680   5.007
  349   2HG   GLU  43          1HG       GLU  43 -13.468   9.384   3.854
  350    H    LEU  44           H        LEU  44 -10.592   7.170   5.597
  351    HA   LEU  44           HA       LEU  44  -9.545   6.924   8.206
  352   1HB   LEU  44          2HB       LEU  44  -9.894   5.255   5.890
  353   2HB   LEU  44          1HB       LEU  44  -8.299   4.997   6.567
  354    HG   LEU  44           HG       LEU  44  -9.879   3.399   7.485
  355   1HD1  LEU  44          1HD1      LEU  44  -9.386   3.677   9.790
  356   2HD1  LEU  44          2HD1      LEU  44  -9.229   5.425   9.614
  357   3HD1  LEU  44          3HD1      LEU  44  -8.030   4.354   8.889
  358   1HD2  LEU  44          1HD2      LEU  44 -11.951   4.554   7.265
  359   2HD2  LEU  44          2HD2      LEU  44 -11.408   5.853   8.328
  360   3HD2  LEU  44          3HD2      LEU  44 -11.703   4.242   8.983
  361    H    PHE  45           H        PHE  45  -7.781   7.860   8.978
  362    HA   PHE  45           HA       PHE  45  -5.762   8.961   7.278
  363   1HB   PHE  45          2HB       PHE  45  -6.378  10.040   9.394
  364   2HB   PHE  45          1HB       PHE  45  -5.818   8.629  10.286
  365    HD1  PHE  45           1HD      PHE  45  -4.420  10.780   7.570
  366    HD2  PHE  45           2HD      PHE  45  -3.853   8.998  11.393
  367    HE1  PHE  45           1HE      PHE  45  -2.164  11.756   7.686
  368    HE2  PHE  45           2HE      PHE  45  -1.597   9.972  11.517
  369    HZ   PHE  45           HZ       PHE  45  -0.750  11.354   9.662
  370    H    PHE  46           H        PHE  46  -5.472   6.695   6.295
  371    HA   PHE  46           HA       PHE  46  -4.084   4.691   7.697
  372   1HB   PHE  46          2HB       PHE  46  -4.425   5.335   4.786
  373   2HB   PHE  46          1HB       PHE  46  -3.330   4.053   5.289
  374    HD1  PHE  46           1HD      PHE  46  -6.686   4.905   4.521
  375    HD2  PHE  46           2HD      PHE  46  -4.294   2.203   6.776
  376    HE1  PHE  46           1HE      PHE  46  -8.577   3.335   4.639
  377    HE2  PHE  46           2HE      PHE  46  -6.182   0.628   6.897
  378    HZ   PHE  46           HZ       PHE  46  -8.327   1.195   5.829
  379    HA   PRO  47           HA       PRO  47  -0.083   6.685   7.744
  380   1HB   PRO  47          2HB       PRO  47   1.169   4.608   9.106
  381   2HB   PRO  47          1HB       PRO  47   0.330   5.966   9.850
  382   1HG   PRO  47          2HG       PRO  47  -0.435   3.205   9.811
  383   2HG   PRO  47          1HG       PRO  47  -1.246   4.555  10.609
  384   1HD   PRO  47          2HD       PRO  47  -1.931   3.197   8.115
  385   2HD   PRO  47          1HD       PRO  47  -2.904   4.303   9.099
  386    H    VAL  48           H        VAL  48  -0.648   3.417   6.629
  387    HA   VAL  48           HA       VAL  48   1.632   3.698   4.799
  388    HB   VAL  48           HB       VAL  48   0.811   1.067   6.013
  389   1HG1  VAL  48          1HG1      VAL  48   2.270   1.546   3.788
  390   2HG1  VAL  48          2HG1      VAL  48   2.483   0.134   4.822
  391   3HG1  VAL  48          3HG1      VAL  48   3.540   1.534   5.012
  392   1HG2  VAL  48          1HG2      VAL  48   1.572   2.615   7.764
  393   2HG2  VAL  48          2HG2      VAL  48   3.071   2.865   6.870
  394   3HG2  VAL  48          3HG2      VAL  48   2.690   1.272   7.524
  395    H    ILE  49           H        ILE  49   1.302   3.057   2.729
  396    HA   ILE  49           HA       ILE  49  -1.223   1.723   2.045
  397    HB   ILE  49           HB       ILE  49  -0.339   3.950   0.272
  398   1HG1  ILE  49          2HG1      ILE  49  -0.357   4.931   2.564
  399   2HG1  ILE  49          1HG1      ILE  49  -1.583   5.619   1.505
  400   1HG2  ILE  49          1HG2      ILE  49  -2.759   2.360   0.796
  401   2HG2  ILE  49          2HG2      ILE  49  -2.128   3.011  -0.717
  402   3HG2  ILE  49          3HG2      ILE  49  -3.026   4.055   0.385
  403   1HD1  ILE  49          1HD1      ILE  49  -1.885   4.339   4.037
  404   2HD1  ILE  49          2HD1      ILE  49  -2.805   3.466   2.813
  405   3HD1  ILE  49          3HD1      ILE  49  -3.084   5.190   3.064
  406    H    VAL  50           H        VAL  50  -0.502  -0.139   1.075
  407    HA   VAL  50           HA       VAL  50   1.735   0.112  -0.814
  408    HB   VAL  50           HB       VAL  50   0.725  -2.377   0.570
  409   1HG1  VAL  50          1HG1      VAL  50   3.236  -2.953  -0.189
  410   2HG1  VAL  50          2HG1      VAL  50   2.775  -1.846  -1.482
  411   3HG1  VAL  50          3HG1      VAL  50   1.817  -3.296  -1.179
  412   1HG2  VAL  50          1HG2      VAL  50   3.204  -1.964   1.574
  413   2HG2  VAL  50          2HG2      VAL  50   1.714  -1.456   2.369
  414   3HG2  VAL  50          3HG2      VAL  50   2.635  -0.303   1.402
  415    H    LEU  51           H        LEU  51   1.523  -0.690  -2.879
  416    HA   LEU  51           HA       LEU  51  -1.221  -1.299  -3.714
  417   1HB   LEU  51          2HB       LEU  51   0.098   0.607  -4.747
  418   2HB   LEU  51          1HB       LEU  51   1.109  -0.614  -5.494
  419    HG   LEU  51           HG       LEU  51  -0.899  -1.522  -6.644
  420   1HD1  LEU  51          1HD1      LEU  51  -2.825  -0.970  -5.612
  421   2HD1  LEU  51          2HD1      LEU  51  -2.746   0.428  -6.683
  422   3HD1  LEU  51          3HD1      LEU  51  -2.195   0.565  -5.013
  423   1HD2  LEU  51          1HD2      LEU  51  -0.328   1.398  -7.137
  424   2HD2  LEU  51          2HD2      LEU  51  -1.065   0.277  -8.282
  425   3HD2  LEU  51          3HD2      LEU  51   0.605   0.039  -7.766
  426    H    ASP  52           H        ASP  52  -1.543  -2.900  -5.397
  427    HA   ASP  52           HA       ASP  52   0.496  -4.987  -5.592
  428   1HB   ASP  52          2HB       ASP  52  -1.187  -5.421  -3.670
  429   2HB   ASP  52          1HB       ASP  52  -2.346  -5.745  -4.956
  430    H    VAL  53           H        VAL  53   0.623  -4.087  -7.728
  431    HA   VAL  53           HA       VAL  53  -1.552  -4.023  -9.520
  432    HB   VAL  53           HB       VAL  53   1.382  -4.302 -10.189
  433   1HG1  VAL  53          1HG1      VAL  53   0.279  -4.701 -12.182
  434   2HG1  VAL  53          2HG1      VAL  53   0.525  -2.955 -12.233
  435   3HG1  VAL  53          3HG1      VAL  53  -1.049  -3.610 -11.785
  436   1HG2  VAL  53          1HG2      VAL  53   1.695  -2.100  -9.818
  437   2HG2  VAL  53          2HG2      VAL  53   0.337  -2.306  -8.711
  438   3HG2  VAL  53          3HG2      VAL  53   0.063  -1.672 -10.334
  439    H    TRP  54           H        TRP  54  -2.364  -6.237  -8.772
  440    HA   TRP  54           HA       TRP  54  -1.062  -8.583  -9.715
  441   1HB   TRP  54          2HB       TRP  54  -2.671  -8.748  -7.913
  442   2HB   TRP  54          1HB       TRP  54  -3.939  -8.066  -8.925
  443    HD1  TRP  54           HD       TRP  54  -5.605  -9.924  -9.466
  444    HE1  TRP  54           1HE      TRP  54  -5.455 -12.393 -10.175
  445    HE3  TRP  54           3HE      TRP  54  -0.532 -10.516  -9.276
  446    HZ2  TRP  54           2HZ      TRP  54  -3.450 -14.337 -10.598
  447    HZ3  TRP  54           3HZ      TRP  54   0.422 -12.712  -9.846
  448    HH2  TRP  54           HH       TRP  54  -1.008 -14.581 -10.493
  449    H    MET  55           H        MET  55  -4.291  -7.564 -10.773
  450    HA   MET  55           HA       MET  55  -3.412  -7.577 -13.551
  451   1HB   MET  55          2HB       MET  55  -5.110  -9.135 -14.269
  452   2HB   MET  55          1HB       MET  55  -4.117  -9.896 -13.035
  453   1HG   MET  55          2HG       MET  55  -5.898  -9.260 -11.375
  454   2HG   MET  55          1HG       MET  55  -6.902  -8.811 -12.752
  455   1HE   MET  55          1HE       MET  55  -8.512 -10.797 -11.215
  456   2HE   MET  55          2HE       MET  55  -7.049 -11.053 -10.265
  457   3HE   MET  55          3HE       MET  55  -7.865 -12.426 -11.014
  458    HA   PRO  56           HA       PRO  56  -6.991  -4.664 -12.767
  459   1HB   PRO  56          2HB       PRO  56  -5.978  -2.637 -11.279
  460   2HB   PRO  56          1HB       PRO  56  -6.637  -4.107 -10.560
  461   1HG   PRO  56          2HG       PRO  56  -3.882  -3.194 -10.634
  462   2HG   PRO  56          1HG       PRO  56  -4.579  -4.536  -9.723
  463   1HD   PRO  56          2HD       PRO  56  -3.150  -4.567 -12.293
  464   2HD   PRO  56          1HD       PRO  56  -3.469  -5.892 -11.163
  465    H    ASP  57           H        ASP  57  -6.750  -1.940 -12.874
  466    HA   ASP  57           HA       ASP  57  -5.477  -1.553 -15.467
  467   1HB   ASP  57          2HB       ASP  57  -7.807  -0.810 -15.164
  468   2HB   ASP  57          1HB       ASP  57  -7.287   0.285 -13.887
  469    H    GLY  58           H        GLY  58  -5.503  -0.083 -12.235
  470   1HA   GLY  58          2HA       GLY  58  -4.009   1.294 -11.173
  471   2HA   GLY  58          1HA       GLY  58  -2.789   0.366 -12.027
  472    H    ASP  59           H        ASP  59  -1.412   1.596 -13.094
  473    HA   ASP  59           HA       ASP  59  -0.520   3.282 -14.331
  474   1HB   ASP  59          2HB       ASP  59  -3.339   3.182 -15.317
  475   2HB   ASP  59          1HB       ASP  59  -2.325   4.535 -15.810
  476    H    GLY  60           H        GLY  60  -1.461   3.775 -11.627
  477   1HA   GLY  60          2HA       GLY  60  -2.394   6.548 -11.720
  478   2HA   GLY  60          1HA       GLY  60  -2.282   5.540 -10.286
  479    H    VAL  61           H        VAL  61  -0.051   6.754 -12.794
  480    HA   VAL  61           HA       VAL  61   2.242   6.782 -11.235
  481    HB   VAL  61           HB       VAL  61   1.527   8.657 -13.493
  482   1HG1  VAL  61          1HG1      VAL  61   3.980   8.199 -11.931
  483   2HG1  VAL  61          2HG1      VAL  61   3.423   9.640 -12.782
  484   3HG1  VAL  61          3HG1      VAL  61   4.179   8.323 -13.679
  485   1HG2  VAL  61          1HG2      VAL  61   2.712   5.896 -13.455
  486   2HG2  VAL  61          2HG2      VAL  61   2.907   6.989 -14.824
  487   3HG2  VAL  61          3HG2      VAL  61   1.295   6.469 -14.333
  488    H    ASN  62           H        ASN  62  -0.274   9.218 -11.620
  489    HA   ASN  62           HA       ASN  62   1.130  11.075  -9.877
  490   1HB   ASN  62          2HB       ASN  62  -0.902  11.282 -11.903
  491   2HB   ASN  62          1HB       ASN  62  -1.468  12.038 -10.418
  492   1HD2  ASN  62          1HD2      ASN  62   0.866  12.128 -12.974
  493   2HD2  ASN  62          2HD2      ASN  62   1.497  13.697 -12.623
  494    H    PHE  63           H        PHE  63  -0.224   8.397  -9.045
  495    HA   PHE  63           HA       PHE  63  -2.270   9.264  -7.214
  496   1HB   PHE  63          2HB       PHE  63  -2.406   7.032  -8.210
  497   2HB   PHE  63          1HB       PHE  63  -0.868   6.593  -7.472
  498    HD1  PHE  63           1HD      PHE  63  -4.097   8.093  -6.353
  499    HD2  PHE  63           2HD      PHE  63  -1.034   5.227  -5.638
  500    HE1  PHE  63           1HE      PHE  63  -5.282   7.338  -4.336
  501    HE2  PHE  63           2HE      PHE  63  -2.214   4.467  -3.616
  502    HZ   PHE  63           HZ       PHE  63  -4.342   5.526  -2.964
  503    H    ILE  64           H        ILE  64   1.129   8.350  -7.035
  504    HA   ILE  64           HA       ILE  64   1.521   8.109  -4.331
  505    HB   ILE  64           HB       ILE  64   3.381   9.531  -6.242
  506   1HG1  ILE  64          2HG1      ILE  64   4.306   6.942  -5.823
  507   2HG1  ILE  64          1HG1      ILE  64   2.565   6.742  -5.995
  508   1HG2  ILE  64          1HG2      ILE  64   4.979   8.258  -4.479
  509   2HG2  ILE  64          2HG2      ILE  64   3.615   8.663  -3.438
  510   3HG2  ILE  64          3HG2      ILE  64   4.468   9.937  -4.310
  511   1HD1  ILE  64          1HD1      ILE  64   4.275   8.236  -7.965
  512   2HD1  ILE  64          2HD1      ILE  64   2.592   7.745  -8.151
  513   3HD1  ILE  64          3HD1      ILE  64   3.864   6.527  -8.106
  514    H    ASP  65           H        ASP  65   0.852  10.995  -6.159
  515    HA   ASP  65           HA       ASP  65   1.628  12.830  -4.101
  516   1HB   ASP  65          2HB       ASP  65   1.208  13.134  -6.742
  517   2HB   ASP  65          1HB       ASP  65  -0.360  13.664  -6.142
  518    H    PHE  66           H        PHE  66  -1.374  11.283  -5.119
  519    HA   PHE  66           HA       PHE  66  -3.177  12.750  -3.576
  520   1HB   PHE  66          2HB       PHE  66  -4.017  11.233  -5.232
  521   2HB   PHE  66          1HB       PHE  66  -3.208   9.864  -4.478
  522    HD1  PHE  66           1HD      PHE  66  -4.038   9.000  -2.296
  523    HD2  PHE  66           2HD      PHE  66  -6.158  11.934  -4.534
  524    HE1  PHE  66           1HE      PHE  66  -6.074   8.513  -1.002
  525    HE2  PHE  66           2HE      PHE  66  -8.197  11.452  -3.243
  526    HZ   PHE  66           HZ       PHE  66  -8.155   9.739  -1.476
  527    H    ILE  67           H        ILE  67  -1.281   9.865  -2.773
  528    HA   ILE  67           HA       ILE  67  -2.300   9.438  -0.201
  529    HB   ILE  67           HB       ILE  67   0.454   8.841  -1.295
  530   1HG1  ILE  67          2HG1      ILE  67  -0.696   6.453  -1.124
  531   2HG1  ILE  67          1HG1      ILE  67  -2.166   7.410  -1.268
  532   1HG2  ILE  67          1HG2      ILE  67   0.955   8.569   0.892
  533   2HG2  ILE  67          2HG2      ILE  67   0.126   7.030   0.665
  534   3HG2  ILE  67          3HG2      ILE  67  -0.733   8.399   1.370
  535   1HD1  ILE  67          1HD1      ILE  67  -0.186   8.170  -3.234
  536   2HD1  ILE  67          2HD1      ILE  67  -1.867   7.684  -3.448
  537   3HD1  ILE  67          3HD1      ILE  67  -0.604   6.459  -3.332
  538    H    LYS  68           H        LYS  68   0.365  11.470  -1.343
  539    HA   LYS  68           HA       LYS  68   1.063  12.352   1.304
  540   1HB   LYS  68          2HB       LYS  68   1.842  13.501  -1.383
  541   2HB   LYS  68          1HB       LYS  68   2.590  13.891   0.160
  542   1HG   LYS  68          2HG       LYS  68   2.545  11.033  -0.521
  543   2HG   LYS  68          1HG       LYS  68   3.534  12.051  -1.571
  544   1HD   LYS  68          2HD       LYS  68   4.859  12.798   0.238
  545   2HD   LYS  68          1HD       LYS  68   3.723  12.160   1.429
  546   1HE   LYS  68          2HE       LYS  68   4.851  10.201  -0.465
  547   2HE   LYS  68          1HE       LYS  68   5.986  10.899   0.689
  548   1HZ   LYS  68          1HZ       LYS  68   3.955  10.309   2.296
  549   2HZ   LYS  68          2HZ       LYS  68   5.225   9.237   1.976
  550   3HZ   LYS  68          3HZ       LYS  68   3.762   9.089   1.141
  551    H    GLU  69           H        GLU  69  -1.137  13.331  -1.175
  552    HA   GLU  69           HA       GLU  69  -1.480  16.035  -0.459
  553   1HB   GLU  69          2HB       GLU  69  -2.261  14.865  -2.578
  554   2HB   GLU  69          1HB       GLU  69  -3.612  14.262  -1.627
  555   1HG   GLU  69          2HG       GLU  69  -3.637  16.959  -1.096
  556   2HG   GLU  69          1HG       GLU  69  -3.171  16.886  -2.795
  557    H    ASN  70           H        ASN  70  -3.072  13.065   0.586
  558    HA   ASN  70           HA       ASN  70  -4.391  14.600   2.728
  559   1HB   ASN  70          2HB       ASN  70  -5.387  11.931   1.776
  560   2HB   ASN  70          1HB       ASN  70  -6.263  13.198   2.629
  561   1HD2  ASN  70          1HD2      ASN  70  -4.627  12.520  -0.432
  562   2HD2  ASN  70          2HD2      ASN  70  -5.682  13.473  -1.410
  563    H    SER  71           H        SER  71  -1.741  12.954   2.396
  564    HA   SER  71           HA       SER  71  -1.681  12.039   5.094
  565   1HB   SER  71          2HB       SER  71  -2.323  10.119   2.993
  566   2HB   SER  71          1HB       SER  71  -0.880   9.662   3.897
  567    HG   SER  71           HG       SER  71  -2.405   8.875   5.168
  568    HA   PRO  72           HA       PRO  72   2.333  13.288   3.049
  569   1HB   PRO  72          2HB       PRO  72   2.539  15.121   5.323
  570   2HB   PRO  72          1HB       PRO  72   2.649  15.470   3.596
  571   1HG   PRO  72          2HG       PRO  72   0.541  16.241   5.095
  572   2HG   PRO  72          1HG       PRO  72   0.384  15.802   3.384
  573   1HD   PRO  72          2HD       PRO  72  -0.273  14.196   5.823
  574   2HD   PRO  72          1HD       PRO  72  -1.160  14.333   4.289
  575    H    ASP  73           H        ASP  73   1.300  12.351   6.169
  576    HA   ASP  73           HA       ASP  73   4.017  11.586   6.953
  577   1HB   ASP  73          2HB       ASP  73   1.951  12.770   8.391
  578   2HB   ASP  73          1HB       ASP  73   2.005  11.108   8.969
  579    H    SER  74           H        SER  74   2.390  10.148   4.965
  580    HA   SER  74           HA       SER  74   2.046   7.588   6.374
  581   1HB   SER  74          2HB       SER  74  -0.019   8.368   5.331
  582   2HB   SER  74          1HB       SER  74   0.804   8.526   3.778
  583    HG   SER  74           HG       SER  74  -0.334   6.357   4.864
  584    H    VAL  75           H        VAL  75   2.196   5.746   4.477
  585    HA   VAL  75           HA       VAL  75   4.776   6.198   3.127
  586    HB   VAL  75           HB       VAL  75   3.912   3.626   4.469
  587   1HG1  VAL  75          1HG1      VAL  75   5.888   4.197   2.465
  588   2HG1  VAL  75          2HG1      VAL  75   5.454   2.652   3.191
  589   3HG1  VAL  75          3HG1      VAL  75   6.681   3.667   3.947
  590   1HG2  VAL  75          1HG2      VAL  75   4.531   4.764   6.318
  591   2HG2  VAL  75          2HG2      VAL  75   5.462   5.953   5.408
  592   3HG2  VAL  75          3HG2      VAL  75   6.157   4.371   5.761
  593    H    VAL  76           H        VAL  76   5.041   5.297   1.110
  594    HA   VAL  76           HA       VAL  76   2.705   3.917  -0.042
  595    HB   VAL  76           HB       VAL  76   4.414   5.786  -1.662
  596   1HG1  VAL  76          1HG1      VAL  76   2.598   3.956  -2.439
  597   2HG1  VAL  76          2HG1      VAL  76   2.937   5.441  -3.330
  598   3HG1  VAL  76          3HG1      VAL  76   1.556   5.365  -2.235
  599   1HG2  VAL  76          1HG2      VAL  76   2.297   6.469   0.279
  600   2HG2  VAL  76          2HG2      VAL  76   2.189   7.248  -1.300
  601   3HG2  VAL  76          3HG2      VAL  76   3.644   7.436  -0.323
  602    H    ILE  77           H        ILE  77   3.577   1.875   0.007
  603    HA   ILE  77           HA       ILE  77   6.263   1.330  -0.813
  604    HB   ILE  77           HB       ILE  77   3.966  -0.601  -0.471
  605   1HG1  ILE  77          2HG1      ILE  77   4.383   0.646   1.583
  606   2HG1  ILE  77          1HG1      ILE  77   4.943  -1.014   1.762
  607   1HG2  ILE  77          1HG2      ILE  77   5.852  -1.472  -1.804
  608   2HG2  ILE  77          2HG2      ILE  77   5.660  -2.313  -0.266
  609   3HG2  ILE  77          3HG2      ILE  77   6.937  -1.114  -0.460
  610   1HD1  ILE  77          1HD1      ILE  77   7.188   0.259   0.872
  611   2HD1  ILE  77          2HD1      ILE  77   6.807  -0.091   2.558
  612   3HD1  ILE  77          3HD1      ILE  77   6.425   1.491   1.878
  613    H    VAL  78           H        VAL  78   3.192   0.174  -2.231
  614    HA   VAL  78           HA       VAL  78   2.554  -0.162  -4.395
  615    HB   VAL  78           HB       VAL  78   4.956   1.434  -5.274
  616   1HG1  VAL  78          1HG1      VAL  78   2.236   1.026  -6.515
  617   2HG1  VAL  78          2HG1      VAL  78   3.730   0.237  -7.023
  618   3HG1  VAL  78          3HG1      VAL  78   3.554   1.984  -7.190
  619   1HG2  VAL  78          1HG2      VAL  78   2.511   2.310  -3.877
  620   2HG2  VAL  78          2HG2      VAL  78   2.960   3.245  -5.304
  621   3HG2  VAL  78          3HG2      VAL  78   4.101   3.068  -3.971
  622    H    ILE  79           H        ILE  79   3.003  -2.370  -4.253
  623    HA   ILE  79           HA       ILE  79   5.596  -3.253  -5.329
  624    HB   ILE  79           HB       ILE  79   3.655  -5.188  -4.151
  625   1HG1  ILE  79          2HG1      ILE  79   5.474  -3.489  -2.443
  626   2HG1  ILE  79          1HG1      ILE  79   3.741  -3.229  -2.591
  627   1HG2  ILE  79          1HG2      ILE  79   5.499  -6.343  -4.809
  628   2HG2  ILE  79          2HG2      ILE  79   6.016  -5.903  -3.183
  629   3HG2  ILE  79          3HG2      ILE  79   6.581  -4.971  -4.569
  630   1HD1  ILE  79          1HD1      ILE  79   3.294  -4.813  -1.108
  631   2HD1  ILE  79          2HD1      ILE  79   5.019  -4.823  -0.739
  632   3HD1  ILE  79          3HD1      ILE  79   4.360  -5.967  -1.910
  633    H    THR  80           H        THR  80   5.307  -5.485  -6.530
  634    HA   THR  80           HA       THR  80   4.488  -6.670  -8.295
  635    HB   THR  80           HB       THR  80   1.921  -5.243  -8.538
  636    HG1  THR  80           1HG      THR  80   2.517  -6.688  -6.172
  637   1HG2  THR  80          1HG2      THR  80   1.164  -7.687  -8.043
  638   2HG2  THR  80          2HG2      THR  80   2.845  -8.063  -8.421
  639   3HG2  THR  80          3HG2      THR  80   1.833  -7.250  -9.614
  640    H    GLY  81           H        GLY  81   5.245  -6.315 -10.265
  641   1HA   GLY  81          2HA       GLY  81   4.303  -4.242 -11.959
  642   2HA   GLY  81          1HA       GLY  81   5.881  -3.823 -11.309
  643    H    HIS  82           H        HIS  82   5.079  -4.378 -14.075
  644    HA   HIS  82           HA       HIS  82   6.962  -6.579 -14.598
  645   1HB   HIS  82          2HB       HIS  82   4.287  -6.053 -15.875
  646   2HB   HIS  82          1HB       HIS  82   5.529  -6.991 -16.697
  647    HD1  HIS  82           1HD      HIS  82   6.543  -8.583 -14.205
  648    HD2  HIS  82           2HD      HIS  82   2.558  -8.094 -15.276
  649    HE1  HIS  82           1HE      HIS  82   5.322 -10.511 -13.148
  650    HE2  HIS  82           2HE      HIS  82   2.903 -10.161 -13.759
  651    H    GLY  83           H        GLY  83   7.399  -6.485 -17.174
  652   1HA   GLY  83          2HA       GLY  83   8.084  -5.202 -19.006
  653   2HA   GLY  83          1HA       GLY  83   7.693  -3.746 -18.103
  654    H    SER  84           H        SER  84   9.554  -2.617 -18.310
  655    HA   SER  84           HA       SER  84  12.080  -3.936 -17.637
  656   1HB   SER  84          2HB       SER  84  11.522  -1.231 -18.875
  657   2HB   SER  84          1HB       SER  84  13.132  -1.867 -18.539
  658    HG   SER  84           HG       SER  84  11.212  -3.113 -20.219
  659    H    VAL  85           H        VAL  85  10.066  -3.247 -15.618
  660    HA   VAL  85           HA       VAL  85   9.945  -2.363 -13.525
  661    HB   VAL  85           HB       VAL  85  12.911  -1.863 -13.748
  662   1HG1  VAL  85          1HG1      VAL  85  10.938  -2.019 -11.532
  663   2HG1  VAL  85          2HG1      VAL  85  12.328  -0.953 -11.739
  664   3HG1  VAL  85          3HG1      VAL  85  12.567  -2.626 -11.238
  665   1HG2  VAL  85          1HG2      VAL  85  11.406  -4.395 -13.616
  666   2HG2  VAL  85          2HG2      VAL  85  12.759  -4.244 -12.494
  667   3HG2  VAL  85          3HG2      VAL  85  13.027  -4.067 -14.228
  668    H    ASP  86           H        ASP  86   9.638  -0.603 -15.845
  669    HA   ASP  86           HA       ASP  86  10.817   1.925 -15.105
  670   1HB   ASP  86          2HB       ASP  86  10.431   1.354 -17.470
  671   2HB   ASP  86          1HB       ASP  86   8.697   1.295 -17.171
  672    H    THR  87           H        THR  87   7.750   0.284 -14.664
  673    HA   THR  87           HA       THR  87   6.223   2.530 -13.904
  674    HB   THR  87           HB       THR  87   5.426   0.134 -14.453
  675    HG1  THR  87           1HG      THR  87   4.095   1.882 -13.667
  676   1HG2  THR  87          1HG2      THR  87   6.850  -0.734 -12.397
  677   2HG2  THR  87          2HG2      THR  87   5.335  -1.496 -12.882
  678   3HG2  THR  87          3HG2      THR  87   5.357  -0.359 -11.534
  679    H    ALA  88           H        ALA  88   8.437   0.446 -12.186
  680    HA   ALA  88           HA       ALA  88   7.854   1.209  -9.553
  681   1HB   ALA  88          1HB       ALA  88  10.507   0.395 -10.741
  682   2HB   ALA  88          2HB       ALA  88   9.279  -0.701 -10.103
  683   3HB   ALA  88          3HB       ALA  88  10.110   0.419  -9.022
  684    H    VAL  89           H        VAL  89  10.482   2.349 -11.659
  685    HA   VAL  89           HA       VAL  89  11.219   4.506 -10.005
  686    HB   VAL  89           HB       VAL  89  12.604   5.265 -11.809
  687   1HG1  VAL  89          1HG1      VAL  89  13.284   3.193 -10.669
  688   2HG1  VAL  89          2HG1      VAL  89  13.857   3.262 -12.334
  689   3HG1  VAL  89          3HG1      VAL  89  12.470   2.256 -11.921
  690   1HG2  VAL  89          1HG2      VAL  89  11.969   5.213 -13.937
  691   2HG2  VAL  89          2HG2      VAL  89  10.510   4.347 -13.466
  692   3HG2  VAL  89          3HG2      VAL  89  11.956   3.449 -13.920
  693    H    LYS  90           H        LYS  90   8.692   4.109 -12.322
  694    HA   LYS  90           HA       LYS  90   8.281   6.922 -12.783
  695   1HB   LYS  90          2HB       LYS  90   7.723   5.370 -14.543
  696   2HB   LYS  90          1HB       LYS  90   6.647   4.479 -13.478
  697   1HG   LYS  90          2HG       LYS  90   5.118   6.344 -13.393
  698   2HG   LYS  90          1HG       LYS  90   6.225   7.329 -14.353
  699   1HD   LYS  90          2HD       LYS  90   4.559   6.528 -15.842
  700   2HD   LYS  90          1HD       LYS  90   6.019   5.591 -16.165
  701   1HE   LYS  90          2HE       LYS  90   4.936   3.976 -14.370
  702   2HE   LYS  90          1HE       LYS  90   3.452   4.754 -14.920
  703   1HZ   LYS  90          1HZ       LYS  90   3.935   4.080 -17.163
  704   2HZ   LYS  90          2HZ       LYS  90   3.976   2.720 -16.158
  705   3HZ   LYS  90          3HZ       LYS  90   5.421   3.416 -16.697
  706    H    ALA  91           H        ALA  91   7.590   4.879 -10.219
  707    HA   ALA  91           HA       ALA  91   5.370   6.615  -9.363
  708   1HB   ALA  91          1HB       ALA  91   4.893   4.434  -7.896
  709   2HB   ALA  91          2HB       ALA  91   5.642   3.672  -9.300
  710   3HB   ALA  91          3HB       ALA  91   4.207   4.678  -9.502
  711    H    ILE  92           H        ILE  92   8.173   4.716  -8.325
  712    HA   ILE  92           HA       ILE  92   8.053   5.539  -5.610
  713    HB   ILE  92           HB       ILE  92  10.079   4.433  -5.264
  714   1HG1  ILE  92          2HG1      ILE  92  10.660   4.857  -8.206
  715   2HG1  ILE  92          1HG1      ILE  92  11.491   5.601  -6.846
  716   1HG2  ILE  92          1HG2      ILE  92   9.705   2.629  -7.429
  717   2HG2  ILE  92          2HG2      ILE  92   8.124   3.224  -6.930
  718   3HG2  ILE  92          3HG2      ILE  92   9.190   2.460  -5.753
  719   1HD1  ILE  92          1HD1      ILE  92  12.989   3.978  -7.055
  720   2HD1  ILE  92          2HD1      ILE  92  11.943   3.046  -8.127
  721   3HD1  ILE  92          3HD1      ILE  92  11.771   2.897  -6.378
  722    H    LYS  93           H        LYS  93   9.804   6.731  -8.436
  723    HA   LYS  93           HA       LYS  93  11.472   8.576  -7.190
  724   1HB   LYS  93          2HB       LYS  93  10.181   8.561  -9.912
  725   2HB   LYS  93          1HB       LYS  93  11.291   9.829  -9.413
  726   1HG   LYS  93          2HG       LYS  93  12.231   7.058  -9.044
  727   2HG   LYS  93          1HG       LYS  93  12.055   7.616 -10.710
  728   1HD   LYS  93          2HD       LYS  93  13.308   9.741  -9.589
  729   2HD   LYS  93          1HD       LYS  93  13.983   8.419  -8.635
  730   1HE   LYS  93          2HE       LYS  93  15.448   8.218 -10.319
  731   2HE   LYS  93          1HE       LYS  93  14.127   7.408 -11.161
  732   1HZ   LYS  93          1HZ       LYS  93  15.134   9.147 -12.513
  733   2HZ   LYS  93          2HZ       LYS  93  14.754  10.306 -11.341
  734   3HZ   LYS  93          3HZ       LYS  93  13.516   9.507 -12.171
  735    H    LYS  94           H        LYS  94   8.058   8.674  -7.755
  736    HA   LYS  94           HA       LYS  94   7.675  11.467  -7.567
  737   1HB   LYS  94          2HB       LYS  94   6.084   9.437  -8.257
  738   2HB   LYS  94          1HB       LYS  94   5.549   9.655  -6.597
  739   1HG   LYS  94          2HG       LYS  94   4.123  11.111  -7.543
  740   2HG   LYS  94          1HG       LYS  94   5.502  12.207  -7.427
  741   1HD   LYS  94          2HD       LYS  94   6.001  10.959  -9.794
  742   2HD   LYS  94          1HD       LYS  94   4.237  11.002  -9.787
  743   1HE   LYS  94          2HE       LYS  94   4.715  13.021 -10.769
  744   2HE   LYS  94          1HE       LYS  94   4.600  13.492  -9.074
  745   1HZ   LYS  94          1HZ       LYS  94   6.655  14.119 -10.637
  746   2HZ   LYS  94          2HZ       LYS  94   7.232  12.669  -9.985
  747   3HZ   LYS  94          3HZ       LYS  94   6.787  13.941  -8.960
  748    H    GLY  95           H        GLY  95   8.386   9.073  -5.210
  749   1HA   GLY  95          2HA       GLY  95   9.159  10.333  -3.104
  750   2HA   GLY  95          1HA       GLY  95   7.483  10.852  -3.044
  751    H    ALA  96           H        ALA  96   7.292   7.828  -4.255
  752    HA   ALA  96           HA       ALA  96   6.142   6.694  -1.994
  753   1HB   ALA  96          1HB       ALA  96   5.687   4.943  -3.328
  754   2HB   ALA  96          2HB       ALA  96   7.360   4.781  -3.862
  755   3HB   ALA  96          3HB       ALA  96   6.309   5.987  -4.604
  756    H    TYR  97           H        TYR  97   7.189   4.189  -1.618
  757    HA   TYR  97           HA       TYR  97   9.715   4.802  -0.247
  758   1HB   TYR  97          2HB       TYR  97   7.670   4.120   1.095
  759   2HB   TYR  97          1HB       TYR  97   7.845   2.523   0.376
  760    HD1  TYR  97           1HD      TYR  97   9.425   0.977   1.213
  761    HD2  TYR  97           2HD      TYR  97   9.520   5.019   2.535
  762    HE1  TYR  97           1HE      TYR  97  11.029   0.357   2.971
  763    HE2  TYR  97           2HE      TYR  97  11.126   4.412   4.297
  764    HH   TYR  97           HH       TYR  97  11.782   2.367   5.565
  765    H    GLU  98           H        GLU  98   9.365   3.929  -3.050
  766    HA   GLU  98           HA       GLU  98  10.663   2.724  -4.492
  767   1HB   GLU  98          2HB       GLU  98  12.603   1.820  -3.775
  768   2HB   GLU  98          1HB       GLU  98  12.173   2.576  -2.250
  769   1HG   GLU  98          2HG       GLU  98  12.664   0.495  -1.503
  770   2HG   GLU  98          1HG       GLU  98  10.955   0.259  -1.859
  771    H    PHE  99           H        PHE  99  10.559   0.715  -5.586
  772    HA   PHE  99           HA       PHE  99   8.102  -0.679  -5.130
  773   1HB   PHE  99          2HB       PHE  99  10.028  -0.409  -7.262
  774   2HB   PHE  99          1HB       PHE  99   9.611  -2.103  -7.031
  775    HD1  PHE  99           1HD      PHE  99   8.250  -2.625  -8.833
  776    HD2  PHE  99           2HD      PHE  99   7.493   0.921  -6.604
  777    HE1  PHE  99           1HE      PHE  99   6.167  -2.281 -10.095
  778    HE2  PHE  99           2HE      PHE  99   5.408   1.270  -7.864
  779    HZ   PHE  99           HZ       PHE  99   4.742  -0.333  -9.610
  780    H    LEU 100           H        LEU 100   8.030  -1.979  -3.393
  781    HA   LEU 100           HA       LEU 100  10.267  -3.583  -2.570
  782   1HB   LEU 100          2HB       LEU 100   8.649  -2.497  -1.028
  783   2HB   LEU 100          1HB       LEU 100   7.408  -3.582  -1.618
  784    HG   LEU 100           HG       LEU 100   8.410  -5.460  -0.604
  785   1HD1  LEU 100          1HD1      LEU 100  10.657  -5.501  -0.899
  786   2HD1  LEU 100          2HD1      LEU 100  10.639  -4.873   0.749
  787   3HD1  LEU 100          3HD1      LEU 100  10.838  -3.771  -0.613
  788   1HD2  LEU 100          1HD2      LEU 100   8.459  -3.005   1.113
  789   2HD2  LEU 100          2HD2      LEU 100   8.768  -4.610   1.774
  790   3HD2  LEU 100          3HD2      LEU 100   7.220  -4.257   1.006
  791    H    GLU 101           H        GLU 101   9.862  -4.420  -5.076
  792    HA   GLU 101           HA       GLU 101   8.433  -6.980  -4.774
  793   1HB   GLU 101          2HB       GLU 101   8.058  -6.930  -7.217
  794   2HB   GLU 101          1HB       GLU 101   7.282  -5.588  -6.386
  795   1HG   GLU 101          2HG       GLU 101   8.463  -4.069  -7.503
  796   2HG   GLU 101          1HG       GLU 101   9.971  -4.958  -7.300
  797    H    LYS 102           H        LYS 102   9.533  -8.804  -5.155
  798    HA   LYS 102           HA       LYS 102  11.612  -9.211  -6.928
  799   1HB   LYS 102          2HB       LYS 102  12.487  -7.726  -4.674
  800   2HB   LYS 102          1HB       LYS 102  13.157  -9.345  -4.517
  801   1HG   LYS 102          2HG       LYS 102  14.102  -9.160  -6.775
  802   2HG   LYS 102          1HG       LYS 102  13.459  -7.521  -6.895
  803   1HD   LYS 102          2HD       LYS 102  14.961  -6.676  -5.363
  804   2HD   LYS 102          1HD       LYS 102  15.204  -8.239  -4.582
  805   1HE   LYS 102          2HE       LYS 102  16.089  -7.757  -7.406
  806   2HE   LYS 102          1HE       LYS 102  17.099  -7.283  -6.041
  807   1HZ   LYS 102          1HZ       LYS 102  17.221  -9.673  -7.170
  808   2HZ   LYS 102          2HZ       LYS 102  16.053  -9.996  -5.990
  809   3HZ   LYS 102          3HZ       LYS 102  17.576  -9.412  -5.537
  810    HA   PRO 103           HA       PRO 103  11.472 -12.898  -3.921
  811   1HB   PRO 103          2HB       PRO 103  10.594 -12.642  -1.418
  812   2HB   PRO 103          1HB       PRO 103  12.207 -12.079  -1.878
  813   1HG   PRO 103          2HG       PRO 103   9.695 -10.506  -1.470
  814   2HG   PRO 103          1HG       PRO 103  11.353 -10.115  -0.980
  815   1HD   PRO 103          2HD       PRO 103  10.096  -9.127  -3.241
  816   2HD   PRO 103          1HD       PRO 103  11.852  -9.204  -3.009
  817    H    PHE 104           H        PHE 104   8.896 -11.046  -4.763
  818    HA   PHE 104           HA       PHE 104   6.702 -11.458  -5.186
  819   1HB   PHE 104          2HB       PHE 104   8.005 -14.032  -5.308
  820   2HB   PHE 104          1HB       PHE 104   6.359 -14.206  -4.712
  821    HD1  PHE 104           1HD      PHE 104   7.828 -11.878  -7.220
  822    HD2  PHE 104           2HD      PHE 104   5.081 -15.032  -6.440
  823    HE1  PHE 104           1HE      PHE 104   6.981 -11.704  -9.523
  824    HE2  PHE 104           2HE      PHE 104   4.229 -14.865  -8.742
  825    HZ   PHE 104           HZ       PHE 104   5.179 -13.198 -10.287
  826    H    SER 105           H        SER 105   4.652 -12.472  -4.171
  827    HA   SER 105           HA       SER 105   3.230 -12.532  -2.395
  828   1HB   SER 105          2HB       SER 105   5.566 -13.471  -0.729
  829   2HB   SER 105          1HB       SER 105   3.855 -13.843  -0.514
  830    HG   SER 105           HG       SER 105   4.704 -15.603  -1.497
  831    H    VAL 106           H        VAL 106   3.547 -12.011   0.312
  832    HA   VAL 106           HA       VAL 106   4.525  -9.230   0.274
  833    HB   VAL 106           HB       VAL 106   2.805  -8.574   1.775
  834   1HG1  VAL 106          1HG1      VAL 106   1.820 -10.280  -0.490
  835   2HG1  VAL 106          2HG1      VAL 106   1.996  -8.526  -0.424
  836   3HG1  VAL 106          3HG1      VAL 106   0.724  -9.321   0.505
  837   1HG2  VAL 106          1HG2      VAL 106   1.059 -10.643   2.177
  838   2HG2  VAL 106          2HG2      VAL 106   2.239 -10.056   3.349
  839   3HG2  VAL 106          3HG2      VAL 106   2.626 -11.438   2.324
  840    H    GLU 107           H        GLU 107   4.963 -12.288   1.688
  841    HA   GLU 107           HA       GLU 107   5.525 -11.973   4.301
  842   1HB   GLU 107          2HB       GLU 107   5.918 -13.998   2.787
  843   2HB   GLU 107          1HB       GLU 107   7.517 -13.322   2.502
  844   1HG   GLU 107          2HG       GLU 107   7.584 -13.258   5.129
  845   2HG   GLU 107          1HG       GLU 107   6.372 -14.528   4.958
  846    H    ARG 108           H        ARG 108   7.785 -11.114   1.678
  847    HA   ARG 108           HA       ARG 108   9.768 -10.044   3.398
  848   1HB   ARG 108          2HB       ARG 108   9.808 -10.713   0.822
  849   2HB   ARG 108          1HB       ARG 108   9.460  -9.001   0.620
  850   1HG   ARG 108          2HG       ARG 108  11.617  -9.464   2.502
  851   2HG   ARG 108          1HG       ARG 108  11.952 -10.153   0.912
  852   1HD   ARG 108          2HD       ARG 108  10.824  -7.588   0.505
  853   2HD   ARG 108          1HD       ARG 108  12.064  -7.428   1.748
  854    HE   ARG 108           HE       ARG 108  12.905  -8.938  -0.551
  855   1HH1  ARG 108          1HH1      ARG 108  12.613  -5.749   0.835
  856   2HH1  ARG 108          2HH1      ARG 108  13.864  -5.070  -0.153
  857   1HH2  ARG 108          1HH2      ARG 108  14.548  -8.048  -1.850
  858   2HH2  ARG 108          2HH2      ARG 108  14.963  -6.374  -1.677
  859    H    PHE 109           H        PHE 109   6.950  -8.741   1.796
  860    HA   PHE 109           HA       PHE 109   7.388  -6.009   2.173
  861   1HB   PHE 109          2HB       PHE 109   5.543  -6.129   0.893
  862   2HB   PHE 109          1HB       PHE 109   5.180  -7.754   1.442
  863    HD1  PHE 109           1HD      PHE 109   4.170  -4.371   1.466
  864    HD2  PHE 109           2HD      PHE 109   4.017  -7.958   3.750
  865    HE1  PHE 109           1HE      PHE 109   2.218  -3.506   2.689
  866    HE2  PHE 109           2HE      PHE 109   2.066  -7.100   4.977
  867    HZ   PHE 109           HZ       PHE 109   1.163  -4.871   4.446
  868    H    LEU 110           H        LEU 110   6.551  -8.506   4.391
  869    HA   LEU 110           HA       LEU 110   5.303  -7.065   6.434
  870   1HB   LEU 110          2HB       LEU 110   5.922  -9.637   6.048
  871   2HB   LEU 110          1HB       LEU 110   7.168  -9.206   7.202
  872    HG   LEU 110           HG       LEU 110   4.215  -8.803   7.656
  873   1HD1  LEU 110          1HD1      LEU 110   4.496 -10.687   9.260
  874   2HD1  LEU 110          2HD1      LEU 110   6.086 -10.978   8.555
  875   3HD1  LEU 110          3HD1      LEU 110   4.638 -11.144   7.562
  876   1HD2  LEU 110          1HD2      LEU 110   6.658  -8.077   9.131
  877   2HD2  LEU 110          2HD2      LEU 110   5.377  -8.816  10.090
  878   3HD2  LEU 110          3HD2      LEU 110   5.051  -7.351   9.164
  879    H    LEU 111           H        LEU 111   8.722  -7.842   5.946
  880    HA   LEU 111           HA       LEU 111   9.756  -6.648   8.229
  881   1HB   LEU 111          2HB       LEU 111  11.008  -6.932   5.501
  882   2HB   LEU 111          1HB       LEU 111  11.883  -6.492   6.956
  883    HG   LEU 111           HG       LEU 111  10.824  -8.772   7.834
  884   1HD1  LEU 111          1HD1      LEU 111  10.570  -8.864   4.892
  885   2HD1  LEU 111          2HD1      LEU 111   9.643  -9.695   6.142
  886   3HD1  LEU 111          3HD1      LEU 111  11.234 -10.298   5.676
  887   1HD2  LEU 111          1HD2      LEU 111  13.268  -7.989   7.453
  888   2HD2  LEU 111          2HD2      LEU 111  13.174  -8.981   5.998
  889   3HD2  LEU 111          3HD2      LEU 111  12.921  -9.713   7.582
  890    H    THR 112           H        THR 112   9.573  -5.227   4.955
  891    HA   THR 112           HA       THR 112  10.543  -2.715   5.574
  892    HB   THR 112           HB       THR 112   8.398  -3.397   3.556
  893    HG1  THR 112           1HG      THR 112  10.211  -4.621   3.160
  894   1HG2  THR 112          1HG2      THR 112  10.155  -1.403   2.617
  895   2HG2  THR 112          2HG2      THR 112   9.573  -0.895   4.203
  896   3HG2  THR 112          3HG2      THR 112   8.423  -1.285   2.924
  897    H    ILE 113           H        ILE 113   7.103  -3.630   5.345
  898    HA   ILE 113           HA       ILE 113   5.744  -1.451   5.960
  899    HB   ILE 113           HB       ILE 113   5.383  -4.215   7.060
  900   1HG1  ILE 113          2HG1      ILE 113   4.846  -3.831   4.718
  901   2HG1  ILE 113          1HG1      ILE 113   3.370  -4.134   5.628
  902   1HG2  ILE 113          1HG2      ILE 113   3.692  -1.817   7.724
  903   2HG2  ILE 113          2HG2      ILE 113   4.513  -2.902   8.845
  904   3HG2  ILE 113          3HG2      ILE 113   3.138  -3.481   7.903
  905   1HD1  ILE 113          1HD1      ILE 113   3.168  -1.584   5.760
  906   2HD1  ILE 113          2HD1      ILE 113   2.819  -2.373   4.223
  907   3HD1  ILE 113          3HD1      ILE 113   4.368  -1.565   4.469
  908    H    LYS 114           H        LYS 114   6.987  -3.436   8.666
  909    HA   LYS 114           HA       LYS 114   6.440  -1.668  10.712
  910   1HB   LYS 114          2HB       LYS 114   7.536  -4.053  10.717
  911   2HB   LYS 114          1HB       LYS 114   9.038  -3.141  10.730
  912   1HG   LYS 114          2HG       LYS 114   6.948  -2.430  12.715
  913   2HG   LYS 114          1HG       LYS 114   7.868  -3.916  12.957
  914   1HD   LYS 114          2HD       LYS 114   9.520  -2.711  13.827
  915   2HD   LYS 114          1HD       LYS 114   9.734  -1.923  12.263
  916   1HE   LYS 114          2HE       LYS 114   9.226  -0.031  13.341
  917   2HE   LYS 114          1HE       LYS 114   7.562  -0.610  13.296
  918   1HZ   LYS 114          1HZ       LYS 114   8.336   0.083  15.530
  919   2HZ   LYS 114          2HZ       LYS 114   9.455  -1.185  15.509
  920   3HZ   LYS 114          3HZ       LYS 114   7.797  -1.519  15.473
  921    H    HIS 115           H        HIS 115   9.516  -2.004   9.008
  922    HA   HIS 115           HA       HIS 115  10.819   0.221  10.003
  923   1HB   HIS 115          2HB       HIS 115  11.527  -1.692   8.291
  924   2HB   HIS 115          1HB       HIS 115  11.224  -0.400   7.134
  925    HD1  HIS 115           1HD      HIS 115  13.007   1.352   6.883
  926    HD2  HIS 115           2HD      HIS 115  13.600  -1.072  10.205
  927    HE1  HIS 115           1HE      HIS 115  15.283   1.960   7.761
  928    HE2  HIS 115           2HE      HIS 115  15.654   0.424   9.723
  929    H    ALA 116           H        ALA 116   8.287   0.028   7.610
  930    HA   ALA 116           HA       ALA 116   8.651   2.625   6.495
  931   1HB   ALA 116          1HB       ALA 116   6.040   1.144   6.574
  932   2HB   ALA 116          2HB       ALA 116   7.357   0.659   5.506
  933   3HB   ALA 116          3HB       ALA 116   6.638   2.261   5.347
  934    H    PHE 117           H        PHE 117   6.917   1.358   9.256
  935    HA   PHE 117           HA       PHE 117   5.314   3.644   9.755
  936   1HB   PHE 117          2HB       PHE 117   6.119   1.226  11.321
  937   2HB   PHE 117          1HB       PHE 117   5.360   2.572  12.164
  938    HD1  PHE 117           1HD      PHE 117   3.052   3.182  11.708
  939    HD2  PHE 117           2HD      PHE 117   4.878  -0.144   9.778
  940    HE1  PHE 117           1HE      PHE 117   0.835   2.360  11.036
  941    HE2  PHE 117           2HE      PHE 117   2.662  -0.968   9.104
  942    HZ   PHE 117           HZ       PHE 117   0.640   0.284   9.733
  943    H    GLU 118           H        GLU 118   8.179   2.445  11.518
  944    HA   GLU 118           HA       GLU 118   8.547   4.738  13.075
  945   1HB   GLU 118          2HB       GLU 118  10.469   2.591  12.207
  946   2HB   GLU 118          1HB       GLU 118  10.910   3.871  13.329
  947   1HG   GLU 118          2HG       GLU 118   9.160   3.135  14.861
  948   2HG   GLU 118          1HG       GLU 118   8.717   1.851  13.737
  949    H    GLU 119           H        GLU 119   9.901   3.857   9.924
  950    HA   GLU 119           HA       GLU 119  11.605   6.134   9.761
  951   1HB   GLU 119          2HB       GLU 119  10.595   4.266   7.617
  952   2HB   GLU 119          1HB       GLU 119  11.821   5.500   7.364
  953   1HG   GLU 119          2HG       GLU 119  12.115   3.315   9.401
  954   2HG   GLU 119          1HG       GLU 119  12.645   3.145   7.729
  955    H    TYR 120           H        TYR 120   8.286   5.858   9.546
  956    HA   TYR 120           HA       TYR 120   8.102   8.505   8.341
  957   1HB   TYR 120          2HB       TYR 120   7.530   6.244   6.838
  958   2HB   TYR 120          1HB       TYR 120   5.948   6.783   7.393
  959    HD1  TYR 120           1HD      TYR 120   6.223   9.691   7.401
  960    HD2  TYR 120           2HD      TYR 120   7.669   6.836   4.597
  961    HE1  TYR 120           1HE      TYR 120   6.191  11.411   5.643
  962    HE2  TYR 120           2HE      TYR 120   7.641   8.548   2.832
  963    HH   TYR 120           HH       TYR 120   7.627  11.653   3.280
  964    H    SER 121           H        SER 121   7.867   7.739  11.030
  965    HA   SER 121           HA       SER 121   5.207   7.300  11.856
  966   1HB   SER 121          2HB       SER 121   6.126   8.418  14.037
  967   2HB   SER 121          1HB       SER 121   6.771   6.859  13.523
  968    HG   SER 121           HG       SER 121   8.239   8.786  14.092
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1  -4.423   1.415  16.364
    2   2H    MET   1          2HT       MET   1  -3.780   2.209  17.743
    3   3H    MET   1          3HT       MET   1  -3.288   0.609  17.364
    4    HA   MET   1           HA       MET   1  -2.858   2.891  15.568
    5   1HB   MET   1          2HB       MET   1  -1.285   1.882  17.916
    6   2HB   MET   1          1HB       MET   1  -0.447   2.596  16.544
    7   1HG   MET   1          2HG       MET   1  -1.233   4.690  16.969
    8   2HG   MET   1          1HG       MET   1  -2.712   4.102  17.726
    9   1HE   MET   1          1HE       MET   1  -0.578   6.304  18.210
   10   2HE   MET   1          2HE       MET   1   0.403   6.148  19.669
   11   3HE   MET   1          3HE       MET   1  -1.323   6.486  19.798
   12    H    LYS   2           H        LYS   2  -0.764   2.358  14.318
   13    HA   LYS   2           HA       LYS   2   0.309   1.056  12.799
   14   1HB   LYS   2          2HB       LYS   2   0.043  -0.593  15.143
   15   2HB   LYS   2          1HB       LYS   2  -0.004  -1.572  13.683
   16   1HG   LYS   2          2HG       LYS   2   2.253  -1.480  14.323
   17   2HG   LYS   2          1HG       LYS   2   2.096  -0.366  12.964
   18   1HD   LYS   2          2HD       LYS   2   2.552   1.445  14.229
   19   2HD   LYS   2          1HD       LYS   2   1.664   0.822  15.622
   20   1HE   LYS   2          2HE       LYS   2   3.486  -0.212  16.492
   21   2HE   LYS   2          1HE       LYS   2   4.164  -0.584  14.908
   22   1HZ   LYS   2          1HZ       LYS   2   5.146   1.277  16.535
   23   2HZ   LYS   2          2HZ       LYS   2   4.092   2.229  15.616
   24   3HZ   LYS   2          3HZ       LYS   2   5.307   1.335  14.852
   25    H    ARG   3           H        ARG   3  -1.023   1.328  11.058
   26    HA   ARG   3           HA       ARG   3  -2.702  -0.957  10.378
   27   1HB   ARG   3          2HB       ARG   3  -3.775   1.823   9.967
   28   2HB   ARG   3          1HB       ARG   3  -4.635   0.294   9.862
   29   1HG   ARG   3          2HG       ARG   3  -5.395   1.028  11.874
   30   2HG   ARG   3          1HG       ARG   3  -3.969   0.137  12.408
   31   1HD   ARG   3          2HD       ARG   3  -2.982   1.988  13.168
   32   2HD   ARG   3          1HD       ARG   3  -3.344   2.878  11.690
   33    HE   ARG   3           HE       ARG   3  -4.838   2.909  14.153
   34   1HH1  ARG   3          1HH1      ARG   3  -4.945   3.513  10.716
   35   2HH1  ARG   3          2HH1      ARG   3  -6.274   4.616  10.826
   36   1HH2  ARG   3          1HH2      ARG   3  -6.584   4.362  14.297
   37   2HH2  ARG   3          2HH2      ARG   3  -7.203   5.101  12.858
   38    H    VAL   4           H        VAL   4  -2.483  -1.527   8.276
   39    HA   VAL   4           HA       VAL   4  -1.251   0.449   6.463
   40    HB   VAL   4           HB       VAL   4  -0.751  -2.519   6.276
   41   1HG1  VAL   4          1HG1      VAL   4   1.279  -0.697   5.284
   42   2HG1  VAL   4          2HG1      VAL   4  -0.284  -0.443   4.511
   43   3HG1  VAL   4          3HG1      VAL   4   0.469  -2.036   4.473
   44   1HG2  VAL   4          1HG2      VAL   4   1.448  -0.846   7.266
   45   2HG2  VAL   4          2HG2      VAL   4   0.941  -2.461   7.759
   46   3HG2  VAL   4          3HG2      VAL   4   0.113  -1.043   8.399
   47    H    LEU   5           H        LEU   5  -1.961   0.452   4.315
   48    HA   LEU   5           HA       LEU   5  -4.508  -0.940   3.904
   49   1HB   LEU   5          2HB       LEU   5  -4.510   1.528   3.768
   50   2HB   LEU   5          1HB       LEU   5  -3.372   1.440   2.437
   51    HG   LEU   5           HG       LEU   5  -5.081   0.184   1.126
   52   1HD1  LEU   5          1HD1      LEU   5  -7.215  -0.207   1.874
   53   2HD1  LEU   5          2HD1      LEU   5  -7.144   1.078   3.079
   54   3HD1  LEU   5          3HD1      LEU   5  -6.294  -0.440   3.359
   55   1HD2  LEU   5          1HD2      LEU   5  -6.411   2.706   1.928
   56   2HD2  LEU   5          2HD2      LEU   5  -6.001   2.100   0.324
   57   3HD2  LEU   5          3HD2      LEU   5  -4.751   2.813   1.343
   58    H    VAL   6           H        VAL   6  -4.784  -2.397   2.344
   59    HA   VAL   6           HA       VAL   6  -2.531  -2.879   0.503
   60    HB   VAL   6           HB       VAL   6  -4.593  -4.887   1.408
   61   1HG1  VAL   6          1HG1      VAL   6  -3.758  -5.582  -0.671
   62   2HG1  VAL   6          2HG1      VAL   6  -2.813  -6.481   0.517
   63   3HG1  VAL   6          3HG1      VAL   6  -2.116  -5.069  -0.279
   64   1HG2  VAL   6          1HG2      VAL   6  -3.172  -5.655   3.046
   65   2HG2  VAL   6          2HG2      VAL   6  -2.877  -3.919   3.128
   66   3HG2  VAL   6          3HG2      VAL   6  -1.741  -4.966   2.278
   67    H    VAL   7           H        VAL   7  -3.258  -1.545  -1.167
   68    HA   VAL   7           HA       VAL   7  -5.923  -1.841  -2.234
   69    HB   VAL   7           HB       VAL   7  -3.569  -0.364  -3.424
   70   1HG1  VAL   7          1HG1      VAL   7  -6.487  -0.479  -4.064
   71   2HG1  VAL   7          2HG1      VAL   7  -5.097  -0.540  -5.149
   72   3HG1  VAL   7          3HG1      VAL   7  -5.564   0.986  -4.398
   73   1HG2  VAL   7          1HG2      VAL   7  -5.596   0.428  -1.373
   74   2HG2  VAL   7          2HG2      VAL   7  -4.895   1.637  -2.449
   75   3HG2  VAL   7          3HG2      VAL   7  -3.853   0.694  -1.383
   76    H    ASP   8           H        ASP   8  -6.343  -3.739  -3.216
   77    HA   ASP   8           HA       ASP   8  -4.596  -4.510  -5.445
   78   1HB   ASP   8          2HB       ASP   8  -4.010  -5.991  -3.610
   79   2HB   ASP   8          1HB       ASP   8  -5.704  -6.390  -3.348
   80    H    ASP   9           H        ASP   9  -5.638  -5.052  -7.272
   81    HA   ASP   9           HA       ASP   9  -8.449  -4.592  -7.448
   82   1HB   ASP   9          2HB       ASP   9  -6.963  -3.946  -9.267
   83   2HB   ASP   9          1HB       ASP   9  -6.488  -5.623  -9.508
   84    H    GLU  10           H        GLU  10  -6.406  -7.482  -7.593
   85    HA   GLU  10           HA       GLU  10  -8.386  -9.184  -6.588
   86   1HB   GLU  10          2HB       GLU  10  -8.842  -8.577  -9.274
   87   2HB   GLU  10          1HB       GLU  10  -8.098 -10.171  -9.302
   88   1HG   GLU  10          2HG       GLU  10  -9.908 -11.163  -8.452
   89   2HG   GLU  10          1HG       GLU  10 -10.190  -9.873  -7.284
   90    H    GLU  11           H        GLU  11  -7.232 -10.699  -5.607
   91    HA   GLU  11           HA       GLU  11  -5.450 -12.437  -6.863
   92   1HB   GLU  11          2HB       GLU  11  -4.204 -10.060  -6.645
   93   2HB   GLU  11          1HB       GLU  11  -3.801 -10.743  -5.077
   94   1HG   GLU  11          2HG       GLU  11  -2.467 -12.353  -5.960
   95   2HG   GLU  11          1HG       GLU  11  -3.393 -12.457  -7.458
   96    H    SER  12           H        SER  12  -3.888 -13.443  -5.042
   97    HA   SER  12           HA       SER  12  -5.697 -14.134  -2.855
   98   1HB   SER  12          2HB       SER  12  -3.070 -15.501  -3.293
   99   2HB   SER  12          1HB       SER  12  -4.592 -16.164  -2.697
  100    HG   SER  12           HG       SER  12  -3.845 -15.552  -5.349
  101    H    ILE  13           H        ILE  13  -3.922 -11.650  -3.074
  102    HA   ILE  13           HA       ILE  13  -2.020 -11.967  -0.934
  103    HB   ILE  13           HB       ILE  13  -2.896  -9.647  -2.633
  104   1HG1  ILE  13          2HG1      ILE  13  -0.398  -9.619  -3.082
  105   2HG1  ILE  13          1HG1      ILE  13  -0.303 -11.124  -2.174
  106   1HG2  ILE  13          1HG2      ILE  13  -1.114  -9.484  -0.207
  107   2HG2  ILE  13          2HG2      ILE  13  -2.667  -8.679  -0.435
  108   3HG2  ILE  13          3HG2      ILE  13  -1.280  -8.219  -1.422
  109   1HD1  ILE  13          1HD1      ILE  13  -0.369 -11.548  -4.555
  110   2HD1  ILE  13          2HD1      ILE  13  -1.893 -10.670  -4.687
  111   3HD1  ILE  13          3HD1      ILE  13  -1.819 -12.178  -3.775
  112    H    THR  14           H        THR  14  -4.905  -9.908  -1.369
  113    HA   THR  14           HA       THR  14  -5.163  -8.876   1.141
  114    HB   THR  14           HB       THR  14  -7.625  -8.805   0.708
  115    HG1  THR  14           1HG      THR  14  -7.775 -10.800  -0.406
  116   1HG2  THR  14          1HG2      THR  14  -5.599  -7.557  -0.778
  117   2HG2  THR  14          2HG2      THR  14  -7.263  -7.024  -0.541
  118   3HG2  THR  14          3HG2      THR  14  -6.849  -8.036  -1.926
  119    H    SER  15           H        SER  15  -5.739 -12.167   0.185
  120    HA   SER  15           HA       SER  15  -7.262 -12.877   2.509
  121   1HB   SER  15          2HB       SER  15  -7.390 -14.079   0.304
  122   2HB   SER  15          1HB       SER  15  -5.785 -14.732   0.632
  123    HG   SER  15           HG       SER  15  -6.799 -15.495   2.678
  124    H    SER  16           H        SER  16  -4.049 -14.008   1.430
  125    HA   SER  16           HA       SER  16  -3.351 -14.917   4.042
  126   1HB   SER  16          2HB       SER  16  -1.479 -14.454   1.715
  127   2HB   SER  16          1HB       SER  16  -1.239 -15.540   3.083
  128    HG   SER  16           HG       SER  16  -2.159 -16.980   1.874
  129    H    LEU  17           H        LEU  17  -2.115 -12.255   2.018
  130    HA   LEU  17           HA       LEU  17  -0.260 -11.160   3.698
  131   1HB   LEU  17          2HB       LEU  17  -0.679 -10.360   1.435
  132   2HB   LEU  17          1HB       LEU  17  -2.221  -9.693   1.932
  133    HG   LEU  17           HG       LEU  17  -0.108  -8.162   1.650
  134   1HD1  LEU  17          1HD1      LEU  17  -1.069  -6.600   3.239
  135   2HD1  LEU  17          2HD1      LEU  17  -1.986  -7.904   3.989
  136   3HD1  LEU  17          3HD1      LEU  17  -2.333  -7.424   2.328
  137   1HD2  LEU  17          1HD2      LEU  17   1.224  -7.854   3.564
  138   2HD2  LEU  17          2HD2      LEU  17   1.185  -9.597   3.300
  139   3HD2  LEU  17          3HD2      LEU  17   0.181  -8.872   4.554
  140    H    SER  18           H        SER  18  -3.722 -10.275   3.636
  141    HA   SER  18           HA       SER  18  -3.707  -8.458   5.726
  142   1HB   SER  18          2HB       SER  18  -5.864 -10.409   4.891
  143   2HB   SER  18          1HB       SER  18  -6.119  -9.102   6.047
  144    HG   SER  18           HG       SER  18  -6.719  -8.424   3.984
  145    H    ALA  19           H        ALA  19  -4.037 -11.984   5.849
  146    HA   ALA  19           HA       ALA  19  -4.446 -12.184   8.634
  147   1HB   ALA  19          1HB       ALA  19  -5.003 -14.159   7.674
  148   2HB   ALA  19          2HB       ALA  19  -3.333 -14.557   8.083
  149   3HB   ALA  19          3HB       ALA  19  -3.741 -14.044   6.446
  150    H    ILE  20           H        ILE  20  -1.539 -12.218   6.630
  151    HA   ILE  20           HA       ILE  20   0.346 -12.901   8.564
  152    HB   ILE  20           HB       ILE  20   0.547 -11.183   6.094
  153   1HG1  ILE  20          2HG1      ILE  20   1.647 -13.920   6.751
  154   2HG1  ILE  20          1HG1      ILE  20   0.181 -13.614   5.824
  155   1HG2  ILE  20          1HG2      ILE  20   2.742 -11.917   8.020
  156   2HG2  ILE  20          2HG2      ILE  20   2.247 -10.304   7.507
  157   3HG2  ILE  20          3HG2      ILE  20   3.035 -11.391   6.363
  158   1HD1  ILE  20          1HD1      ILE  20   2.921 -13.655   4.962
  159   2HD1  ILE  20          2HD1      ILE  20   2.158 -12.115   4.565
  160   3HD1  ILE  20          3HD1      ILE  20   1.439 -13.625   4.007
  161    H    LEU  21           H        LEU  21  -0.237  -9.578   7.390
  162    HA   LEU  21           HA       LEU  21   1.128  -8.200   9.328
  163   1HB   LEU  21          2HB       LEU  21  -1.485  -7.451   8.026
  164   2HB   LEU  21          1HB       LEU  21  -0.443  -6.337   8.892
  165    HG   LEU  21           HG       LEU  21   1.006  -7.770   6.829
  166   1HD1  LEU  21          1HD1      LEU  21  -1.203  -7.791   5.767
  167   2HD1  LEU  21          2HD1      LEU  21  -0.053  -6.763   4.912
  168   3HD1  LEU  21          3HD1      LEU  21  -1.290  -6.039   5.941
  169   1HD2  LEU  21          1HD2      LEU  21   0.659  -5.027   7.861
  170   2HD2  LEU  21          2HD2      LEU  21   1.180  -5.179   6.184
  171   3HD2  LEU  21          3HD2      LEU  21   2.129  -5.920   7.473
  172    H    GLU  22           H        GLU  22  -2.027  -9.693   9.523
  173    HA   GLU  22           HA       GLU  22  -2.906  -8.520  11.922
  174   1HB   GLU  22          2HB       GLU  22  -3.948 -10.298  10.102
  175   2HB   GLU  22          1HB       GLU  22  -3.760 -11.277  11.549
  176   1HG   GLU  22          2HG       GLU  22  -5.321 -10.103  12.718
  177   2HG   GLU  22          1HG       GLU  22  -5.018  -8.608  11.833
  178    H    GLU  23           H        GLU  23  -0.709 -11.147  11.242
  179    HA   GLU  23           HA       GLU  23  -0.673 -12.137  13.940
  180   1HB   GLU  23          2HB       GLU  23  -0.175 -13.745  12.279
  181   2HB   GLU  23          1HB       GLU  23   0.962 -12.677  11.468
  182   1HG   GLU  23          2HG       GLU  23   2.664 -13.282  12.780
  183   2HG   GLU  23          1HG       GLU  23   1.665 -13.322  14.233
  184    H    GLU  24           H        GLU  24   1.239  -9.961  11.946
  185    HA   GLU  24           HA       GLU  24   3.351  -9.623  13.812
  186   1HB   GLU  24          2HB       GLU  24   2.547  -8.438  11.257
  187   2HB   GLU  24          1HB       GLU  24   3.420  -7.349  12.325
  188   1HG   GLU  24          2HG       GLU  24   4.810  -9.786  12.368
  189   2HG   GLU  24          1HG       GLU  24   4.419  -9.459  10.681
  190    H    GLY  25           H        GLY  25   0.183  -8.308  13.545
  191   1HA   GLY  25          2HA       GLY  25  -0.841  -7.224  15.406
  192   2HA   GLY  25          1HA       GLY  25   0.736  -6.601  15.858
  193    H    TYR  26           H        TYR  26  -1.341  -6.501  12.963
  194    HA   TYR  26           HA       TYR  26  -1.051  -3.572  12.973
  195   1HB   TYR  26          2HB       TYR  26  -0.777  -5.453  10.627
  196   2HB   TYR  26          1HB       TYR  26  -1.043  -3.724  10.439
  197    HD1  TYR  26           1HD      TYR  26   0.663  -2.249  11.915
  198    HD2  TYR  26           2HD      TYR  26   1.396  -6.188  10.484
  199    HE1  TYR  26           1HE      TYR  26   3.083  -1.854  12.083
  200    HE2  TYR  26           2HE      TYR  26   3.817  -5.805  10.648
  201    HH   TYR  26           HH       TYR  26   5.167  -3.271  12.352
  202    H    HIS  27           H        HIS  27  -2.636  -2.760  11.064
  203    HA   HIS  27           HA       HIS  27  -5.228  -4.104  11.411
  204   1HB   HIS  27          2HB       HIS  27  -4.577  -1.748  12.680
  205   2HB   HIS  27          1HB       HIS  27  -5.378  -1.176  11.221
  206    HD1  HIS  27           1HD      HIS  27  -7.269  -3.910  11.361
  207    HD2  HIS  27           2HD      HIS  27  -6.859  -0.835  14.127
  208    HE1  HIS  27           1HE      HIS  27  -9.377  -3.952  12.730
  209    HE2  HIS  27           2HE      HIS  27  -9.077  -2.130  14.444
  210    HA   PRO  28           HA       PRO  28  -4.265  -3.318   6.949
  211   1HB   PRO  28          2HB       PRO  28  -5.470  -5.947   6.567
  212   2HB   PRO  28          1HB       PRO  28  -3.870  -5.371   6.102
  213   1HG   PRO  28          2HG       PRO  28  -4.275  -7.173   8.091
  214   2HG   PRO  28          1HG       PRO  28  -2.911  -6.043   8.066
  215   1HD   PRO  28          2HD       PRO  28  -5.444  -5.923   9.645
  216   2HD   PRO  28          1HD       PRO  28  -3.800  -5.441  10.104
  217    H    ASP  29           H        ASP  29  -5.647  -2.457   5.559
  218    HA   ASP  29           HA       ASP  29  -8.511  -2.941   5.996
  219   1HB   ASP  29          2HB       ASP  29  -7.659  -0.651   6.689
  220   2HB   ASP  29          1HB       ASP  29  -7.454  -0.330   4.970
  221    H    THR  30           H        THR  30  -6.284  -3.727   3.959
  222    HA   THR  30           HA       THR  30  -6.121  -3.548   1.567
  223    HB   THR  30           HB       THR  30  -6.888  -5.666   0.875
  224    HG1  THR  30           1HG      THR  30  -8.827  -6.237   1.372
  225   1HG2  THR  30          1HG2      THR  30  -5.756  -6.947   2.308
  226   2HG2  THR  30          2HG2      THR  30  -6.749  -6.461   3.682
  227   3HG2  THR  30          3HG2      THR  30  -5.422  -5.431   3.145
  228    H    ALA  31           H        ALA  31  -6.851  -2.463  -0.078
  229    HA   ALA  31           HA       ALA  31  -9.712  -1.833  -0.245
  230   1HB   ALA  31          1HB       ALA  31  -9.149   0.191  -1.024
  231   2HB   ALA  31          2HB       ALA  31  -7.933  -0.465  -2.120
  232   3HB   ALA  31          3HB       ALA  31  -7.535  -0.186  -0.425
  233    H    LYS  32           H        LYS  32  -9.778  -1.156  -2.979
  234    HA   LYS  32           HA       LYS  32  -9.458  -3.796  -4.237
  235   1HB   LYS  32          2HB       LYS  32 -11.760  -3.515  -4.093
  236   2HB   LYS  32          1HB       LYS  32 -11.665  -1.777  -4.332
  237   1HG   LYS  32          2HG       LYS  32 -11.071  -2.158  -6.680
  238   2HG   LYS  32          1HG       LYS  32 -11.255  -3.893  -6.426
  239   1HD   LYS  32          2HD       LYS  32 -13.388  -3.592  -7.047
  240   2HD   LYS  32          1HD       LYS  32 -13.616  -2.882  -5.448
  241   1HE   LYS  32          2HE       LYS  32 -12.665  -0.744  -6.774
  242   2HE   LYS  32          1HE       LYS  32 -13.460  -1.592  -8.101
  243   1HZ   LYS  32          1HZ       LYS  32 -15.239  -0.465  -7.346
  244   2HZ   LYS  32          2HZ       LYS  32 -14.616  -0.272  -5.786
  245   3HZ   LYS  32          3HZ       LYS  32 -15.343  -1.734  -6.232
  246    H    THR  33           H        THR  33  -9.281  -0.303  -4.703
  247    HA   THR  33           HA       THR  33  -7.204  -0.621  -6.655
  248    HB   THR  33           HB       THR  33  -8.501   0.774  -8.380
  249    HG1  THR  33           1HG      THR  33 -10.647  -0.212  -6.816
  250   1HG2  THR  33          1HG2      THR  33  -8.082  -1.843  -8.330
  251   2HG2  THR  33          2HG2      THR  33  -9.050  -1.058  -9.577
  252   3HG2  THR  33          3HG2      THR  33  -9.841  -1.852  -8.216
  253    H    LEU  34           H        LEU  34  -7.044   1.818  -7.761
  254    HA   LEU  34           HA       LEU  34  -6.208   3.442  -5.600
  255   1HB   LEU  34          2HB       LEU  34  -6.664   4.321  -8.449
  256   2HB   LEU  34          1HB       LEU  34  -5.607   5.069  -7.266
  257    HG   LEU  34           HG       LEU  34  -5.171   2.260  -8.252
  258   1HD1  LEU  34          1HD1      LEU  34  -3.265   3.660  -9.523
  259   2HD1  LEU  34          2HD1      LEU  34  -4.585   4.829  -9.571
  260   3HD1  LEU  34          3HD1      LEU  34  -4.806   3.219 -10.258
  261   1HD2  LEU  34          1HD2      LEU  34  -4.117   3.093  -6.111
  262   2HD2  LEU  34          2HD2      LEU  34  -3.201   4.224  -7.108
  263   3HD2  LEU  34          3HD2      LEU  34  -3.004   2.487  -7.337
  264    H    ARG  35           H        ARG  35  -8.972   3.631  -7.820
  265    HA   ARG  35           HA       ARG  35 -10.056   6.015  -6.776
  266   1HB   ARG  35          2HB       ARG  35 -11.556   3.719  -8.054
  267   2HB   ARG  35          1HB       ARG  35 -12.110   5.381  -7.912
  268   1HG   ARG  35          2HG       ARG  35 -10.835   6.102  -9.637
  269   2HG   ARG  35          1HG       ARG  35  -9.541   4.947  -9.308
  270   1HD   ARG  35          2HD       ARG  35 -10.724   3.183 -10.351
  271   2HD   ARG  35          1HD       ARG  35 -12.217   4.119 -10.402
  272    HE   ARG  35           HE       ARG  35 -11.485   5.124 -12.324
  273   1HH1  ARG  35          1HH1      ARG  35  -8.791   3.524 -10.787
  274   2HH1  ARG  35          2HH1      ARG  35  -7.717   3.779 -12.121
  275   1HH2  ARG  35          1HH2      ARG  35 -10.074   5.460 -14.080
  276   2HH2  ARG  35          2HH2      ARG  35  -8.445   4.878 -13.990
  277    H    GLU  36           H        GLU  36 -10.658   2.603  -6.046
  278    HA   GLU  36           HA       GLU  36 -12.602   3.096  -4.031
  279   1HB   GLU  36          2HB       GLU  36 -12.062   0.912  -5.373
  280   2HB   GLU  36          1HB       GLU  36 -10.904   0.623  -4.083
  281   1HG   GLU  36          2HG       GLU  36 -13.576   1.355  -3.150
  282   2HG   GLU  36          1HG       GLU  36 -13.509  -0.153  -4.062
  283    H    ALA  37           H        ALA  37  -9.112   2.839  -4.080
  284    HA   ALA  37           HA       ALA  37  -8.789   2.637  -1.248
  285   1HB   ALA  37          1HB       ALA  37  -6.416   3.098  -1.705
  286   2HB   ALA  37          2HB       ALA  37  -6.820   3.467  -3.382
  287   3HB   ALA  37          3HB       ALA  37  -7.056   1.835  -2.757
  288    H    GLU  38           H        GLU  38  -9.156   5.254  -3.518
  289    HA   GLU  38           HA       GLU  38  -8.182   7.310  -1.809
  290   1HB   GLU  38          2HB       GLU  38  -9.966   7.339  -4.235
  291   2HB   GLU  38          1HB       GLU  38  -9.535   8.804  -3.365
  292   1HG   GLU  38          2HG       GLU  38  -7.331   8.708  -4.019
  293   2HG   GLU  38          1HG       GLU  38  -7.387   6.972  -4.318
  294    H    LYS  39           H        LYS  39 -11.377   5.969  -2.518
  295    HA   LYS  39           HA       LYS  39 -12.880   7.722  -0.923
  296   1HB   LYS  39          2HB       LYS  39 -13.964   6.249  -2.513
  297   2HB   LYS  39          1HB       LYS  39 -13.370   4.829  -1.663
  298   1HG   LYS  39          2HG       LYS  39 -15.034   6.733  -0.122
  299   2HG   LYS  39          1HG       LYS  39 -15.837   5.757  -1.353
  300   1HD   LYS  39          2HD       LYS  39 -14.454   3.817  -0.202
  301   2HD   LYS  39          1HD       LYS  39 -14.505   4.920   1.173
  302   1HE   LYS  39          2HE       LYS  39 -16.892   4.936   1.164
  303   2HE   LYS  39          1HE       LYS  39 -16.948   4.068  -0.369
  304   1HZ   LYS  39          1HZ       LYS  39 -15.842   2.952   2.151
  305   2HZ   LYS  39          2HZ       LYS  39 -16.064   2.126   0.690
  306   3HZ   LYS  39          3HZ       LYS  39 -17.404   2.651   1.577
  307    H    LYS  40           H        LYS  40 -11.171   4.722  -0.195
  308    HA   LYS  40           HA       LYS  40 -12.057   4.529   2.504
  309   1HB   LYS  40          2HB       LYS  40  -9.652   3.331   1.125
  310   2HB   LYS  40          1HB       LYS  40 -10.199   2.896   2.738
  311   1HG   LYS  40          2HG       LYS  40 -12.325   2.703   0.776
  312   2HG   LYS  40          1HG       LYS  40 -10.937   1.693   0.365
  313   1HD   LYS  40          2HD       LYS  40 -11.183   1.184   3.020
  314   2HD   LYS  40          1HD       LYS  40 -12.869   1.456   2.571
  315   1HE   LYS  40          2HE       LYS  40 -12.943  -0.374   1.204
  316   2HE   LYS  40          1HE       LYS  40 -11.224  -0.297   0.824
  317   1HZ   LYS  40          1HZ       LYS  40 -12.580  -1.607   3.043
  318   2HZ   LYS  40          2HZ       LYS  40 -11.096  -0.876   3.399
  319   3HZ   LYS  40          3HZ       LYS  40 -11.186  -2.067   2.202
  320    H    ILE  41           H        ILE  41  -9.081   5.748   0.992
  321    HA   ILE  41           HA       ILE  41  -7.889   6.535   3.464
  322    HB   ILE  41           HB       ILE  41  -7.209   7.472   0.676
  323   1HG1  ILE  41          2HG1      ILE  41  -5.645   5.375   2.111
  324   2HG1  ILE  41          1HG1      ILE  41  -7.174   4.905   1.376
  325   1HG2  ILE  41          1HG2      ILE  41  -5.761   7.623   3.304
  326   2HG2  ILE  41          2HG2      ILE  41  -6.173   8.934   2.199
  327   3HG2  ILE  41          3HG2      ILE  41  -4.927   7.769   1.757
  328   1HD1  ILE  41          1HD1      ILE  41  -6.125   4.681  -0.552
  329   2HD1  ILE  41          2HD1      ILE  41  -4.630   5.290   0.154
  330   3HD1  ILE  41          3HD1      ILE  41  -5.793   6.413  -0.549
  331    H    LYS  42           H        LYS  42 -10.203   7.982   1.368
  332    HA   LYS  42           HA       LYS  42  -9.738  10.696   1.783
  333   1HB   LYS  42          2HB       LYS  42 -12.030   9.044   0.966
  334   2HB   LYS  42          1HB       LYS  42 -12.431  10.627   1.618
  335   1HG   LYS  42          2HG       LYS  42 -11.145  11.728  -0.052
  336   2HG   LYS  42          1HG       LYS  42 -10.457  10.202  -0.609
  337   1HD   LYS  42          2HD       LYS  42 -12.402   9.558  -1.669
  338   2HD   LYS  42          1HD       LYS  42 -13.420  10.567  -0.639
  339   1HE   LYS  42          2HE       LYS  42 -13.468  12.019  -2.329
  340   2HE   LYS  42          1HE       LYS  42 -11.791  12.389  -1.927
  341   1HZ   LYS  42          1HZ       LYS  42 -11.485  10.222  -3.449
  342   2HZ   LYS  42          2HZ       LYS  42 -11.455  11.801  -4.054
  343   3HZ   LYS  42          3HZ       LYS  42 -12.872  10.881  -4.156
  344    H    GLU  43           H        GLU  43 -10.892   8.307   3.964
  345    HA   GLU  43           HA       GLU  43 -11.476  10.411   5.928
  346   1HB   GLU  43          2HB       GLU  43 -12.848   7.726   5.840
  347   2HB   GLU  43          1HB       GLU  43 -13.242   9.093   6.874
  348   1HG   GLU  43          2HG       GLU  43 -14.535  10.023   5.325
  349   2HG   GLU  43          1HG       GLU  43 -13.339   9.772   4.056
  350    H    LEU  44           H        LEU  44 -10.440   7.063   5.435
  351    HA   LEU  44           HA       LEU  44  -9.468   6.779   8.122
  352   1HB   LEU  44          2HB       LEU  44  -9.949   5.080   5.875
  353   2HB   LEU  44          1HB       LEU  44  -8.297   4.836   6.412
  354    HG   LEU  44           HG       LEU  44  -9.813   3.245   7.469
  355   1HD1  LEU  44          1HD1      LEU  44  -8.977   3.426   9.637
  356   2HD1  LEU  44          2HD1      LEU  44  -8.992   5.190   9.596
  357   3HD1  LEU  44          3HD1      LEU  44  -7.798   4.296   8.655
  358   1HD2  LEU  44          1HD2      LEU  44 -11.902   4.105   7.698
  359   2HD2  LEU  44          2HD2      LEU  44 -11.314   5.720   8.096
  360   3HD2  LEU  44          3HD2      LEU  44 -11.301   4.450   9.320
  361    H    PHE  45           H        PHE  45  -7.591   7.472   8.884
  362    HA   PHE  45           HA       PHE  45  -5.621   8.609   7.111
  363   1HB   PHE  45          2HB       PHE  45  -6.274   9.577   9.361
  364   2HB   PHE  45          1HB       PHE  45  -5.394   8.243  10.100
  365    HD1  PHE  45           1HD      PHE  45  -5.136  11.416   8.357
  366    HD2  PHE  45           2HD      PHE  45  -2.959   8.088   9.874
  367    HE1  PHE  45           1HE      PHE  45  -3.049  12.709   8.187
  368    HE2  PHE  45           2HE      PHE  45  -0.868   9.375   9.707
  369    HZ   PHE  45           HZ       PHE  45  -0.912  11.688   8.864
  370    H    PHE  46           H        PHE  46  -4.929   6.756   5.960
  371    HA   PHE  46           HA       PHE  46  -3.750   4.538   7.362
  372   1HB   PHE  46          2HB       PHE  46  -3.958   5.276   4.448
  373   2HB   PHE  46          1HB       PHE  46  -3.055   3.868   4.997
  374    HD1  PHE  46           1HD      PHE  46  -6.212   5.089   3.994
  375    HD2  PHE  46           2HD      PHE  46  -4.343   2.187   6.481
  376    HE1  PHE  46           1HE      PHE  46  -8.287   3.765   4.002
  377    HE2  PHE  46           2HE      PHE  46  -6.413   0.858   6.494
  378    HZ   PHE  46           HZ       PHE  46  -8.389   1.650   5.255
  379    HA   PRO  47           HA       PRO  47   0.204   6.700   7.626
  380   1HB   PRO  47          2HB       PRO  47   1.427   4.904   9.221
  381   2HB   PRO  47          1HB       PRO  47   0.226   6.041   9.843
  382   1HG   PRO  47          2HG       PRO  47  -0.104   3.161   9.093
  383   2HG   PRO  47          1HG       PRO  47  -0.724   4.024  10.513
  384   1HD   PRO  47          2HD       PRO  47  -2.245   3.487   8.322
  385   2HD   PRO  47          1HD       PRO  47  -2.500   4.908   9.352
  386    H    VAL  48           H        VAL  48  -0.460   3.488   6.510
  387    HA   VAL  48           HA       VAL  48   1.871   3.600   4.767
  388    HB   VAL  48           HB       VAL  48   1.236   1.051   6.224
  389   1HG1  VAL  48          1HG1      VAL  48   3.492   2.068   4.536
  390   2HG1  VAL  48          2HG1      VAL  48   2.553   0.584   4.365
  391   3HG1  VAL  48          3HG1      VAL  48   3.734   0.736   5.666
  392   1HG2  VAL  48          1HG2      VAL  48   1.727   2.634   7.942
  393   2HG2  VAL  48          2HG2      VAL  48   3.125   3.238   7.051
  394   3HG2  VAL  48          3HG2      VAL  48   3.142   1.604   7.714
  395    H    ILE  49           H        ILE  49   1.378   2.993   2.767
  396    HA   ILE  49           HA       ILE  49  -1.099   1.468   2.315
  397    HB   ILE  49           HB       ILE  49   0.107   3.282   0.246
  398   1HG1  ILE  49          2HG1      ILE  49  -0.243   4.683   2.222
  399   2HG1  ILE  49          1HG1      ILE  49  -1.425   5.067   0.975
  400   1HG2  ILE  49          1HG2      ILE  49  -2.658   2.192   0.733
  401   2HG2  ILE  49          2HG2      ILE  49  -1.542   1.738  -0.553
  402   3HG2  ILE  49          3HG2      ILE  49  -2.253   3.352  -0.532
  403   1HD1  ILE  49          1HD1      ILE  49  -2.110   4.794   3.495
  404   2HD1  ILE  49          2HD1      ILE  49  -2.174   3.088   3.054
  405   3HD1  ILE  49          3HD1      ILE  49  -3.170   4.259   2.191
  406    H    VAL  50           H        VAL  50  -1.088   0.062   0.425
  407    HA   VAL  50           HA       VAL  50   1.500  -0.593  -0.712
  408    HB   VAL  50           HB       VAL  50  -0.091  -2.651   0.827
  409   1HG1  VAL  50          1HG1      VAL  50   2.517  -3.522   0.020
  410   2HG1  VAL  50          2HG1      VAL  50   1.608  -2.990  -1.395
  411   3HG1  VAL  50          3HG1      VAL  50   0.945  -4.236  -0.338
  412   1HG2  VAL  50          1HG2      VAL  50   2.206  -2.771   2.037
  413   2HG2  VAL  50          2HG2      VAL  50   1.072  -1.486   2.450
  414   3HG2  VAL  50          3HG2      VAL  50   2.434  -1.153   1.381
  415    H    LEU  51           H        LEU  51   0.904  -0.273  -2.748
  416    HA   LEU  51           HA       LEU  51  -1.652  -1.088  -3.767
  417   1HB   LEU  51          2HB       LEU  51  -0.550   0.920  -4.601
  418   2HB   LEU  51          1HB       LEU  51   0.799  -0.040  -5.175
  419    HG   LEU  51           HG       LEU  51  -0.748  -1.192  -6.750
  420   1HD1  LEU  51          1HD1      LEU  51  -2.908  -1.057  -6.141
  421   2HD1  LEU  51          2HD1      LEU  51  -2.872   0.439  -7.075
  422   3HD1  LEU  51          3HD1      LEU  51  -2.691   0.489  -5.321
  423   1HD2  LEU  51          1HD2      LEU  51   0.315   1.437  -6.889
  424   2HD2  LEU  51          2HD2      LEU  51  -1.240   1.430  -7.721
  425   3HD2  LEU  51          3HD2      LEU  51   0.023   0.297  -8.202
  426    H    ASP  52           H        ASP  52  -2.075  -2.652  -5.305
  427    HA   ASP  52           HA       ASP  52   0.020  -4.660  -5.772
  428   1HB   ASP  52          2HB       ASP  52  -1.984  -5.117  -4.016
  429   2HB   ASP  52          1HB       ASP  52  -2.764  -5.645  -5.504
  430    H    VAL  53           H        VAL  53   0.285  -3.692  -7.826
  431    HA   VAL  53           HA       VAL  53  -1.765  -3.256  -9.688
  432    HB   VAL  53           HB       VAL  53   1.162  -3.840 -10.169
  433   1HG1  VAL  53          1HG1      VAL  53   0.292  -4.135 -12.273
  434   2HG1  VAL  53          2HG1      VAL  53   0.576  -2.394 -12.273
  435   3HG1  VAL  53          3HG1      VAL  53  -1.048  -3.022 -11.995
  436   1HG2  VAL  53          1HG2      VAL  53   0.970  -1.917  -8.797
  437   2HG2  VAL  53          2HG2      VAL  53  -0.367  -1.282  -9.758
  438   3HG2  VAL  53          3HG2      VAL  53   1.258  -1.340 -10.439
  439    H    TRP  54           H        TRP  54  -2.980  -5.341  -9.264
  440    HA   TRP  54           HA       TRP  54  -1.942  -7.808 -10.187
  441   1HB   TRP  54          2HB       TRP  54  -3.826  -7.877  -8.717
  442   2HB   TRP  54          1HB       TRP  54  -4.771  -6.829  -9.769
  443    HD1  TRP  54           HD       TRP  54  -3.022 -10.276 -10.242
  444    HE1  TRP  54           1HE      TRP  54  -4.657 -11.814 -11.497
  445    HE3  TRP  54           3HE      TRP  54  -6.935  -7.034 -10.795
  446    HZ2  TRP  54           2HZ      TRP  54  -7.261 -11.678 -12.577
  447    HZ3  TRP  54           3HZ      TRP  54  -8.961  -7.815 -11.951
  448    HH2  TRP  54           HH       TRP  54  -9.119 -10.090 -12.823
  449    H    MET  55           H        MET  55  -4.888  -6.791 -11.762
  450    HA   MET  55           HA       MET  55  -3.466  -6.482 -14.303
  451   1HB   MET  55          2HB       MET  55  -5.579  -8.488 -13.637
  452   2HB   MET  55          1HB       MET  55  -5.524  -7.818 -15.262
  453   1HG   MET  55          2HG       MET  55  -3.714  -8.998 -15.822
  454   2HG   MET  55          1HG       MET  55  -2.933  -8.728 -14.266
  455   1HE   MET  55          1HE       MET  55  -3.723 -12.690 -15.472
  456   2HE   MET  55          2HE       MET  55  -2.528 -11.421 -15.742
  457   3HE   MET  55          3HE       MET  55  -4.094 -11.343 -16.549
  458    HA   PRO  56           HA       PRO  56  -7.214  -3.630 -13.769
  459   1HB   PRO  56          2HB       PRO  56  -6.359  -1.558 -12.335
  460   2HB   PRO  56          1HB       PRO  56  -6.866  -3.053 -11.540
  461   1HG   PRO  56          2HG       PRO  56  -4.107  -2.056 -12.117
  462   2HG   PRO  56          1HG       PRO  56  -4.727  -2.851 -10.661
  463   1HD   PRO  56          2HD       PRO  56  -3.322  -4.117 -12.688
  464   2HD   PRO  56          1HD       PRO  56  -4.382  -4.925 -11.518
  465    H    ASP  57           H        ASP  57  -6.971  -0.942 -14.046
  466    HA   ASP  57           HA       ASP  57  -4.911  -0.411 -16.042
  467   1HB   ASP  57          2HB       ASP  57  -6.622   0.525 -17.610
  468   2HB   ASP  57          1HB       ASP  57  -6.718  -1.222 -17.412
  469    H    GLY  58           H        GLY  58  -5.085   0.578 -13.440
  470   1HA   GLY  58          2HA       GLY  58  -6.187   3.280 -13.688
  471   2HA   GLY  58          1HA       GLY  58  -5.599   2.533 -12.210
  472    H    ASP  59           H        ASP  59  -4.722   4.937 -12.391
  473    HA   ASP  59           HA       ASP  59  -2.038   4.780 -13.599
  474   1HB   ASP  59          2HB       ASP  59  -3.657   6.549 -14.483
  475   2HB   ASP  59          1HB       ASP  59  -3.482   7.340 -12.919
  476    H    GLY  60           H        GLY  60  -1.393   3.666 -11.617
  477   1HA   GLY  60          2HA       GLY  60  -1.562   4.787  -9.054
  478   2HA   GLY  60          1HA       GLY  60  -0.344   3.632  -9.577
  479    H    VAL  61           H        VAL  61   0.542   5.542 -11.714
  480    HA   VAL  61           HA       VAL  61   2.713   6.675 -10.436
  481    HB   VAL  61           HB       VAL  61   1.429   7.724 -12.959
  482   1HG1  VAL  61          1HG1      VAL  61   4.130   7.976 -11.711
  483   2HG1  VAL  61          2HG1      VAL  61   3.101   9.222 -12.417
  484   3HG1  VAL  61          3HG1      VAL  61   3.944   8.080 -13.462
  485   1HG2  VAL  61          1HG2      VAL  61   3.187   5.337 -12.481
  486   2HG2  VAL  61          2HG2      VAL  61   3.110   6.137 -14.050
  487   3HG2  VAL  61          3HG2      VAL  61   1.657   5.422 -13.353
  488    H    ASN  62           H        ASN  62  -0.390   8.172 -11.296
  489    HA   ASN  62           HA       ASN  62   0.393  10.660 -10.011
  490   1HB   ASN  62          2HB       ASN  62  -1.437   9.927 -12.065
  491   2HB   ASN  62          1HB       ASN  62  -2.362  10.672 -10.765
  492   1HD2  ASN  62          1HD2      ASN  62   0.398  11.120 -12.899
  493   2HD2  ASN  62          2HD2      ASN  62   0.344  12.847 -12.907
  494    H    PHE  63           H        PHE  63  -0.522   7.843  -8.768
  495    HA   PHE  63           HA       PHE  63  -2.583   8.825  -6.968
  496   1HB   PHE  63          2HB       PHE  63  -2.792   6.546  -7.859
  497   2HB   PHE  63          1HB       PHE  63  -1.250   6.113  -7.127
  498    HD1  PHE  63           1HD      PHE  63  -4.316   7.871  -5.931
  499    HD2  PHE  63           2HD      PHE  63  -1.516   4.725  -5.323
  500    HE1  PHE  63           1HE      PHE  63  -5.481   7.241  -3.859
  501    HE2  PHE  63           2HE      PHE  63  -2.675   4.089  -3.248
  502    HZ   PHE  63           HZ       PHE  63  -4.662   5.349  -2.513
  503    H    ILE  64           H        ILE  64   0.807   7.870  -6.899
  504    HA   ILE  64           HA       ILE  64   1.328   7.721  -4.215
  505    HB   ILE  64           HB       ILE  64   3.107   9.093  -6.234
  506   1HG1  ILE  64          2HG1      ILE  64   3.980   6.463  -5.784
  507   2HG1  ILE  64          1HG1      ILE  64   2.236   6.340  -5.995
  508   1HG2  ILE  64          1HG2      ILE  64   4.932   8.471  -4.780
  509   2HG2  ILE  64          2HG2      ILE  64   3.819   7.667  -3.674
  510   3HG2  ILE  64          3HG2      ILE  64   3.753   9.418  -3.875
  511   1HD1  ILE  64          1HD1      ILE  64   4.062   7.756  -7.917
  512   2HD1  ILE  64          2HD1      ILE  64   2.357   7.361  -8.143
  513   3HD1  ILE  64          3HD1      ILE  64   3.559   6.074  -8.080
  514    H    ASP  65           H        ASP  65   0.590  10.567  -6.084
  515    HA   ASP  65           HA       ASP  65   1.472  12.431  -4.086
  516   1HB   ASP  65          2HB       ASP  65   1.168  12.793  -6.656
  517   2HB   ASP  65          1HB       ASP  65  -0.511  13.119  -6.232
  518    H    PHE  66           H        PHE  66  -1.564  10.899  -4.974
  519    HA   PHE  66           HA       PHE  66  -3.306  12.456  -3.437
  520   1HB   PHE  66          2HB       PHE  66  -4.187  10.910  -5.061
  521   2HB   PHE  66          1HB       PHE  66  -3.437   9.543  -4.244
  522    HD1  PHE  66           1HD      PHE  66  -4.418   8.583  -2.270
  523    HD2  PHE  66           2HD      PHE  66  -6.184  11.962  -4.161
  524    HE1  PHE  66           1HE      PHE  66  -6.473   8.235  -0.967
  525    HE2  PHE  66           2HE      PHE  66  -8.244  11.620  -2.859
  526    HZ   PHE  66           HZ       PHE  66  -8.390   9.754  -1.258
  527    H    ILE  67           H        ILE  67  -1.399   9.592  -2.615
  528    HA   ILE  67           HA       ILE  67  -2.380   9.200  -0.019
  529    HB   ILE  67           HB       ILE  67   0.342   8.577  -1.179
  530   1HG1  ILE  67          2HG1      ILE  67  -0.761   6.197  -0.912
  531   2HG1  ILE  67          1HG1      ILE  67  -2.261   7.117  -0.951
  532   1HG2  ILE  67          1HG2      ILE  67   0.929   8.395   0.998
  533   2HG2  ILE  67          2HG2      ILE  67   0.115   6.837   0.852
  534   3HG2  ILE  67          3HG2      ILE  67  -0.738   8.217   1.546
  535   1HD1  ILE  67          1HD1      ILE  67  -0.394   7.825  -3.076
  536   2HD1  ILE  67          2HD1      ILE  67  -2.118   7.463  -3.147
  537   3HD1  ILE  67          3HD1      ILE  67  -0.941   6.150  -3.125
  538    H    LYS  68           H        LYS  68   0.294  11.190  -1.233
  539    HA   LYS  68           HA       LYS  68   0.947  12.158   1.408
  540   1HB   LYS  68          2HB       LYS  68   1.897  13.303  -1.215
  541   2HB   LYS  68          1HB       LYS  68   2.676  13.415   0.357
  542   1HG   LYS  68          2HG       LYS  68   2.574  10.724   0.007
  543   2HG   LYS  68          1HG       LYS  68   2.775  11.288  -1.653
  544   1HD   LYS  68          2HD       LYS  68   4.505  12.568   0.367
  545   2HD   LYS  68          1HD       LYS  68   4.826  10.862   0.044
  546   1HE   LYS  68          2HE       LYS  68   6.175  11.897  -1.514
  547   2HE   LYS  68          1HE       LYS  68   4.712  11.590  -2.450
  548   1HZ   LYS  68          1HZ       LYS  68   4.166  13.996  -1.468
  549   2HZ   LYS  68          2HZ       LYS  68   4.948  13.757  -2.948
  550   3HZ   LYS  68          3HZ       LYS  68   5.851  14.109  -1.561
  551    H    GLU  69           H        GLU  69  -1.298  12.961  -1.023
  552    HA   GLU  69           HA       GLU  69  -1.480  15.764  -0.515
  553   1HB   GLU  69          2HB       GLU  69  -2.221  14.568  -2.620
  554   2HB   GLU  69          1HB       GLU  69  -3.614  14.010  -1.708
  555   1HG   GLU  69          2HG       GLU  69  -3.267  16.862  -1.450
  556   2HG   GLU  69          1HG       GLU  69  -3.385  16.372  -3.140
  557    H    ASN  70           H        ASN  70  -3.021  12.886   0.738
  558    HA   ASN  70           HA       ASN  70  -4.391  14.555   2.737
  559   1HB   ASN  70          2HB       ASN  70  -5.961  12.326   2.663
  560   2HB   ASN  70          1HB       ASN  70  -6.306  13.814   1.788
  561   1HD2  ASN  70          1HD2      ASN  70  -5.126  13.920  -0.395
  562   2HD2  ASN  70          2HD2      ASN  70  -5.209  12.492  -1.361
  563    H    SER  71           H        SER  71  -1.833  12.772   2.499
  564    HA   SER  71           HA       SER  71  -1.917  11.872   5.214
  565   1HB   SER  71          2HB       SER  71  -2.486   9.983   3.073
  566   2HB   SER  71          1HB       SER  71  -1.069   9.502   4.008
  567    HG   SER  71           HG       SER  71  -3.693  10.004   4.949
  568    HA   PRO  72           HA       PRO  72   2.209  13.087   3.366
  569   1HB   PRO  72          2HB       PRO  72   2.309  14.955   5.618
  570   2HB   PRO  72          1HB       PRO  72   2.512  15.276   3.894
  571   1HG   PRO  72          2HG       PRO  72   0.333  16.084   5.267
  572   2HG   PRO  72          1HG       PRO  72   0.263  15.618   3.557
  573   1HD   PRO  72          2HD       PRO  72  -0.530  14.057   5.986
  574   2HD   PRO  72          1HD       PRO  72  -1.337  14.176   4.408
  575    H    ASP  73           H        ASP  73   1.011  12.225   6.453
  576    HA   ASP  73           HA       ASP  73   3.676  11.484   7.417
  577   1HB   ASP  73          2HB       ASP  73   2.195  12.802   8.917
  578   2HB   ASP  73          1HB       ASP  73   1.051  11.464   8.913
  579    H    SER  74           H        SER  74   2.304  10.029   5.292
  580    HA   SER  74           HA       SER  74   1.880   7.441   6.627
  581   1HB   SER  74          2HB       SER  74  -0.093   8.227   5.402
  582   2HB   SER  74          1HB       SER  74   0.870   8.385   3.934
  583    HG   SER  74           HG       SER  74  -0.459   6.327   4.517
  584    H    VAL  75           H        VAL  75   2.096   5.901   4.215
  585    HA   VAL  75           HA       VAL  75   4.734   6.421   3.137
  586    HB   VAL  75           HB       VAL  75   4.248   3.873   4.689
  587   1HG1  VAL  75          1HG1      VAL  75   6.291   4.774   2.737
  588   2HG1  VAL  75          2HG1      VAL  75   5.693   3.153   3.084
  589   3HG1  VAL  75          3HG1      VAL  75   6.881   3.900   4.151
  590   1HG2  VAL  75          1HG2      VAL  75   4.620   5.643   6.244
  591   2HG2  VAL  75          2HG2      VAL  75   5.945   6.294   5.280
  592   3HG2  VAL  75          3HG2      VAL  75   6.131   4.744   6.100
  593    H    VAL  76           H        VAL  76   5.001   5.610   1.161
  594    HA   VAL  76           HA       VAL  76   2.814   3.946   0.099
  595    HB   VAL  76           HB       VAL  76   4.722   5.517  -1.608
  596   1HG1  VAL  76          1HG1      VAL  76   3.234   3.737  -2.574
  597   2HG1  VAL  76          2HG1      VAL  76   3.037   5.345  -3.273
  598   3HG1  VAL  76          3HG1      VAL  76   1.859   4.739  -2.109
  599   1HG2  VAL  76          1HG2      VAL  76   2.199   6.501  -0.288
  600   2HG2  VAL  76          2HG2      VAL  76   2.965   7.299  -1.661
  601   3HG2  VAL  76          3HG2      VAL  76   3.825   7.163  -0.127
  602    H    ILE  77           H        ILE  77   3.292   1.880  -0.130
  603    HA   ILE  77           HA       ILE  77   6.052   1.032  -0.546
  604    HB   ILE  77           HB       ILE  77   3.573  -0.654  -0.165
  605   1HG1  ILE  77          2HG1      ILE  77   3.992   0.717   1.805
  606   2HG1  ILE  77          1HG1      ILE  77   4.404  -0.960   2.147
  607   1HG2  ILE  77          1HG2      ILE  77   4.836  -2.470  -0.427
  608   2HG2  ILE  77          2HG2      ILE  77   6.133  -1.815   0.572
  609   3HG2  ILE  77          3HG2      ILE  77   6.043  -1.401  -1.140
  610   1HD1  ILE  77          1HD1      ILE  77   6.803  -0.113   1.393
  611   2HD1  ILE  77          2HD1      ILE  77   6.217   0.047   3.049
  612   3HD1  ILE  77          3HD1      ILE  77   6.140   1.424   1.950
  613    H    VAL  78           H        VAL  78   2.918   0.080  -1.978
  614    HA   VAL  78           HA       VAL  78   2.360  -0.595  -4.088
  615    HB   VAL  78           HB       VAL  78   4.443   1.467  -4.859
  616   1HG1  VAL  78          1HG1      VAL  78   2.073   0.557  -6.479
  617   2HG1  VAL  78          2HG1      VAL  78   3.683  -0.137  -6.663
  618   3HG1  VAL  78          3HG1      VAL  78   3.417   1.575  -6.991
  619   1HG2  VAL  78          1HG2      VAL  78   1.564   2.103  -4.957
  620   2HG2  VAL  78          2HG2      VAL  78   2.937   3.106  -4.490
  621   3HG2  VAL  78          3HG2      VAL  78   2.268   1.942  -3.348
  622    H    ILE  79           H        ILE  79   3.023  -2.703  -4.221
  623    HA   ILE  79           HA       ILE  79   5.656  -3.157  -5.466
  624    HB   ILE  79           HB       ILE  79   4.328  -5.110  -3.600
  625   1HG1  ILE  79          2HG1      ILE  79   6.660  -3.340  -2.901
  626   2HG1  ILE  79          1HG1      ILE  79   4.997  -2.902  -2.521
  627   1HG2  ILE  79          1HG2      ILE  79   6.766  -5.925  -3.525
  628   2HG2  ILE  79          2HG2      ILE  79   6.981  -4.950  -4.978
  629   3HG2  ILE  79          3HG2      ILE  79   5.812  -6.271  -4.967
  630   1HD1  ILE  79          1HD1      ILE  79   4.838  -4.418  -0.858
  631   2HD1  ILE  79          2HD1      ILE  79   6.587  -4.190  -0.821
  632   3HD1  ILE  79          3HD1      ILE  79   5.895  -5.578  -1.661
  633    H    THR  80           H        THR  80   5.766  -4.633  -7.104
  634    HA   THR  80           HA       THR  80   3.984  -6.617  -7.781
  635    HB   THR  80           HB       THR  80   3.098  -5.025  -9.877
  636    HG1  THR  80           1HG      THR  80   2.339  -3.560  -7.641
  637   1HG2  THR  80          1HG2      THR  80   1.926  -6.749  -8.268
  638   2HG2  THR  80          2HG2      THR  80   1.008  -5.571  -9.202
  639   3HG2  THR  80          3HG2      THR  80   1.348  -5.271  -7.500
  640    H    GLY  81           H        GLY  81   5.406  -7.832  -8.828
  641   1HA   GLY  81          2HA       GLY  81   7.068  -6.547 -10.908
  642   2HA   GLY  81          1HA       GLY  81   7.615  -7.893  -9.919
  643    H    HIS  82           H        HIS  82   5.492  -6.929 -12.539
  644    HA   HIS  82           HA       HIS  82   5.330  -9.757 -13.352
  645   1HB   HIS  82          2HB       HIS  82   3.161  -8.519 -12.588
  646   2HB   HIS  82          1HB       HIS  82   3.259  -7.744 -14.166
  647    HD1  HIS  82           1HD      HIS  82   0.838  -9.234 -14.090
  648    HD2  HIS  82           2HD      HIS  82   4.427 -11.209 -14.785
  649    HE1  HIS  82           1HE      HIS  82   0.207 -11.406 -15.187
  650    HE2  HIS  82           2HE      HIS  82   2.389 -12.622 -15.522
  651    H    GLY  83           H        GLY  83   7.365  -7.791 -14.045
  652   1HA   GLY  83          2HA       GLY  83   8.568  -7.768 -16.100
  653   2HA   GLY  83          1HA       GLY  83   7.046  -7.933 -16.960
  654    H    SER  84           H        SER  84   7.850  -5.634 -14.393
  655    HA   SER  84           HA       SER  84   7.898  -3.455 -16.339
  656   1HB   SER  84          2HB       SER  84   6.342  -2.166 -14.720
  657   2HB   SER  84          1HB       SER  84   5.614  -3.348 -15.807
  658    HG   SER  84           HG       SER  84   4.880  -4.266 -14.080
  659    H    VAL  85           H        VAL  85   9.909  -2.740 -15.941
  660    HA   VAL  85           HA       VAL  85  10.785  -2.390 -13.165
  661    HB   VAL  85           HB       VAL  85  13.024  -1.892 -14.235
  662   1HG1  VAL  85          1HG1      VAL  85  13.162  -4.422 -15.074
  663   2HG1  VAL  85          2HG1      VAL  85  11.611  -4.492 -14.238
  664   3HG1  VAL  85          3HG1      VAL  85  13.059  -3.988 -13.367
  665   1HG2  VAL  85          1HG2      VAL  85  13.364  -1.986 -16.466
  666   2HG2  VAL  85          2HG2      VAL  85  11.646  -1.595 -16.530
  667   3HG2  VAL  85          3HG2      VAL  85  12.175  -3.268 -16.701
  668    H    ASP  86           H        ASP  86   9.922  -0.612 -16.030
  669    HA   ASP  86           HA       ASP  86  10.978   1.891 -15.034
  670   1HB   ASP  86          2HB       ASP  86  10.958   1.418 -17.451
  671   2HB   ASP  86          1HB       ASP  86   9.199   1.338 -17.419
  672    H    THR  87           H        THR  87   8.453   0.124 -14.053
  673    HA   THR  87           HA       THR  87   6.535   2.314 -13.836
  674    HB   THR  87           HB       THR  87   6.009  -0.245 -14.278
  675    HG1  THR  87           1HG      THR  87   4.022   0.328 -13.860
  676   1HG2  THR  87          1HG2      THR  87   7.107  -0.922 -12.081
  677   2HG2  THR  87          2HG2      THR  87   5.501  -1.565 -12.420
  678   3HG2  THR  87          3HG2      THR  87   5.692  -0.219 -11.298
  679    H    ALA  88           H        ALA  88   8.693   0.347 -11.929
  680    HA   ALA  88           HA       ALA  88   7.999   1.179  -9.355
  681   1HB   ALA  88          1HB       ALA  88  10.515   0.683  -8.931
  682   2HB   ALA  88          2HB       ALA  88  10.513   0.147 -10.611
  683   3HB   ALA  88          3HB       ALA  88   9.454  -0.633  -9.439
  684    H    VAL  89           H        VAL  89  10.612   2.347 -11.442
  685    HA   VAL  89           HA       VAL  89  11.365   4.523  -9.855
  686    HB   VAL  89           HB       VAL  89  12.583   5.337 -11.774
  687   1HG1  VAL  89          1HG1      VAL  89  13.020   2.980 -10.579
  688   2HG1  VAL  89          2HG1      VAL  89  14.067   3.627 -11.842
  689   3HG1  VAL  89          3HG1      VAL  89  12.835   2.430 -12.244
  690   1HG2  VAL  89          1HG2      VAL  89  12.320   4.360 -13.997
  691   2HG2  VAL  89          2HG2      VAL  89  10.815   5.101 -13.454
  692   3HG2  VAL  89          3HG2      VAL  89  11.002   3.349 -13.407
  693    H    LYS  90           H        LYS  90   8.741   4.137 -12.109
  694    HA   LYS  90           HA       LYS  90   8.292   6.967 -12.430
  695   1HB   LYS  90          2HB       LYS  90   7.722   5.372 -14.212
  696   2HB   LYS  90          1HB       LYS  90   6.527   4.629 -13.156
  697   1HG   LYS  90          2HG       LYS  90   5.116   6.476 -13.249
  698   2HG   LYS  90          1HG       LYS  90   6.396   7.542 -13.829
  699   1HD   LYS  90          2HD       LYS  90   6.274   5.585 -15.768
  700   2HD   LYS  90          1HD       LYS  90   4.583   5.814 -15.318
  701   1HE   LYS  90          2HE       LYS  90   4.911   7.367 -17.022
  702   2HE   LYS  90          1HE       LYS  90   5.078   8.325 -15.551
  703   1HZ   LYS  90          1HZ       LYS  90   6.832   8.407 -17.523
  704   2HZ   LYS  90          2HZ       LYS  90   7.514   7.147 -16.625
  705   3HZ   LYS  90          3HZ       LYS  90   7.267   8.659 -15.908
  706    H    ALA  91           H        ALA  91   7.425   4.593 -10.115
  707    HA   ALA  91           HA       ALA  91   5.248   6.297  -9.111
  708   1HB   ALA  91          1HB       ALA  91   4.554   4.301  -7.810
  709   2HB   ALA  91          2HB       ALA  91   5.834   3.386  -8.604
  710   3HB   ALA  91          3HB       ALA  91   4.510   4.057  -9.556
  711    H    ILE  92           H        ILE  92   8.337   4.869  -8.295
  712    HA   ILE  92           HA       ILE  92   8.150   5.628  -5.518
  713    HB   ILE  92           HB       ILE  92  10.234   4.626  -5.171
  714   1HG1  ILE  92          2HG1      ILE  92  10.730   4.887  -8.146
  715   2HG1  ILE  92          1HG1      ILE  92  11.535   5.789  -6.869
  716   1HG2  ILE  92          1HG2      ILE  92  10.007   2.617  -7.045
  717   2HG2  ILE  92          2HG2      ILE  92   8.375   3.273  -6.956
  718   3HG2  ILE  92          3HG2      ILE  92   9.171   2.693  -5.496
  719   1HD1  ILE  92          1HD1      ILE  92  12.512   3.690  -6.040
  720   2HD1  ILE  92          2HD1      ILE  92  12.980   4.049  -7.702
  721   3HD1  ILE  92          3HD1      ILE  92  11.748   2.830  -7.376
  722    H    LYS  93           H        LYS  93   9.259   7.065  -8.451
  723    HA   LYS  93           HA       LYS  93  11.082   8.929  -7.323
  724   1HB   LYS  93          2HB       LYS  93  10.987  10.061  -9.455
  725   2HB   LYS  93          1HB       LYS  93  11.033   8.326  -9.733
  726   1HG   LYS  93          2HG       LYS  93   8.723   8.267 -10.281
  727   2HG   LYS  93          1HG       LYS  93   8.488   9.927  -9.729
  728   1HD   LYS  93          2HD       LYS  93  10.512  10.102 -11.631
  729   2HD   LYS  93          1HD       LYS  93   9.369   8.938 -12.307
  730   1HE   LYS  93          2HE       LYS  93   7.548  10.600 -11.803
  731   2HE   LYS  93          1HE       LYS  93   8.816  11.762 -11.416
  732   1HZ   LYS  93          1HZ       LYS  93   9.675  11.079 -13.767
  733   2HZ   LYS  93          2HZ       LYS  93   8.445  12.229 -13.607
  734   3HZ   LYS  93          3HZ       LYS  93   8.061  10.633 -14.015
  735    H    LYS  94           H        LYS  94   7.622   8.928  -7.901
  736    HA   LYS  94           HA       LYS  94   7.088  11.640  -7.501
  737   1HB   LYS  94          2HB       LYS  94   5.505   9.135  -7.236
  738   2HB   LYS  94          1HB       LYS  94   4.831  10.628  -6.597
  739   1HG   LYS  94          2HG       LYS  94   5.861  10.469  -9.403
  740   2HG   LYS  94          1HG       LYS  94   4.229   9.942  -8.989
  741   1HD   LYS  94          2HD       LYS  94   3.544  12.054  -9.108
  742   2HD   LYS  94          1HD       LYS  94   4.615  12.458  -7.765
  743   1HE   LYS  94          2HE       LYS  94   5.701  12.272 -10.544
  744   2HE   LYS  94          1HE       LYS  94   4.837  13.721 -10.032
  745   1HZ   LYS  94          1HZ       LYS  94   6.932  14.292  -9.424
  746   2HZ   LYS  94          2HZ       LYS  94   7.432  12.698  -9.161
  747   3HZ   LYS  94          3HZ       LYS  94   6.484  13.490  -8.004
  748    H    GLY  95           H        GLY  95   7.839   9.107  -5.249
  749   1HA   GLY  95          2HA       GLY  95   8.805  10.201  -3.145
  750   2HA   GLY  95          1HA       GLY  95   7.200  10.901  -3.001
  751    H    ALA  96           H        ALA  96   7.919   7.608  -4.069
  752    HA   ALA  96           HA       ALA  96   6.237   6.608  -1.917
  753   1HB   ALA  96          1HB       ALA  96   5.821   4.788  -3.204
  754   2HB   ALA  96          2HB       ALA  96   7.467   4.717  -3.832
  755   3HB   ALA  96          3HB       ALA  96   6.321   5.885  -4.491
  756    H    TYR  97           H        TYR  97   7.286   4.061  -1.583
  757    HA   TYR  97           HA       TYR  97   9.789   4.663  -0.161
  758   1HB   TYR  97          2HB       TYR  97   7.871   4.075   1.271
  759   2HB   TYR  97          1HB       TYR  97   7.730   2.533   0.436
  760    HD1  TYR  97           1HD      TYR  97  10.341   4.532   2.223
  761    HD2  TYR  97           2HD      TYR  97   8.660   0.697   1.468
  762    HE1  TYR  97           1HE      TYR  97  11.921   3.531   3.819
  763    HE2  TYR  97           2HE      TYR  97  10.235  -0.314   3.062
  764    HH   TYR  97           HH       TYR  97  12.917   0.886   4.011
  765    H    GLU  98           H        GLU  98   9.416   3.774  -2.963
  766    HA   GLU  98           HA       GLU  98  10.781   2.604  -4.383
  767   1HB   GLU  98          2HB       GLU  98  12.597   1.453  -3.659
  768   2HB   GLU  98          1HB       GLU  98  12.226   2.289  -2.164
  769   1HG   GLU  98          2HG       GLU  98  10.753   0.071  -1.803
  770   2HG   GLU  98          1HG       GLU  98  12.018  -0.579  -2.845
  771    H    PHE  99           H        PHE  99  10.838   0.482  -5.414
  772    HA   PHE  99           HA       PHE  99   8.269  -0.868  -5.070
  773   1HB   PHE  99          2HB       PHE  99   9.842  -0.117  -7.306
  774   2HB   PHE  99          1HB       PHE  99   9.787  -1.874  -7.288
  775    HD1  PHE  99           1HD      PHE  99   8.145  -2.802  -8.573
  776    HD2  PHE  99           2HD      PHE  99   7.405   0.944  -6.694
  777    HE1  PHE  99           1HE      PHE  99   5.909  -2.735  -9.599
  778    HE2  PHE  99           2HE      PHE  99   5.170   1.020  -7.719
  779    HZ   PHE  99           HZ       PHE  99   4.418  -0.822  -9.171
  780    H    LEU 100           H        LEU 100   8.591  -2.258  -3.361
  781    HA   LEU 100           HA       LEU 100  10.806  -3.738  -2.722
  782   1HB   LEU 100          2HB       LEU 100   8.627  -3.483  -1.467
  783   2HB   LEU 100          1HB       LEU 100   7.988  -4.755  -2.490
  784    HG   LEU 100           HG       LEU 100   9.681  -6.304  -1.626
  785   1HD1  LEU 100          1HD1      LEU 100  11.548  -5.188  -0.949
  786   2HD1  LEU 100          2HD1      LEU 100  10.739  -5.351   0.610
  787   3HD1  LEU 100          3HD1      LEU 100  10.632  -3.835  -0.284
  788   1HD2  LEU 100          1HD2      LEU 100   8.726  -6.560   0.573
  789   2HD2  LEU 100          2HD2      LEU 100   7.475  -6.099  -0.580
  790   3HD2  LEU 100          3HD2      LEU 100   8.130  -4.899   0.533
  791    H    GLU 101           H        GLU 101  11.938  -4.724  -4.333
  792    HA   GLU 101           HA       GLU 101  10.527  -6.666  -6.024
  793   1HB   GLU 101          2HB       GLU 101  12.506  -6.594  -7.470
  794   2HB   GLU 101          1HB       GLU 101  11.835  -4.987  -7.229
  795   1HG   GLU 101          2HG       GLU 101  13.688  -5.192  -5.211
  796   2HG   GLU 101          1HG       GLU 101  14.457  -6.041  -6.551
  797    H    LYS 102           H        LYS 102  10.414  -8.105  -4.137
  798    HA   LYS 102           HA       LYS 102  12.696  -9.894  -4.113
  799   1HB   LYS 102          2HB       LYS 102  11.914  -8.208  -1.805
  800   2HB   LYS 102          1HB       LYS 102  12.259  -9.896  -1.449
  801   1HG   LYS 102          2HG       LYS 102  14.473  -9.714  -2.078
  802   2HG   LYS 102          1HG       LYS 102  14.180  -8.285  -3.072
  803   1HD   LYS 102          2HD       LYS 102  13.548  -7.952  -0.223
  804   2HD   LYS 102          1HD       LYS 102  15.253  -8.245  -0.570
  805   1HE   LYS 102          2HE       LYS 102  15.524  -6.247  -1.581
  806   2HE   LYS 102          1HE       LYS 102  13.928  -6.295  -2.329
  807   1HZ   LYS 102          1HZ       LYS 102  13.201  -5.944   0.166
  808   2HZ   LYS 102          2HZ       LYS 102  13.599  -4.640  -0.835
  809   3HZ   LYS 102          3HZ       LYS 102  14.733  -5.232   0.270
  810    HA   PRO 103           HA       PRO 103   8.330 -11.732  -3.930
  811   1HB   PRO 103          2HB       PRO 103   8.683 -13.298  -6.157
  812   2HB   PRO 103          1HB       PRO 103   7.962 -11.686  -6.186
  813   1HG   PRO 103          2HG       PRO 103  10.768 -12.519  -6.815
  814   2HG   PRO 103          1HG       PRO 103   9.728 -11.356  -7.660
  815   1HD   PRO 103          2HD       PRO 103  11.663 -10.551  -5.981
  816   2HD   PRO 103          1HD       PRO 103  10.118  -9.685  -6.102
  817    H    PHE 104           H        PHE 104   9.111 -12.804  -2.050
  818    HA   PHE 104           HA       PHE 104  10.363 -15.418  -2.594
  819   1HB   PHE 104          2HB       PHE 104  10.934 -13.368  -0.556
  820   2HB   PHE 104          1HB       PHE 104  10.829 -15.011   0.067
  821    HD1  PHE 104           1HD      PHE 104  12.807 -12.640  -1.773
  822    HD2  PHE 104           2HD      PHE 104  12.325 -16.774  -0.886
  823    HE1  PHE 104           1HE      PHE 104  15.109 -13.066  -2.528
  824    HE2  PHE 104           2HE      PHE 104  14.626 -17.208  -1.637
  825    HZ   PHE 104           HZ       PHE 104  16.022 -15.353  -2.461
  826    H    SER 105           H        SER 105   8.664 -13.967   0.174
  827    HA   SER 105           HA       SER 105   6.397 -15.707  -0.119
  828   1HB   SER 105          2HB       SER 105   6.744 -16.747   2.178
  829   2HB   SER 105          1HB       SER 105   7.795 -17.348   0.897
  830    HG   SER 105           HG       SER 105   8.470 -16.184   3.207
  831    H    VAL 106           H        VAL 106   6.637 -12.958  -0.079
  832    HA   VAL 106           HA       VAL 106   5.925 -11.035   0.902
  833    HB   VAL 106           HB       VAL 106   3.785 -12.106   0.551
  834   1HG1  VAL 106          1HG1      VAL 106   4.246 -13.357   3.247
  835   2HG1  VAL 106          2HG1      VAL 106   4.003 -14.170   1.702
  836   3HG1  VAL 106          3HG1      VAL 106   2.673 -13.294   2.454
  837   1HG2  VAL 106          1HG2      VAL 106   3.245 -11.056   3.227
  838   2HG2  VAL 106          2HG2      VAL 106   2.668 -10.509   1.653
  839   3HG2  VAL 106          3HG2      VAL 106   4.259 -10.013   2.230
  840    H    GLU 107           H        GLU 107   7.824 -12.871   2.574
  841    HA   GLU 107           HA       GLU 107   7.211 -12.035   5.263
  842   1HB   GLU 107          2HB       GLU 107   8.556 -14.155   4.289
  843   2HB   GLU 107          1HB       GLU 107   9.900 -13.070   4.612
  844   1HG   GLU 107          2HG       GLU 107   7.923 -13.316   6.769
  845   2HG   GLU 107          1HG       GLU 107   8.853 -14.771   6.415
  846    H    ARG 108           H        ARG 108   9.557 -11.279   2.724
  847    HA   ARG 108           HA       ARG 108  11.027  -9.347   4.157
  848   1HB   ARG 108          2HB       ARG 108  10.529  -9.587   1.180
  849   2HB   ARG 108          1HB       ARG 108  11.733  -8.536   1.914
  850   1HG   ARG 108          2HG       ARG 108  11.759 -11.477   2.446
  851   2HG   ARG 108          1HG       ARG 108  12.462 -10.819   0.969
  852   1HD   ARG 108          2HD       ARG 108  13.203  -9.979   3.770
  853   2HD   ARG 108          1HD       ARG 108  14.117 -11.112   2.778
  854    HE   ARG 108           HE       ARG 108  14.812  -9.347   1.418
  855   1HH1  ARG 108          1HH1      ARG 108  12.665  -8.224   3.939
  856   2HH1  ARG 108          2HH1      ARG 108  13.112  -6.563   3.745
  857   1HH2  ARG 108          1HH2      ARG 108  15.391  -7.165   1.166
  858   2HH2  ARG 108          2HH2      ARG 108  14.655  -5.961   2.171
  859    H    PHE 109           H        PHE 109   8.054  -9.252   2.314
  860    HA   PHE 109           HA       PHE 109   7.745  -6.450   2.175
  861   1HB   PHE 109          2HB       PHE 109   6.365  -7.768   0.748
  862   2HB   PHE 109          1HB       PHE 109   5.791  -8.753   2.085
  863    HD1  PHE 109           1HD      PHE 109   5.975  -5.108   2.393
  864    HD2  PHE 109           2HD      PHE 109   3.480  -8.430   1.468
  865    HE1  PHE 109           1HE      PHE 109   3.989  -3.672   2.603
  866    HE2  PHE 109           2HE      PHE 109   1.492  -7.000   1.676
  867    HZ   PHE 109           HZ       PHE 109   1.742  -4.620   2.246
  868    H    LEU 110           H        LEU 110   6.628  -8.890   4.502
  869    HA   LEU 110           HA       LEU 110   5.162  -7.331   6.229
  870   1HB   LEU 110          2HB       LEU 110   6.271  -9.877   6.262
  871   2HB   LEU 110          1HB       LEU 110   6.886  -9.095   7.706
  872    HG   LEU 110           HG       LEU 110   4.004  -9.530   6.953
  873   1HD1  LEU 110          1HD1      LEU 110   5.780 -10.545   9.153
  874   2HD1  LEU 110          2HD1      LEU 110   4.970 -11.476   7.893
  875   3HD1  LEU 110          3HD1      LEU 110   4.023 -10.704   9.165
  876   1HD2  LEU 110          1HD2      LEU 110   4.056  -7.361   7.906
  877   2HD2  LEU 110          2HD2      LEU 110   5.207  -7.856   9.146
  878   3HD2  LEU 110          3HD2      LEU 110   3.551  -8.458   9.191
  879    H    LEU 111           H        LEU 111   8.648  -7.607   5.936
  880    HA   LEU 111           HA       LEU 111   9.300  -6.086   8.239
  881   1HB   LEU 111          2HB       LEU 111  10.783  -6.943   5.796
  882   2HB   LEU 111          1HB       LEU 111  11.497  -5.758   6.873
  883    HG   LEU 111           HG       LEU 111  11.000  -7.537   8.721
  884   1HD1  LEU 111          1HD1      LEU 111  10.623  -9.036   6.187
  885   2HD1  LEU 111          2HD1      LEU 111   9.839  -9.242   7.753
  886   3HD1  LEU 111          3HD1      LEU 111  11.482  -9.833   7.505
  887   1HD2  LEU 111          1HD2      LEU 111  13.224  -6.733   7.512
  888   2HD2  LEU 111          2HD2      LEU 111  13.202  -8.398   6.932
  889   3HD2  LEU 111          3HD2      LEU 111  13.210  -8.068   8.664
  890    H    THR 112           H        THR 112   8.999  -5.284   4.795
  891    HA   THR 112           HA       THR 112   9.798  -2.668   4.757
  892    HB   THR 112           HB       THR 112   7.393  -3.838   3.339
  893    HG1  THR 112           1HG      THR 112  10.070  -3.560   2.449
  894   1HG2  THR 112          1HG2      THR 112   8.768  -1.911   1.780
  895   2HG2  THR 112          2HG2      THR 112   8.341  -1.180   3.326
  896   3HG2  THR 112          3HG2      THR 112   7.089  -1.907   2.320
  897    H    ILE 113           H        ILE 113   6.706  -3.965   5.851
  898    HA   ILE 113           HA       ILE 113   5.400  -1.511   6.324
  899    HB   ILE 113           HB       ILE 113   5.057  -4.273   7.488
  900   1HG1  ILE 113          2HG1      ILE 113   4.333  -4.043   5.200
  901   2HG1  ILE 113          1HG1      ILE 113   2.906  -4.146   6.227
  902   1HG2  ILE 113          1HG2      ILE 113   3.472  -1.800   8.146
  903   2HG2  ILE 113          2HG2      ILE 113   4.397  -2.809   9.256
  904   3HG2  ILE 113          3HG2      ILE 113   2.938  -3.443   8.496
  905   1HD1  ILE 113          1HD1      ILE 113   2.908  -1.587   6.146
  906   2HD1  ILE 113          2HD1      ILE 113   2.399  -2.468   4.706
  907   3HD1  ILE 113          3HD1      ILE 113   4.017  -1.772   4.788
  908    H    LYS 114           H        LYS 114   6.773  -3.745   8.735
  909    HA   LYS 114           HA       LYS 114   6.807  -1.962  10.876
  910   1HB   LYS 114          2HB       LYS 114   7.089  -4.319  11.258
  911   2HB   LYS 114          1HB       LYS 114   8.553  -4.355  10.285
  912   1HG   LYS 114          2HG       LYS 114   8.553  -2.539  12.616
  913   2HG   LYS 114          1HG       LYS 114   8.571  -4.271  12.950
  914   1HD   LYS 114          2HD       LYS 114  10.714  -4.445  12.356
  915   2HD   LYS 114          1HD       LYS 114  10.428  -3.588  10.840
  916   1HE   LYS 114          2HE       LYS 114  11.602  -1.894  11.671
  917   2HE   LYS 114          1HE       LYS 114  10.288  -1.626  12.815
  918   1HZ   LYS 114          1HZ       LYS 114  12.043  -1.884  14.227
  919   2HZ   LYS 114          2HZ       LYS 114  12.861  -2.970  13.222
  920   3HZ   LYS 114          3HZ       LYS 114  11.533  -3.494  14.127
  921    H    HIS 115           H        HIS 115   8.709  -1.967   8.071
  922    HA   HIS 115           HA       HIS 115  10.939  -0.539   9.271
  923   1HB   HIS 115          2HB       HIS 115  10.980  -2.266   7.270
  924   2HB   HIS 115          1HB       HIS 115  10.635  -0.823   6.323
  925    HD1  HIS 115           1HD      HIS 115  12.916  -0.732   5.186
  926    HD2  HIS 115           2HD      HIS 115  13.137  -0.710   9.335
  927    HE1  HIS 115           1HE      HIS 115  15.305  -0.165   5.728
  928    HE2  HIS 115           2HE      HIS 115  15.430  -0.220   8.244
  929    H    ALA 116           H        ALA 116   8.067  -0.004   7.393
  930    HA   ALA 116           HA       ALA 116   8.665   2.735   6.726
  931   1HB   ALA 116          1HB       ALA 116   6.020   2.540   6.289
  932   2HB   ALA 116          2HB       ALA 116   6.459   0.832   6.240
  933   3HB   ALA 116          3HB       ALA 116   7.235   1.974   5.143
  934    H    PHE 117           H        PHE 117   6.898   0.989   9.192
  935    HA   PHE 117           HA       PHE 117   5.546   3.222  10.311
  936   1HB   PHE 117          2HB       PHE 117   6.103   0.411  11.168
  937   2HB   PHE 117          1HB       PHE 117   5.514   1.560  12.363
  938    HD1  PHE 117           1HD      PHE 117   3.488   3.073  11.266
  939    HD2  PHE 117           2HD      PHE 117   4.485  -0.953  10.310
  940    HE1  PHE 117           1HE      PHE 117   1.178   2.682  10.518
  941    HE2  PHE 117           2HE      PHE 117   2.174  -1.348   9.557
  942    HZ   PHE 117           HZ       PHE 117   0.519   0.474   9.659
  943    H    GLU 118           H        GLU 118   8.719   1.830  10.751
  944    HA   GLU 118           HA       GLU 118   9.221   3.553  13.058
  945   1HB   GLU 118          2HB       GLU 118  10.096   0.964  12.297
  946   2HB   GLU 118          1HB       GLU 118  11.504   2.009  12.415
  947   1HG   GLU 118          2HG       GLU 118   9.472   1.977  14.599
  948   2HG   GLU 118          1HG       GLU 118  10.689   0.706  14.495
  949    H    GLU 119           H        GLU 119  10.302   3.007   9.752
  950    HA   GLU 119           HA       GLU 119  12.307   5.106   9.995
  951   1HB   GLU 119          2HB       GLU 119  11.582   3.521   7.532
  952   2HB   GLU 119          1HB       GLU 119  13.038   4.467   7.800
  953   1HG   GLU 119          2HG       GLU 119  12.709   2.468   9.850
  954   2HG   GLU 119          1HG       GLU 119  12.693   1.747   8.242
  955    H    TYR 120           H        TYR 120   9.260   5.514   9.987
  956    HA   TYR 120           HA       TYR 120   9.338   7.876   8.330
  957   1HB   TYR 120          2HB       TYR 120   8.367   5.607   7.143
  958   2HB   TYR 120          1HB       TYR 120   6.900   6.330   7.793
  959    HD1  TYR 120           1HD      TYR 120   6.718   8.959   7.327
  960    HD2  TYR 120           2HD      TYR 120   8.998   6.213   5.011
  961    HE1  TYR 120           1HE      TYR 120   6.635  10.507   5.418
  962    HE2  TYR 120           2HE      TYR 120   8.922   7.755   3.098
  963    HH   TYR 120           HH       TYR 120   6.818  10.331   2.894
  964    H    SER 121           H        SER 121   9.192   7.475  11.120
  965    HA   SER 121           HA       SER 121   6.730   8.917  11.669
  966   1HB   SER 121          2HB       SER 121   6.613   6.250  12.052
  967   2HB   SER 121          1HB       SER 121   7.276   6.741  13.610
  968    HG   SER 121           HG       SER 121   5.477   8.326  13.600
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -2.908  -2.038  17.278
    2   2H    MET   1          2HT       MET   1  -4.173  -0.975  16.814
    3   3H    MET   1          3HT       MET   1  -3.438  -0.817  18.357
    4    HA   MET   1           HA       MET   1  -2.774   0.816  16.622
    5   1HB   MET   1          2HB       MET   1  -0.426   0.718  17.383
    6   2HB   MET   1          1HB       MET   1  -1.560   0.470  18.704
    7   1HG   MET   1          2HG       MET   1  -1.053  -1.784  18.887
    8   2HG   MET   1          1HG       MET   1  -0.367  -1.862  17.266
    9   1HE   MET   1          1HE       MET   1   1.576  -2.363  16.935
   10   2HE   MET   1          2HE       MET   1   2.511  -2.904  18.329
   11   3HE   MET   1          3HE       MET   1   3.031  -1.488  17.414
   12    H    LYS   2           H        LYS   2  -0.894   1.114  15.088
   13    HA   LYS   2           HA       LYS   2   0.086   0.688  13.084
   14   1HB   LYS   2          2HB       LYS   2   0.258  -1.869  14.525
   15   2HB   LYS   2          1HB       LYS   2   0.445  -1.974  12.780
   16   1HG   LYS   2          2HG       LYS   2   2.588  -1.749  13.958
   17   2HG   LYS   2          1HG       LYS   2   2.284  -0.421  12.836
   18   1HD   LYS   2          2HD       LYS   2   1.758   1.072  14.590
   19   2HD   LYS   2          1HD       LYS   2   1.623  -0.238  15.765
   20   1HE   LYS   2          2HE       LYS   2   3.720   0.297  16.332
   21   2HE   LYS   2          1HE       LYS   2   4.182  -0.546  14.853
   22   1HZ   LYS   2          1HZ       LYS   2   5.178   1.415  14.430
   23   2HZ   LYS   2          2HZ       LYS   2   4.145   2.303  15.432
   24   3HZ   LYS   2          3HZ       LYS   2   3.641   1.858  13.878
   25    H    ARG   3           H        ARG   3  -1.222   1.148  11.439
   26    HA   ARG   3           HA       ARG   3  -3.007  -0.966  10.461
   27   1HB   ARG   3          2HB       ARG   3  -3.842   1.929  10.460
   28   2HB   ARG   3          1HB       ARG   3  -4.831   0.512  10.134
   29   1HG   ARG   3          2HG       ARG   3  -5.521   0.980  12.246
   30   2HG   ARG   3          1HG       ARG   3  -4.167  -0.089  12.616
   31   1HD   ARG   3          2HD       ARG   3  -2.738   1.759  13.086
   32   2HD   ARG   3          1HD       ARG   3  -3.921   2.908  12.463
   33    HE   ARG   3           HE       ARG   3  -5.113   1.509  14.559
   34   1HH1  ARG   3          1HH1      ARG   3  -2.497   3.768  14.067
   35   2HH1  ARG   3          2HH1      ARG   3  -2.625   4.453  15.653
   36   1HH2  ARG   3          1HH2      ARG   3  -5.281   2.410  16.644
   37   2HH2  ARG   3          2HH2      ARG   3  -4.205   3.682  17.115
   38    H    VAL   4           H        VAL   4  -2.495  -1.431   8.425
   39    HA   VAL   4           HA       VAL   4  -1.313   0.699   6.760
   40    HB   VAL   4           HB       VAL   4  -0.877  -2.270   6.443
   41   1HG1  VAL   4          1HG1      VAL   4   1.169  -1.239   5.165
   42   2HG1  VAL   4          2HG1      VAL   4   0.110   0.164   5.035
   43   3HG1  VAL   4          3HG1      VAL   4  -0.400  -1.389   4.376
   44   1HG2  VAL   4          1HG2      VAL   4   1.036  -0.257   7.616
   45   2HG2  VAL   4          2HG2      VAL   4   1.266  -2.001   7.480
   46   3HG2  VAL   4          3HG2      VAL   4   0.047  -1.354   8.578
   47    H    LEU   5           H        LEU   5  -1.746   0.562   4.449
   48    HA   LEU   5           HA       LEU   5  -4.425  -0.531   3.924
   49   1HB   LEU   5          2HB       LEU   5  -4.214   1.926   3.779
   50   2HB   LEU   5          1HB       LEU   5  -2.998   1.734   2.532
   51    HG   LEU   5           HG       LEU   5  -4.693   0.640   1.089
   52   1HD1  LEU   5          1HD1      LEU   5  -6.781   0.158   1.750
   53   2HD1  LEU   5          2HD1      LEU   5  -6.932   1.633   2.705
   54   3HD1  LEU   5          3HD1      LEU   5  -6.093   0.233   3.371
   55   1HD2  LEU   5          1HD2      LEU   5  -5.369   3.396   2.108
   56   2HD2  LEU   5          2HD2      LEU   5  -5.977   2.696   0.607
   57   3HD2  LEU   5          3HD2      LEU   5  -4.251   2.994   0.805
   58    H    VAL   6           H        VAL   6  -4.676  -2.049   2.415
   59    HA   VAL   6           HA       VAL   6  -2.373  -2.627   0.661
   60    HB   VAL   6           HB       VAL   6  -4.468  -4.599   1.565
   61   1HG1  VAL   6          1HG1      VAL   6  -3.511  -5.277  -0.501
   62   2HG1  VAL   6          2HG1      VAL   6  -2.742  -6.239   0.761
   63   3HG1  VAL   6          3HG1      VAL   6  -1.884  -4.873   0.047
   64   1HG2  VAL   6          1HG2      VAL   6  -3.274  -5.109   3.394
   65   2HG2  VAL   6          2HG2      VAL   6  -2.571  -3.506   3.189
   66   3HG2  VAL   6          3HG2      VAL   6  -1.732  -4.922   2.558
   67    H    VAL   7           H        VAL   7  -3.068  -1.321  -1.054
   68    HA   VAL   7           HA       VAL   7  -5.696  -1.742  -2.190
   69    HB   VAL   7           HB       VAL   7  -3.427  -0.125  -3.356
   70   1HG1  VAL   7          1HG1      VAL   7  -6.392  -0.216  -3.860
   71   2HG1  VAL   7          2HG1      VAL   7  -5.080  -0.508  -5.003
   72   3HG1  VAL   7          3HG1      VAL   7  -5.370   1.120  -4.389
   73   1HG2  VAL   7          1HG2      VAL   7  -5.469   0.566  -1.275
   74   2HG2  VAL   7          2HG2      VAL   7  -4.792   1.806  -2.331
   75   3HG2  VAL   7          3HG2      VAL   7  -3.733   0.871  -1.275
   76    H    ASP   8           H        ASP   8  -6.117  -3.409  -3.439
   77    HA   ASP   8           HA       ASP   8  -4.281  -4.131  -5.570
   78   1HB   ASP   8          2HB       ASP   8  -3.498  -5.587  -3.815
   79   2HB   ASP   8          1HB       ASP   8  -5.141  -6.078  -3.418
   80    H    ASP   9           H        ASP   9  -5.299  -5.041  -7.332
   81    HA   ASP   9           HA       ASP   9  -8.187  -4.784  -7.362
   82   1HB   ASP   9          2HB       ASP   9  -6.871  -3.809  -9.192
   83   2HB   ASP   9          1HB       ASP   9  -6.243  -5.401  -9.602
   84    H    GLU  10           H        GLU  10  -7.626  -6.832  -5.746
   85    HA   GLU  10           HA       GLU  10  -8.375  -9.185  -7.346
   86   1HB   GLU  10          2HB       GLU  10  -5.983  -8.977  -6.090
   87   2HB   GLU  10          1HB       GLU  10  -6.949  -9.697  -4.811
   88   1HG   GLU  10          2HG       GLU  10  -7.344 -10.990  -7.384
   89   2HG   GLU  10          1HG       GLU  10  -5.669 -11.041  -6.836
   90    H    GLU  11           H        GLU  11  -9.558  -7.026  -5.266
   91    HA   GLU  11           HA       GLU  11 -11.335  -6.968  -3.849
   92   1HB   GLU  11          2HB       GLU  11 -11.743  -9.438  -5.413
   93   2HB   GLU  11          1HB       GLU  11 -12.624  -9.361  -3.893
   94   1HG   GLU  11          2HG       GLU  11 -14.139  -8.030  -4.791
   95   2HG   GLU  11          1HG       GLU  11 -12.896  -6.869  -5.254
   96    H    SER  12           H        SER  12 -11.912  -7.499  -1.723
   97    HA   SER  12           HA       SER  12 -11.468  -8.133   0.419
   98   1HB   SER  12          2HB       SER  12 -10.630 -10.801  -0.709
   99   2HB   SER  12          1HB       SER  12 -11.402 -10.463   0.839
  100    HG   SER  12           HG       SER  12 -12.526 -10.429  -1.748
  101    H    ILE  13           H        ILE  13  -9.690  -9.371   1.830
  102    HA   ILE  13           HA       ILE  13  -7.351  -7.905   1.689
  103    HB   ILE  13           HB       ILE  13  -7.387 -10.687   2.827
  104   1HG1  ILE  13          2HG1      ILE  13  -9.434  -9.697   3.641
  105   2HG1  ILE  13          1HG1      ILE  13  -8.251  -9.669   4.943
  106   1HG2  ILE  13          1HG2      ILE  13  -5.263  -9.793   3.043
  107   2HG2  ILE  13          2HG2      ILE  13  -6.010  -9.427   4.598
  108   3HG2  ILE  13          3HG2      ILE  13  -5.871  -8.170   3.369
  109   1HD1  ILE  13          1HD1      ILE  13  -8.194  -7.429   5.016
  110   2HD1  ILE  13          2HD1      ILE  13  -9.774  -7.572   4.247
  111   3HD1  ILE  13          3HD1      ILE  13  -8.342  -7.258   3.268
  112    H    THR  14           H        THR  14  -5.122  -8.729   1.360
  113    HA   THR  14           HA       THR  14  -4.962 -10.079  -1.198
  114    HB   THR  14           HB       THR  14  -2.534  -9.495  -1.056
  115    HG1  THR  14           1HG      THR  14  -3.262  -8.087   1.289
  116   1HG2  THR  14          1HG2      THR  14  -2.747  -7.126  -1.332
  117   2HG2  THR  14          2HG2      THR  14  -4.297  -7.123  -0.492
  118   3HG2  THR  14          3HG2      THR  14  -4.148  -7.909  -2.063
  119    H    SER  15           H        SER  15  -3.439 -11.868  -1.551
  120    HA   SER  15           HA       SER  15  -3.833 -13.915   0.379
  121   1HB   SER  15          2HB       SER  15  -3.355 -13.881  -2.312
  122   2HB   SER  15          1HB       SER  15  -1.800 -14.422  -1.684
  123    HG   SER  15           HG       SER  15  -3.133 -15.965  -0.414
  124    H    SER  16           H        SER  16  -2.515 -14.785   1.857
  125    HA   SER  16           HA       SER  16  -0.692 -15.188   3.160
  126   1HB   SER  16          2HB       SER  16   1.053 -13.553   1.341
  127   2HB   SER  16          1HB       SER  16   1.475 -14.964   2.312
  128    HG   SER  16           HG       SER  16   1.184 -15.984   0.494
  129    H    LEU  17           H        LEU  17  -2.063 -12.247   2.677
  130    HA   LEU  17           HA       LEU  17  -0.228 -10.738   4.356
  131   1HB   LEU  17          2HB       LEU  17  -1.934 -10.028   2.324
  132   2HB   LEU  17          1HB       LEU  17  -2.837  -9.542   3.742
  133    HG   LEU  17           HG       LEU  17  -0.520  -8.297   2.483
  134   1HD1  LEU  17          1HD1      LEU  17  -2.334  -6.925   2.619
  135   2HD1  LEU  17          2HD1      LEU  17  -1.456  -6.433   4.068
  136   3HD1  LEU  17          3HD1      LEU  17  -2.823  -7.539   4.198
  137   1HD2  LEU  17          1HD2      LEU  17   0.184  -7.427   4.863
  138   2HD2  LEU  17          2HD2      LEU  17   0.908  -8.882   4.178
  139   3HD2  LEU  17          3HD2      LEU  17  -0.382  -9.016   5.372
  140    H    SER  18           H        SER  18  -3.656 -11.693   4.436
  141    HA   SER  18           HA       SER  18  -4.421 -10.783   6.883
  142   1HB   SER  18          2HB       SER  18  -5.721 -12.202   5.132
  143   2HB   SER  18          1HB       SER  18  -5.167 -13.582   6.079
  144    HG   SER  18           HG       SER  18  -7.280 -12.512   6.628
  145    H    ALA  19           H        ALA  19  -2.954 -13.985   6.319
  146    HA   ALA  19           HA       ALA  19  -2.772 -14.809   8.962
  147   1HB   ALA  19          1HB       ALA  19  -2.133 -15.927   6.605
  148   2HB   ALA  19          2HB       ALA  19  -1.604 -16.569   8.160
  149   3HB   ALA  19          3HB       ALA  19  -0.518 -15.553   7.211
  150    H    ILE  20           H        ILE  20  -0.554 -12.833   7.061
  151    HA   ILE  20           HA       ILE  20   1.529 -12.713   8.962
  152    HB   ILE  20           HB       ILE  20   0.781 -10.901   6.669
  153   1HG1  ILE  20          2HG1      ILE  20   3.056 -12.850   7.064
  154   2HG1  ILE  20          1HG1      ILE  20   1.601 -13.160   6.124
  155   1HG2  ILE  20          1HG2      ILE  20   2.881 -10.564   8.743
  156   2HG2  ILE  20          2HG2      ILE  20   1.949  -9.350   7.866
  157   3HG2  ILE  20          3HG2      ILE  20   3.293 -10.172   7.073
  158   1HD1  ILE  20          1HD1      ILE  20   3.677 -12.508   4.843
  159   2HD1  ILE  20          2HD1      ILE  20   3.456 -10.889   5.505
  160   3HD1  ILE  20          3HD1      ILE  20   2.209 -11.600   4.482
  161    H    LEU  21           H        LEU  21  -0.631 -10.018   8.045
  162    HA   LEU  21           HA       LEU  21  -0.101  -8.314  10.109
  163   1HB   LEU  21          2HB       LEU  21  -2.848  -8.810   8.976
  164   2HB   LEU  21          1HB       LEU  21  -2.277  -7.338   9.744
  165    HG   LEU  21           HG       LEU  21  -0.613  -8.118   7.490
  166   1HD1  LEU  21          1HD1      LEU  21  -2.184  -8.724   6.049
  167   2HD1  LEU  21          2HD1      LEU  21  -2.775  -7.065   6.122
  168   3HD1  LEU  21          3HD1      LEU  21  -3.479  -8.299   7.166
  169   1HD2  LEU  21          1HD2      LEU  21  -1.949  -5.701   8.577
  170   2HD2  LEU  21          2HD2      LEU  21  -1.445  -5.691   6.887
  171   3HD2  LEU  21          3HD2      LEU  21  -0.257  -5.971   8.160
  172    H    GLU  22           H        GLU  22  -2.024 -11.229  10.216
  173    HA   GLU  22           HA       GLU  22  -3.282 -10.726  12.711
  174   1HB   GLU  22          2HB       GLU  22  -3.770 -12.490  10.802
  175   2HB   GLU  22          1HB       GLU  22  -2.754 -13.506  11.814
  176   1HG   GLU  22          2HG       GLU  22  -4.345 -12.680  13.712
  177   2HG   GLU  22          1HG       GLU  22  -5.435 -12.347  12.368
  178    H    GLU  23           H        GLU  23  -0.200 -12.065  11.755
  179    HA   GLU  23           HA       GLU  23   0.386 -13.125  14.374
  180   1HB   GLU  23          2HB       GLU  23   1.388 -14.323  12.609
  181   2HB   GLU  23          1HB       GLU  23   1.921 -12.857  11.800
  182   1HG   GLU  23          2HG       GLU  23   3.845 -12.819  12.906
  183   2HG   GLU  23          1HG       GLU  23   3.064 -13.147  14.451
  184    H    GLU  24           H        GLU  24   1.077 -10.248  12.504
  185    HA   GLU  24           HA       GLU  24   2.938  -9.205  14.446
  186   1HB   GLU  24          2HB       GLU  24   1.734  -8.072  11.932
  187   2HB   GLU  24          1HB       GLU  24   2.796  -7.139  12.979
  188   1HG   GLU  24          2HG       GLU  24   3.595  -9.777  11.788
  189   2HG   GLU  24          1HG       GLU  24   3.862  -8.235  10.975
  190    H    GLY  25           H        GLY  25  -0.420  -8.709  13.524
  191   1HA   GLY  25          2HA       GLY  25  -2.106  -7.992  15.007
  192   2HA   GLY  25          1HA       GLY  25  -0.863  -7.324  16.052
  193    H    TYR  26           H        TYR  26  -1.761  -6.865  12.638
  194    HA   TYR  26           HA       TYR  26  -1.667  -3.961  13.102
  195   1HB   TYR  26          2HB       TYR  26  -1.111  -5.667  10.699
  196   2HB   TYR  26          1HB       TYR  26  -1.551  -3.978  10.496
  197    HD1  TYR  26           1HD      TYR  26   0.363  -2.872   9.822
  198    HD2  TYR  26           2HD      TYR  26   0.610  -5.627  13.053
  199    HE1  TYR  26           1HE      TYR  26   2.698  -2.207  10.201
  200    HE2  TYR  26           2HE      TYR  26   2.948  -4.968  13.440
  201    HH   TYR  26           HH       TYR  26   4.849  -3.925  11.886
  202    H    HIS  27           H        HIS  27  -3.016  -2.960  11.049
  203    HA   HIS  27           HA       HIS  27  -5.690  -4.173  11.085
  204   1HB   HIS  27          2HB       HIS  27  -5.021  -1.895  12.534
  205   2HB   HIS  27          1HB       HIS  27  -5.769  -1.256  11.075
  206    HD1  HIS  27           1HD      HIS  27  -6.579  -2.589  14.334
  207    HD2  HIS  27           2HD      HIS  27  -8.449  -2.431  10.626
  208    HE1  HIS  27           1HE      HIS  27  -9.013  -3.031  14.788
  209    HE2  HIS  27           2HE      HIS  27 -10.109  -3.018  12.520
  210    HA   PRO  28           HA       PRO  28  -4.557  -3.107   6.786
  211   1HB   PRO  28          2HB       PRO  28  -5.423  -5.355   5.634
  212   2HB   PRO  28          1HB       PRO  28  -3.891  -5.301   6.515
  213   1HG   PRO  28          2HG       PRO  28  -6.552  -6.343   7.404
  214   2HG   PRO  28          1HG       PRO  28  -4.940  -7.038   7.650
  215   1HD   PRO  28          2HD       PRO  28  -6.301  -5.562   9.535
  216   2HD   PRO  28          1HD       PRO  28  -4.537  -5.740   9.491
  217    H    ASP  29           H        ASP  29  -5.807  -1.917   5.552
  218    HA   ASP  29           HA       ASP  29  -8.710  -2.257   5.767
  219   1HB   ASP  29          2HB       ASP  29  -7.395  -0.006   6.255
  220   2HB   ASP  29          1HB       ASP  29  -7.637   0.199   4.523
  221    H    THR  30           H        THR  30  -6.456  -3.262   3.844
  222    HA   THR  30           HA       THR  30  -6.229  -3.146   1.438
  223    HB   THR  30           HB       THR  30  -6.924  -5.321   0.855
  224    HG1  THR  30           1HG      THR  30  -9.048  -5.404   1.272
  225   1HG2  THR  30          1HG2      THR  30  -5.797  -6.468   2.387
  226   2HG2  THR  30          2HG2      THR  30  -6.889  -5.990   3.686
  227   3HG2  THR  30          3HG2      THR  30  -5.580  -4.916   3.195
  228    H    ALA  31           H        ALA  31  -6.953  -2.217  -0.314
  229    HA   ALA  31           HA       ALA  31  -9.838  -1.701  -0.577
  230   1HB   ALA  31          1HB       ALA  31  -9.380   0.313  -1.498
  231   2HB   ALA  31          2HB       ALA  31  -7.952  -0.278  -2.347
  232   3HB   ALA  31          3HB       ALA  31  -7.856   0.119  -0.632
  233    H    LYS  32           H        LYS  32  -9.846  -1.090  -3.316
  234    HA   LYS  32           HA       LYS  32  -9.239  -3.718  -4.508
  235   1HB   LYS  32          2HB       LYS  32 -11.421  -1.946  -5.552
  236   2HB   LYS  32          1HB       LYS  32 -11.237  -3.686  -5.711
  237   1HG   LYS  32          2HG       LYS  32 -11.952  -4.066  -3.498
  238   2HG   LYS  32          1HG       LYS  32 -11.797  -2.360  -3.076
  239   1HD   LYS  32          2HD       LYS  32 -13.702  -1.765  -4.291
  240   2HD   LYS  32          1HD       LYS  32 -13.682  -3.261  -5.229
  241   1HE   LYS  32          2HE       LYS  32 -14.182  -4.495  -3.111
  242   2HE   LYS  32          1HE       LYS  32 -14.392  -2.934  -2.318
  243   1HZ   LYS  32          1HZ       LYS  32 -16.031  -2.567  -4.312
  244   2HZ   LYS  32          2HZ       LYS  32 -16.526  -3.384  -2.917
  245   3HZ   LYS  32          3HZ       LYS  32 -16.093  -4.257  -4.300
  246    H    THR  33           H        THR  33  -9.345  -0.238  -5.002
  247    HA   THR  33           HA       THR  33  -7.226  -0.416  -6.941
  248    HB   THR  33           HB       THR  33  -9.577   1.083  -7.974
  249    HG1  THR  33           1HG      THR  33 -10.526  -0.879  -7.423
  250   1HG2  THR  33          1HG2      THR  33  -7.187  -0.247  -9.069
  251   2HG2  THR  33          2HG2      THR  33  -7.984   1.251  -9.553
  252   3HG2  THR  33          3HG2      THR  33  -8.648  -0.303 -10.054
  253    H    LEU  34           H        LEU  34  -6.960   1.971  -7.919
  254    HA   LEU  34           HA       LEU  34  -6.236   3.602  -5.761
  255   1HB   LEU  34          2HB       LEU  34  -6.734   4.467  -8.609
  256   2HB   LEU  34          1HB       LEU  34  -5.768   5.315  -7.418
  257    HG   LEU  34           HG       LEU  34  -5.109   2.581  -8.514
  258   1HD1  LEU  34          1HD1      LEU  34  -3.725   3.524 -10.063
  259   2HD1  LEU  34          2HD1      LEU  34  -3.507   5.007  -9.133
  260   3HD1  LEU  34          3HD1      LEU  34  -5.004   4.738 -10.025
  261   1HD2  LEU  34          1HD2      LEU  34  -4.318   3.309  -6.172
  262   2HD2  LEU  34          2HD2      LEU  34  -3.261   4.421  -7.041
  263   3HD2  LEU  34          3HD2      LEU  34  -3.122   2.684  -7.308
  264    H    ARG  35           H        ARG  35  -9.007   3.821  -7.978
  265    HA   ARG  35           HA       ARG  35 -10.137   6.155  -6.941
  266   1HB   ARG  35          2HB       ARG  35 -11.274   3.777  -8.382
  267   2HB   ARG  35          1HB       ARG  35 -12.337   5.045  -7.786
  268   1HG   ARG  35          2HG       ARG  35 -11.869   6.334  -9.522
  269   2HG   ARG  35          1HG       ARG  35 -10.136   6.204  -9.216
  270   1HD   ARG  35          2HD       ARG  35 -10.370   3.871 -10.320
  271   2HD   ARG  35          1HD       ARG  35 -11.885   4.507 -10.958
  272    HE   ARG  35           HE       ARG  35  -9.222   5.214 -11.777
  273   1HH1  ARG  35          1HH1      ARG  35 -12.550   6.256 -11.650
  274   2HH1  ARG  35          2HH1      ARG  35 -12.388   7.354 -12.979
  275   1HH2  ARG  35          1HH2      ARG  35  -9.006   6.656 -13.527
  276   2HH2  ARG  35          2HH2      ARG  35 -10.377   7.581 -14.045
  277    H    GLU  36           H        GLU  36 -10.639   2.765  -6.036
  278    HA   GLU  36           HA       GLU  36 -12.550   3.333  -4.002
  279   1HB   GLU  36          2HB       GLU  36 -10.801   0.880  -4.213
  280   2HB   GLU  36          1HB       GLU  36 -12.351   1.019  -3.392
  281   1HG   GLU  36          2HG       GLU  36 -12.030   1.393  -6.354
  282   2HG   GLU  36          1HG       GLU  36 -12.367  -0.168  -5.607
  283    H    ALA  37           H        ALA  37  -9.063   3.094  -4.115
  284    HA   ALA  37           HA       ALA  37  -8.705   3.015  -1.275
  285   1HB   ALA  37          1HB       ALA  37  -6.306   3.564  -1.884
  286   2HB   ALA  37          2HB       ALA  37  -6.824   3.510  -3.570
  287   3HB   ALA  37          3HB       ALA  37  -6.962   2.072  -2.557
  288    H    GLU  38           H        GLU  38  -9.023   5.532  -3.673
  289    HA   GLU  38           HA       GLU  38  -7.978   7.623  -2.030
  290   1HB   GLU  38          2HB       GLU  38  -9.727   7.658  -4.489
  291   2HB   GLU  38          1HB       GLU  38  -9.169   9.118  -3.684
  292   1HG   GLU  38          2HG       GLU  38  -6.953   8.748  -4.273
  293   2HG   GLU  38          1HG       GLU  38  -7.229   7.039  -4.607
  294    H    LYS  39           H        LYS  39 -11.162   6.297  -2.700
  295    HA   LYS  39           HA       LYS  39 -12.597   8.209  -1.143
  296   1HB   LYS  39          2HB       LYS  39 -13.830   7.049  -2.811
  297   2HB   LYS  39          1HB       LYS  39 -13.271   5.483  -2.242
  298   1HG   LYS  39          2HG       LYS  39 -14.904   7.193  -0.427
  299   2HG   LYS  39          1HG       LYS  39 -15.694   6.298  -1.726
  300   1HD   LYS  39          2HD       LYS  39 -13.877   4.535  -0.445
  301   2HD   LYS  39          1HD       LYS  39 -14.808   5.352   0.813
  302   1HE   LYS  39          2HE       LYS  39 -16.257   4.283  -1.556
  303   2HE   LYS  39          1HE       LYS  39 -15.680   3.142  -0.343
  304   1HZ   LYS  39          1HZ       LYS  39 -18.029   4.367  -0.198
  305   2HZ   LYS  39          2HZ       LYS  39 -17.088   5.474   0.668
  306   3HZ   LYS  39          3HZ       LYS  39 -17.169   3.859   1.166
  307    H    LYS  40           H        LYS  40 -11.012   5.160  -0.527
  308    HA   LYS  40           HA       LYS  40 -12.112   4.835   2.104
  309   1HB   LYS  40          2HB       LYS  40 -11.156   2.778   2.072
  310   2HB   LYS  40          1HB       LYS  40 -11.044   3.093   0.350
  311   1HG   LYS  40          2HG       LYS  40  -8.725   3.961   0.775
  312   2HG   LYS  40          1HG       LYS  40  -8.878   3.326   2.412
  313   1HD   LYS  40          2HD       LYS  40  -9.304   1.650  -0.051
  314   2HD   LYS  40          1HD       LYS  40  -7.739   1.806   0.747
  315   1HE   LYS  40          2HE       LYS  40  -8.707  -0.168   1.600
  316   2HE   LYS  40          1HE       LYS  40  -8.898   1.044   2.865
  317   1HZ   LYS  40          1HZ       LYS  40 -11.118   0.964   1.053
  318   2HZ   LYS  40          2HZ       LYS  40 -11.103   0.903   2.743
  319   3HZ   LYS  40          3HZ       LYS  40 -10.875  -0.511   1.843
  320    H    ILE  41           H        ILE  41  -9.118   6.106   0.722
  321    HA   ILE  41           HA       ILE  41  -7.860   6.482   3.278
  322    HB   ILE  41           HB       ILE  41  -7.156   7.601   0.560
  323   1HG1  ILE  41          2HG1      ILE  41  -5.557   5.530   2.001
  324   2HG1  ILE  41          1HG1      ILE  41  -7.043   5.032   1.198
  325   1HG2  ILE  41          1HG2      ILE  41  -5.993   8.030   3.238
  326   2HG2  ILE  41          2HG2      ILE  41  -5.974   9.065   1.812
  327   3HG2  ILE  41          3HG2      ILE  41  -4.851   7.712   1.932
  328   1HD1  ILE  41          1HD1      ILE  41  -6.024   6.306  -0.836
  329   2HD1  ILE  41          2HD1      ILE  41  -5.488   4.674  -0.442
  330   3HD1  ILE  41          3HD1      ILE  41  -4.508   6.062   0.030
  331    H    LYS  42           H        LYS  42  -9.959   8.322   1.218
  332    HA   LYS  42           HA       LYS  42  -9.424  10.882   2.327
  333   1HB   LYS  42          2HB       LYS  42 -11.567   9.730   0.608
  334   2HB   LYS  42          1HB       LYS  42 -11.809  11.312   1.337
  335   1HG   LYS  42          2HG       LYS  42  -9.214  11.219   0.157
  336   2HG   LYS  42          1HG       LYS  42 -10.408  10.671  -1.020
  337   1HD   LYS  42          2HD       LYS  42 -11.110  13.076   0.549
  338   2HD   LYS  42          1HD       LYS  42  -9.807  13.257  -0.628
  339   1HE   LYS  42          2HE       LYS  42 -11.638  11.891  -2.089
  340   2HE   LYS  42          1HE       LYS  42 -12.690  12.839  -1.039
  341   1HZ   LYS  42          1HZ       LYS  42 -11.905  13.829  -3.270
  342   2HZ   LYS  42          2HZ       LYS  42 -10.461  14.145  -2.448
  343   3HZ   LYS  42          3HZ       LYS  42 -11.911  14.814  -1.894
  344    H    GLU  43           H        GLU  43 -10.856   8.216   3.730
  345    HA   GLU  43           HA       GLU  43 -12.606   9.855   5.418
  346   1HB   GLU  43          2HB       GLU  43 -12.548   6.847   5.160
  347   2HB   GLU  43          1HB       GLU  43 -13.734   7.802   6.038
  348   1HG   GLU  43          2HG       GLU  43 -14.667   8.658   4.057
  349   2HG   GLU  43          1HG       GLU  43 -13.305   8.101   3.085
  350    H    LEU  44           H        LEU  44  -9.787   7.827   5.419
  351    HA   LEU  44           HA       LEU  44  -9.402   8.445   8.262
  352   1HB   LEU  44          2HB       LEU  44  -9.961   6.258   8.576
  353   2HB   LEU  44          1HB       LEU  44  -9.489   5.788   6.958
  354    HG   LEU  44           HG       LEU  44  -7.380   6.476   8.968
  355   1HD1  LEU  44          1HD1      LEU  44  -7.447   3.817   9.196
  356   2HD1  LEU  44          2HD1      LEU  44  -9.171   4.133   8.995
  357   3HD1  LEU  44          3HD1      LEU  44  -8.281   4.902  10.309
  358   1HD2  LEU  44          1HD2      LEU  44  -7.088   4.244   7.084
  359   2HD2  LEU  44          2HD2      LEU  44  -5.967   5.542   7.491
  360   3HD2  LEU  44          3HD2      LEU  44  -7.270   5.831   6.338
  361    H    PHE  45           H        PHE  45  -7.174   8.425   8.954
  362    HA   PHE  45           HA       PHE  45  -5.390   9.307   6.823
  363   1HB   PHE  45          2HB       PHE  45  -5.633  10.701   8.846
  364   2HB   PHE  45          1HB       PHE  45  -5.021   9.373   9.827
  365    HD1  PHE  45           1HD      PHE  45  -4.154  11.929   7.346
  366    HD2  PHE  45           2HD      PHE  45  -2.687   8.839   9.878
  367    HE1  PHE  45           1HE      PHE  45  -1.855  12.729   6.985
  368    HE2  PHE  45           2HE      PHE  45  -0.386   9.635   9.522
  369    HZ   PHE  45           HZ       PHE  45   0.033  11.583   8.074
  370    H    PHE  46           H        PHE  46  -4.629   7.495   5.815
  371    HA   PHE  46           HA       PHE  46  -3.686   5.217   7.292
  372   1HB   PHE  46          2HB       PHE  46  -3.772   5.971   4.389
  373   2HB   PHE  46          1HB       PHE  46  -2.827   4.585   4.920
  374    HD1  PHE  46           1HD      PHE  46  -6.020   5.731   3.923
  375    HD2  PHE  46           2HD      PHE  46  -4.062   2.816   6.326
  376    HE1  PHE  46           1HE      PHE  46  -8.043   4.331   3.866
  377    HE2  PHE  46           2HE      PHE  46  -6.080   1.409   6.271
  378    HZ   PHE  46           HZ       PHE  46  -8.075   2.169   5.042
  379    HA   PRO  47           HA       PRO  47   0.442   6.947   7.698
  380   1HB   PRO  47          2HB       PRO  47   1.458   5.060   9.304
  381   2HB   PRO  47          1HB       PRO  47   0.262   6.221   9.895
  382   1HG   PRO  47          2HG       PRO  47  -0.110   3.375   9.056
  383   2HG   PRO  47          1HG       PRO  47  -0.825   4.240  10.427
  384   1HD   PRO  47          2HD       PRO  47  -2.109   3.778   8.031
  385   2HD   PRO  47          1HD       PRO  47  -2.520   5.088   9.155
  386    H    VAL  48           H        VAL  48  -0.431   3.827   6.468
  387    HA   VAL  48           HA       VAL  48   1.919   3.803   4.769
  388    HB   VAL  48           HB       VAL  48   1.191   1.279   6.223
  389   1HG1  VAL  48          1HG1      VAL  48   2.779   1.701   4.070
  390   2HG1  VAL  48          2HG1      VAL  48   2.987   0.375   5.214
  391   3HG1  VAL  48          3HG1      VAL  48   3.950   1.843   5.381
  392   1HG2  VAL  48          1HG2      VAL  48   1.698   2.784   7.977
  393   2HG2  VAL  48          2HG2      VAL  48   3.079   3.443   7.097
  394   3HG2  VAL  48          3HG2      VAL  48   3.131   1.791   7.717
  395    H    ILE  49           H        ILE  49   1.451   3.089   2.790
  396    HA   ILE  49           HA       ILE  49  -1.094   1.692   2.342
  397    HB   ILE  49           HB       ILE  49   0.178   3.442   0.260
  398   1HG1  ILE  49          2HG1      ILE  49  -0.175   4.799   2.330
  399   2HG1  ILE  49          1HG1      ILE  49  -1.148   5.330   0.962
  400   1HG2  ILE  49          1HG2      ILE  49  -2.364   2.008   0.631
  401   2HG2  ILE  49          2HG2      ILE  49  -1.469   2.376  -0.844
  402   3HG2  ILE  49          3HG2      ILE  49  -2.487   3.609  -0.099
  403   1HD1  ILE  49          1HD1      ILE  49  -2.102   3.669   3.282
  404   2HD1  ILE  49          2HD1      ILE  49  -3.081   4.159   1.900
  405   3HD1  ILE  49          3HD1      ILE  49  -2.439   5.378   3.001
  406    H    VAL  50           H        VAL  50  -1.092   0.384   0.303
  407    HA   VAL  50           HA       VAL  50   1.495  -0.394  -0.718
  408    HB   VAL  50           HB       VAL  50  -0.201  -2.408   0.765
  409   1HG1  VAL  50          1HG1      VAL  50   2.120  -3.674   0.259
  410   2HG1  VAL  50          2HG1      VAL  50   2.005  -2.662  -1.179
  411   3HG1  VAL  50          3HG1      VAL  50   0.704  -3.784  -0.785
  412   1HG2  VAL  50          1HG2      VAL  50   1.884  -2.596   2.169
  413   2HG2  VAL  50          2HG2      VAL  50   0.972  -1.099   2.352
  414   3HG2  VAL  50          3HG2      VAL  50   2.446  -1.122   1.384
  415    H    LEU  51           H        LEU  51   0.914   0.023  -2.748
  416    HA   LEU  51           HA       LEU  51  -1.621  -0.796  -3.825
  417   1HB   LEU  51          2HB       LEU  51  -0.473   1.275  -4.541
  418   2HB   LEU  51          1HB       LEU  51   0.804   0.303  -5.241
  419    HG   LEU  51           HG       LEU  51  -0.802  -0.669  -6.832
  420   1HD1  LEU  51          1HD1      LEU  51  -3.048   0.161  -7.017
  421   2HD1  LEU  51          2HD1      LEU  51  -2.782   1.297  -5.694
  422   3HD1  LEU  51          3HD1      LEU  51  -2.797  -0.437  -5.377
  423   1HD2  LEU  51          1HD2      LEU  51  -0.255   2.236  -6.675
  424   2HD2  LEU  51          2HD2      LEU  51  -1.429   1.698  -7.876
  425   3HD2  LEU  51          3HD2      LEU  51   0.213   1.055  -7.900
  426    H    ASP  52           H        ASP  52  -1.759  -2.058  -5.827
  427    HA   ASP  52           HA       ASP  52   0.317  -4.019  -6.309
  428   1HB   ASP  52          2HB       ASP  52  -1.208  -4.858  -4.409
  429   2HB   ASP  52          1HB       ASP  52  -2.447  -5.025  -5.650
  430    H    VAL  53           H        VAL  53   0.405  -3.097  -8.362
  431    HA   VAL  53           HA       VAL  53  -1.848  -2.710 -10.025
  432    HB   VAL  53           HB       VAL  53  -0.219  -2.448 -11.856
  433   1HG1  VAL  53          1HG1      VAL  53   0.549  -0.417 -11.131
  434   2HG1  VAL  53          2HG1      VAL  53   1.017  -1.037  -9.548
  435   3HG1  VAL  53          3HG1      VAL  53  -0.683  -0.739  -9.910
  436   1HG2  VAL  53          1HG2      VAL  53   1.908  -3.170 -11.791
  437   2HG2  VAL  53          2HG2      VAL  53   1.323  -4.230 -10.511
  438   3HG2  VAL  53          3HG2      VAL  53   2.117  -2.710 -10.102
  439    H    TRP  54           H        TRP  54  -2.709  -4.970  -9.407
  440    HA   TRP  54           HA       TRP  54  -1.635  -7.309 -10.504
  441   1HB   TRP  54          2HB       TRP  54  -3.406  -7.427  -8.867
  442   2HB   TRP  54          1HB       TRP  54  -4.506  -6.551  -9.923
  443    HD1  TRP  54           HD       TRP  54  -6.314  -8.216 -10.630
  444    HE1  TRP  54           1HE      TRP  54  -6.348 -10.621 -11.548
  445    HE3  TRP  54           3HE      TRP  54  -1.321  -9.275 -10.326
  446    HZ2  TRP  54           2HZ      TRP  54  -4.505 -12.693 -12.071
  447    HZ3  TRP  54           3HZ      TRP  54  -0.538 -11.491 -11.055
  448    HH2  TRP  54           HH       TRP  54  -2.099 -13.164 -11.909
  449    H    MET  55           H        MET  55  -4.643  -5.925 -11.775
  450    HA   MET  55           HA       MET  55  -3.548  -5.751 -14.448
  451   1HB   MET  55          2HB       MET  55  -5.364  -7.933 -13.577
  452   2HB   MET  55          1HB       MET  55  -5.707  -7.191 -15.134
  453   1HG   MET  55          2HG       MET  55  -3.976  -8.185 -16.119
  454   2HG   MET  55          1HG       MET  55  -2.894  -7.845 -14.772
  455   1HE   MET  55          1HE       MET  55  -5.648  -9.809 -16.202
  456   2HE   MET  55          2HE       MET  55  -5.755 -11.320 -15.298
  457   3HE   MET  55          3HE       MET  55  -4.520 -11.122 -16.541
  458    HA   PRO  56           HA       PRO  56  -7.223  -2.995 -13.640
  459   1HB   PRO  56          2HB       PRO  56  -6.077  -0.871 -12.361
  460   2HB   PRO  56          1HB       PRO  56  -6.760  -2.265 -11.522
  461   1HG   PRO  56          2HG       PRO  56  -3.990  -1.456 -11.732
  462   2HG   PRO  56          1HG       PRO  56  -4.695  -2.747 -10.751
  463   1HD   PRO  56          2HD       PRO  56  -3.335  -2.909 -13.350
  464   2HD   PRO  56          1HD       PRO  56  -3.665  -4.188 -12.168
  465    H    ASP  57           H        ASP  57  -7.035  -0.280 -13.914
  466    HA   ASP  57           HA       ASP  57  -5.225   0.355 -16.085
  467   1HB   ASP  57          2HB       ASP  57  -7.191  -0.763 -17.160
  468   2HB   ASP  57          1HB       ASP  57  -8.206   0.532 -16.533
  469    H    GLY  58           H        GLY  58  -5.314   1.402 -13.535
  470   1HA   GLY  58          2HA       GLY  58  -6.499   4.076 -13.961
  471   2HA   GLY  58          1HA       GLY  58  -6.299   3.336 -12.381
  472    H    ASP  59           H        ASP  59  -3.577   2.333 -13.363
  473    HA   ASP  59           HA       ASP  59  -1.402   2.988 -13.233
  474   1HB   ASP  59          2HB       ASP  59  -2.647   4.884 -14.900
  475   2HB   ASP  59          1HB       ASP  59  -1.649   5.812 -13.786
  476    H    GLY  60           H        GLY  60  -0.321   3.249 -11.394
  477   1HA   GLY  60          2HA       GLY  60  -1.498   4.918  -9.301
  478   2HA   GLY  60          1HA       GLY  60  -0.253   3.701  -9.076
  479    H    VAL  61           H        VAL  61   0.383   5.733 -11.723
  480    HA   VAL  61           HA       VAL  61   2.697   6.815 -10.507
  481    HB   VAL  61           HB       VAL  61   1.342   7.681 -13.065
  482   1HG1  VAL  61          1HG1      VAL  61   4.008   8.220 -11.841
  483   2HG1  VAL  61          2HG1      VAL  61   2.883   9.335 -12.617
  484   3HG1  VAL  61          3HG1      VAL  61   3.823   8.207 -13.595
  485   1HG2  VAL  61          1HG2      VAL  61   3.563   5.672 -12.713
  486   2HG2  VAL  61          2HG2      VAL  61   2.755   6.120 -14.216
  487   3HG2  VAL  61          3HG2      VAL  61   1.868   5.249 -12.964
  488    H    ASN  62           H        ASN  62  -0.484   8.148 -11.311
  489    HA   ASN  62           HA       ASN  62   0.238  10.731 -10.182
  490   1HB   ASN  62          2HB       ASN  62  -1.711   9.776 -12.072
  491   2HB   ASN  62          1HB       ASN  62  -2.519  10.681 -10.796
  492   1HD2  ASN  62          1HD2      ASN  62  -0.145  10.814 -13.345
  493   2HD2  ASN  62          2HD2      ASN  62  -0.089  12.536 -13.471
  494    H    PHE  63           H        PHE  63  -0.551   7.915  -8.808
  495    HA   PHE  63           HA       PHE  63  -2.552   8.912  -6.951
  496   1HB   PHE  63          2HB       PHE  63  -2.716   6.599  -7.797
  497   2HB   PHE  63          1HB       PHE  63  -1.168   6.223  -7.048
  498    HD1  PHE  63           1HD      PHE  63  -4.172   8.068  -5.838
  499    HD2  PHE  63           2HD      PHE  63  -1.508   4.797  -5.278
  500    HE1  PHE  63           1HE      PHE  63  -5.327   7.492  -3.745
  501    HE2  PHE  63           2HE      PHE  63  -2.660   4.214  -3.183
  502    HZ   PHE  63           HZ       PHE  63  -4.573   5.563  -2.414
  503    H    ILE  64           H        ILE  64   0.861   8.049  -6.995
  504    HA   ILE  64           HA       ILE  64   1.503   7.953  -4.339
  505    HB   ILE  64           HB       ILE  64   3.125   9.356  -6.468
  506   1HG1  ILE  64          2HG1      ILE  64   4.189   6.824  -5.996
  507   2HG1  ILE  64          1HG1      ILE  64   2.449   6.559  -6.027
  508   1HG2  ILE  64          1HG2      ILE  64   4.925   8.237  -4.795
  509   2HG2  ILE  64          2HG2      ILE  64   3.645   8.657  -3.658
  510   3HG2  ILE  64          3HG2      ILE  64   4.367   9.906  -4.672
  511   1HD1  ILE  64          1HD1      ILE  64   4.115   7.826  -8.184
  512   2HD1  ILE  64          2HD1      ILE  64   2.359   7.689  -8.215
  513   3HD1  ILE  64          3HD1      ILE  64   3.354   6.235  -8.221
  514    H    ASP  65           H        ASP  65   0.586  10.761  -6.194
  515    HA   ASP  65           HA       ASP  65   1.453  12.655  -4.209
  516   1HB   ASP  65          2HB       ASP  65   0.825  12.848  -6.872
  517   2HB   ASP  65          1HB       ASP  65  -0.605  13.543  -6.115
  518    H    PHE  66           H        PHE  66  -1.527  11.005  -5.050
  519    HA   PHE  66           HA       PHE  66  -3.310  12.504  -3.494
  520   1HB   PHE  66          2HB       PHE  66  -4.045  10.853  -5.159
  521   2HB   PHE  66          1HB       PHE  66  -3.403   9.554  -4.160
  522    HD1  PHE  66           1HD      PHE  66  -4.423   9.153  -1.896
  523    HD2  PHE  66           2HD      PHE  66  -6.196  11.704  -4.804
  524    HE1  PHE  66           1HE      PHE  66  -6.578   8.991  -0.720
  525    HE2  PHE  66           2HE      PHE  66  -8.353  11.547  -3.633
  526    HZ   PHE  66           HZ       PHE  66  -8.546  10.187  -1.588
  527    H    ILE  67           H        ILE  67  -1.258   9.743  -2.690
  528    HA   ILE  67           HA       ILE  67  -2.211   9.312  -0.081
  529    HB   ILE  67           HB       ILE  67   0.506   8.767  -1.291
  530   1HG1  ILE  67          2HG1      ILE  67  -0.494   6.357  -0.975
  531   2HG1  ILE  67          1HG1      ILE  67  -2.032   7.212  -0.953
  532   1HG2  ILE  67          1HG2      ILE  67   1.161   8.636   0.871
  533   2HG2  ILE  67          2HG2      ILE  67   0.392   7.051   0.771
  534   3HG2  ILE  67          3HG2      ILE  67  -0.483   8.413   1.470
  535   1HD1  ILE  67          1HD1      ILE  67  -0.248   7.941  -3.161
  536   2HD1  ILE  67          2HD1      ILE  67  -1.980   7.609  -3.154
  537   3HD1  ILE  67          3HD1      ILE  67  -0.826   6.276  -3.176
  538    H    LYS  68           H        LYS  68   0.385  11.373  -1.338
  539    HA   LYS  68           HA       LYS  68   1.133  12.354   1.251
  540   1HB   LYS  68          2HB       LYS  68   1.740  13.550  -1.459
  541   2HB   LYS  68          1HB       LYS  68   2.585  13.876   0.048
  542   1HG   LYS  68          2HG       LYS  68   2.592  11.059  -0.495
  543   2HG   LYS  68          1HG       LYS  68   3.207  11.954  -1.886
  544   1HD   LYS  68          2HD       LYS  68   5.160  11.889  -0.766
  545   2HD   LYS  68          1HD       LYS  68   4.468  13.227   0.152
  546   1HE   LYS  68          2HE       LYS  68   3.432  11.153   1.510
  547   2HE   LYS  68          1HE       LYS  68   4.927  10.416   0.935
  548   1HZ   LYS  68          1HZ       LYS  68   4.535  12.531   2.883
  549   2HZ   LYS  68          2HZ       LYS  68   5.838  12.749   1.827
  550   3HZ   LYS  68          3HZ       LYS  68   5.749  11.359   2.787
  551    H    GLU  69           H        GLU  69  -1.185  13.207  -1.173
  552    HA   GLU  69           HA       GLU  69  -1.619  15.902  -0.492
  553   1HB   GLU  69          2HB       GLU  69  -2.436  14.663  -2.551
  554   2HB   GLU  69          1HB       GLU  69  -3.715  14.012  -1.536
  555   1HG   GLU  69          2HG       GLU  69  -4.133  16.538  -0.981
  556   2HG   GLU  69          1HG       GLU  69  -3.295  16.788  -2.512
  557    H    ASN  70           H        ASN  70  -3.004  12.893   0.724
  558    HA   ASN  70           HA       ASN  70  -4.277  14.439   2.887
  559   1HB   ASN  70          2HB       ASN  70  -5.311  11.748   2.065
  560   2HB   ASN  70          1HB       ASN  70  -6.156  13.069   2.868
  561   1HD2  ASN  70          1HD2      ASN  70  -4.615  12.200  -0.193
  562   2HD2  ASN  70          2HD2      ASN  70  -5.698  13.096  -1.196
  563    H    SER  71           H        SER  71  -1.611  12.905   2.509
  564    HA   SER  71           HA       SER  71  -1.465  11.948   5.185
  565   1HB   SER  71          2HB       SER  71  -2.140  10.040   3.109
  566   2HB   SER  71          1HB       SER  71  -0.608   9.622   3.876
  567    HG   SER  71           HG       SER  71  -2.919  10.276   5.369
  568    HA   PRO  72           HA       PRO  72   2.480  13.323   3.128
  569   1HB   PRO  72          2HB       PRO  72   2.692  15.193   5.354
  570   2HB   PRO  72          1HB       PRO  72   2.675  15.527   3.621
  571   1HG   PRO  72          2HG       PRO  72   0.628  16.197   5.269
  572   2HG   PRO  72          1HG       PRO  72   0.396  15.786   3.561
  573   1HD   PRO  72          2HD       PRO  72  -0.055  14.104   5.994
  574   2HD   PRO  72          1HD       PRO  72  -1.033  14.234   4.516
  575    H    ASP  73           H        ASP  73   1.517  12.320   6.246
  576    HA   ASP  73           HA       ASP  73   4.285  11.656   6.975
  577   1HB   ASP  73          2HB       ASP  73   2.738  13.053   8.514
  578   2HB   ASP  73          1HB       ASP  73   1.980  11.507   8.880
  579    H    SER  74           H        SER  74   2.546  10.167   5.107
  580    HA   SER  74           HA       SER  74   2.187   7.649   6.572
  581   1HB   SER  74          2HB       SER  74   0.222   8.469   5.338
  582   2HB   SER  74          1HB       SER  74   1.159   8.475   3.846
  583    HG   SER  74           HG       SER  74  -0.231   6.494   4.803
  584    H    VAL  75           H        VAL  75   2.298   5.968   4.254
  585    HA   VAL  75           HA       VAL  75   4.938   6.362   3.111
  586    HB   VAL  75           HB       VAL  75   4.358   3.859   4.702
  587   1HG1  VAL  75          1HG1      VAL  75   6.441   4.685   2.748
  588   2HG1  VAL  75          2HG1      VAL  75   5.737   3.097   3.048
  589   3HG1  VAL  75          3HG1      VAL  75   6.966   3.737   4.139
  590   1HG2  VAL  75          1HG2      VAL  75   4.829   5.545   6.281
  591   2HG2  VAL  75          2HG2      VAL  75   6.082   6.261   5.267
  592   3HG2  VAL  75          3HG2      VAL  75   6.356   4.697   6.036
  593    H    VAL  76           H        VAL  76   5.110   5.542   1.127
  594    HA   VAL  76           HA       VAL  76   2.873   3.880   0.171
  595    HB   VAL  76           HB       VAL  76   4.699   5.506  -1.582
  596   1HG1  VAL  76          1HG1      VAL  76   3.028   3.559  -2.301
  597   2HG1  VAL  76          2HG1      VAL  76   3.309   4.984  -3.299
  598   3HG1  VAL  76          3HG1      VAL  76   1.883   4.900  -2.265
  599   1HG2  VAL  76          1HG2      VAL  76   2.366   6.359   0.043
  600   2HG2  VAL  76          2HG2      VAL  76   2.505   7.000  -1.594
  601   3HG2  VAL  76          3HG2      VAL  76   3.805   7.260  -0.432
  602    H    ILE  77           H        ILE  77   3.327   1.824  -0.130
  603    HA   ILE  77           HA       ILE  77   6.030   1.085  -1.046
  604    HB   ILE  77           HB       ILE  77   4.198  -0.726   0.516
  605   1HG1  ILE  77          2HG1      ILE  77   4.765   1.283   1.859
  606   2HG1  ILE  77          1HG1      ILE  77   5.474  -0.189   2.513
  607   1HG2  ILE  77          1HG2      ILE  77   6.164  -1.545  -0.959
  608   2HG2  ILE  77          2HG2      ILE  77   5.990  -2.181   0.677
  609   3HG2  ILE  77          3HG2      ILE  77   7.176  -0.920   0.342
  610   1HD1  ILE  77          1HD1      ILE  77   7.447   0.749   0.856
  611   2HD1  ILE  77          2HD1      ILE  77   7.366   0.973   2.604
  612   3HD1  ILE  77          3HD1      ILE  77   6.751   2.226   1.526
  613    H    VAL  78           H        VAL  78   4.311   1.768  -2.990
  614    HA   VAL  78           HA       VAL  78   2.507  -0.037  -4.027
  615    HB   VAL  78           HB       VAL  78   4.514   1.544  -5.646
  616   1HG1  VAL  78          1HG1      VAL  78   1.804   1.185  -6.681
  617   2HG1  VAL  78          2HG1      VAL  78   2.714  -0.318  -6.533
  618   3HG1  VAL  78          3HG1      VAL  78   3.359   1.013  -7.492
  619   1HG2  VAL  78          1HG2      VAL  78   2.139   2.347  -4.090
  620   2HG2  VAL  78          2HG2      VAL  78   2.274   3.029  -5.710
  621   3HG2  VAL  78          3HG2      VAL  78   3.571   3.273  -4.541
  622    H    ILE  79           H        ILE  79   2.706  -2.136  -4.416
  623    HA   ILE  79           HA       ILE  79   5.313  -3.183  -5.299
  624    HB   ILE  79           HB       ILE  79   3.182  -5.010  -4.291
  625   1HG1  ILE  79          2HG1      ILE  79   5.000  -3.447  -2.451
  626   2HG1  ILE  79          1HG1      ILE  79   3.286  -3.115  -2.667
  627   1HG2  ILE  79          1HG2      ILE  79   5.522  -5.812  -3.201
  628   2HG2  ILE  79          2HG2      ILE  79   6.097  -5.006  -4.661
  629   3HG2  ILE  79          3HG2      ILE  79   4.937  -6.329  -4.782
  630   1HD1  ILE  79          1HD1      ILE  79   4.120  -4.563  -0.669
  631   2HD1  ILE  79          2HD1      ILE  79   4.141  -5.852  -1.874
  632   3HD1  ILE  79          3HD1      ILE  79   2.640  -4.992  -1.527
  633    H    THR  80           H        THR  80   4.870  -5.434  -6.509
  634    HA   THR  80           HA       THR  80   3.946  -6.584  -8.259
  635    HB   THR  80           HB       THR  80   1.875  -4.437  -8.648
  636    HG1  THR  80           1HG      THR  80   1.970  -6.437  -6.660
  637   1HG2  THR  80          1HG2      THR  80   0.503  -6.139  -9.508
  638   2HG2  THR  80          2HG2      THR  80   1.575  -7.409  -8.920
  639   3HG2  THR  80          3HG2      THR  80   2.085  -6.372 -10.252
  640    H    GLY  81           H        GLY  81   5.357  -6.501  -9.869
  641   1HA   GLY  81          2HA       GLY  81   5.108  -4.555 -11.942
  642   2HA   GLY  81          1HA       GLY  81   6.548  -4.272 -10.974
  643    H    HIS  82           H        HIS  82   5.253  -5.946 -13.585
  644    HA   HIS  82           HA       HIS  82   7.288  -8.044 -13.519
  645   1HB   HIS  82          2HB       HIS  82   4.721  -8.219 -14.257
  646   2HB   HIS  82          1HB       HIS  82   5.417  -7.792 -15.817
  647    HD1  HIS  82           1HD      HIS  82   6.527 -10.224 -13.096
  648    HD2  HIS  82           2HD      HIS  82   5.790 -10.085 -17.183
  649    HE1  HIS  82           1HE      HIS  82   7.081 -12.520 -13.958
  650    HE2  HIS  82           2HE      HIS  82   6.547 -12.438 -16.419
  651    H    GLY  83           H        GLY  83   8.521  -8.481 -15.524
  652   1HA   GLY  83          2HA       GLY  83  10.033  -7.816 -17.118
  653   2HA   GLY  83          1HA       GLY  83   8.833  -6.624 -17.596
  654    H    SER  84           H        SER  84  10.498  -5.127 -18.051
  655    HA   SER  84           HA       SER  84  12.490  -4.329 -16.256
  656   1HB   SER  84          2HB       SER  84  11.246  -3.184 -18.697
  657   2HB   SER  84          1HB       SER  84  12.121  -2.061 -17.655
  658    HG   SER  84           HG       SER  84  13.966  -3.196 -17.966
  659    H    VAL  85           H        VAL  85  12.490  -3.092 -14.487
  660    HA   VAL  85           HA       VAL  85  10.027  -2.230 -13.340
  661    HB   VAL  85           HB       VAL  85  11.510  -1.198 -11.581
  662   1HG1  VAL  85          1HG1      VAL  85  10.725  -3.755 -11.927
  663   2HG1  VAL  85          2HG1      VAL  85  11.604  -3.179 -10.509
  664   3HG1  VAL  85          3HG1      VAL  85  12.473  -3.970 -11.825
  665   1HG2  VAL  85          1HG2      VAL  85  13.846  -1.515 -11.620
  666   2HG2  VAL  85          2HG2      VAL  85  13.430  -0.886 -13.214
  667   3HG2  VAL  85          3HG2      VAL  85  13.754  -2.607 -13.002
  668    H    ASP  86           H        ASP  86   9.629  -0.901 -15.424
  669    HA   ASP  86           HA       ASP  86  10.874   1.740 -15.304
  670   1HB   ASP  86          2HB       ASP  86  10.673   0.642 -17.502
  671   2HB   ASP  86          1HB       ASP  86   8.922   0.600 -17.318
  672    H    THR  87           H        THR  87   7.990   0.131 -14.350
  673    HA   THR  87           HA       THR  87   6.416   2.566 -14.225
  674    HB   THR  87           HB       THR  87   5.586   0.078 -14.608
  675    HG1  THR  87           1HG      THR  87   3.736   1.027 -14.452
  676   1HG2  THR  87          1HG2      THR  87   6.482  -0.513 -12.225
  677   2HG2  THR  87          2HG2      THR  87   4.945  -1.164 -12.794
  678   3HG2  THR  87          3HG2      THR  87   4.965   0.218 -11.699
  679    H    ALA  88           H        ALA  88   8.293   0.486 -12.158
  680    HA   ALA  88           HA       ALA  88   7.545   1.457  -9.647
  681   1HB   ALA  88          1HB       ALA  88   9.813   0.689  -8.936
  682   2HB   ALA  88          2HB       ALA  88  10.185   0.381 -10.630
  683   3HB   ALA  88          3HB       ALA  88   8.898  -0.522  -9.834
  684    H    VAL  89           H        VAL  89  10.369   2.338 -11.608
  685    HA   VAL  89           HA       VAL  89  11.233   4.491 -10.094
  686    HB   VAL  89           HB       VAL  89  12.452   5.233 -12.065
  687   1HG1  VAL  89          1HG1      VAL  89  12.993   3.052 -10.773
  688   2HG1  VAL  89          2HG1      VAL  89  13.827   3.383 -12.291
  689   3HG1  VAL  89          3HG1      VAL  89  12.476   2.250 -12.255
  690   1HG2  VAL  89          1HG2      VAL  89  12.123   4.066 -14.237
  691   2HG2  VAL  89          2HG2      VAL  89  10.752   5.066 -13.755
  692   3HG2  VAL  89          3HG2      VAL  89  10.675   3.314 -13.566
  693    H    LYS  90           H        LYS  90   8.615   4.263 -12.379
  694    HA   LYS  90           HA       LYS  90   8.299   7.109 -12.684
  695   1HB   LYS  90          2HB       LYS  90   7.648   5.623 -14.495
  696   2HB   LYS  90          1HB       LYS  90   6.505   4.800 -13.447
  697   1HG   LYS  90          2HG       LYS  90   5.130   6.765 -13.309
  698   2HG   LYS  90          1HG       LYS  90   6.322   7.705 -14.211
  699   1HD   LYS  90          2HD       LYS  90   5.969   5.849 -16.024
  700   2HD   LYS  90          1HD       LYS  90   4.446   5.590 -15.173
  701   1HE   LYS  90          2HE       LYS  90   3.543   7.446 -16.027
  702   2HE   LYS  90          1HE       LYS  90   4.975   8.405 -15.657
  703   1HZ   LYS  90          1HZ       LYS  90   5.943   7.884 -17.685
  704   2HZ   LYS  90          2HZ       LYS  90   4.316   8.100 -18.095
  705   3HZ   LYS  90          3HZ       LYS  90   4.949   6.539 -17.946
  706    H    ALA  91           H        ALA  91   7.534   4.936 -10.232
  707    HA   ALA  91           HA       ALA  91   5.385   6.705  -9.258
  708   1HB   ALA  91          1HB       ALA  91   4.802   4.560  -7.871
  709   2HB   ALA  91          2HB       ALA  91   5.670   3.741  -9.170
  710   3HB   ALA  91          3HB       ALA  91   4.257   4.730  -9.541
  711    H    ILE  92           H        ILE  92   8.329   4.972  -8.445
  712    HA   ILE  92           HA       ILE  92   8.193   5.650  -5.657
  713    HB   ILE  92           HB       ILE  92  10.239   4.537  -5.364
  714   1HG1  ILE  92          2HG1      ILE  92  10.680   4.772  -8.347
  715   2HG1  ILE  92          1HG1      ILE  92  11.550   5.657  -7.100
  716   1HG2  ILE  92          1HG2      ILE  92   9.937   2.479  -6.967
  717   2HG2  ILE  92          2HG2      ILE  92   8.441   3.307  -7.390
  718   3HG2  ILE  92          3HG2      ILE  92   8.746   2.843  -5.720
  719   1HD1  ILE  92          1HD1      ILE  92  12.478   3.566  -6.259
  720   2HD1  ILE  92          2HD1      ILE  92  12.873   3.812  -7.960
  721   3HD1  ILE  92          3HD1      ILE  92  11.603   2.677  -7.506
  722    H    LYS  93           H        LYS  93  10.052   6.807  -8.448
  723    HA   LYS  93           HA       LYS  93  11.595   8.692  -7.036
  724   1HB   LYS  93          2HB       LYS  93  10.783   8.440  -9.919
  725   2HB   LYS  93          1HB       LYS  93  11.718   9.818  -9.359
  726   1HG   LYS  93          2HG       LYS  93  13.570   8.513  -8.843
  727   2HG   LYS  93          1HG       LYS  93  12.627   7.023  -8.801
  728   1HD   LYS  93          2HD       LYS  93  12.236   7.321 -11.265
  729   2HD   LYS  93          1HD       LYS  93  13.407   8.639 -11.221
  730   1HE   LYS  93          2HE       LYS  93  14.285   6.362 -11.916
  731   2HE   LYS  93          1HE       LYS  93  15.171   7.196 -10.640
  732   1HZ   LYS  93          1HZ       LYS  93  14.479   5.721  -9.066
  733   2HZ   LYS  93          2HZ       LYS  93  14.506   4.691 -10.408
  734   3HZ   LYS  93          3HZ       LYS  93  13.039   5.341  -9.869
  735    H    LYS  94           H        LYS  94   8.288   8.662  -7.888
  736    HA   LYS  94           HA       LYS  94   7.910  11.501  -7.975
  737   1HB   LYS  94          2HB       LYS  94   6.423   9.850  -9.122
  738   2HB   LYS  94          1HB       LYS  94   5.836   9.353  -7.540
  739   1HG   LYS  94          2HG       LYS  94   4.215  10.841  -8.149
  740   2HG   LYS  94          1HG       LYS  94   5.315  11.903  -7.269
  741   1HD   LYS  94          2HD       LYS  94   5.534  11.514 -10.239
  742   2HD   LYS  94          1HD       LYS  94   4.438  12.707  -9.539
  743   1HE   LYS  94          2HE       LYS  94   6.684  13.309  -8.195
  744   2HE   LYS  94          1HE       LYS  94   7.389  12.688  -9.686
  745   1HZ   LYS  94          1HZ       LYS  94   6.732  15.196  -9.437
  746   2HZ   LYS  94          2HZ       LYS  94   5.204  14.627  -9.891
  747   3HZ   LYS  94          3HZ       LYS  94   6.533  14.389 -10.910
  748    H    GLY  95           H        GLY  95   7.987   9.073  -5.488
  749   1HA   GLY  95          2HA       GLY  95   8.361  10.669  -3.348
  750   2HA   GLY  95          1HA       GLY  95   6.620  10.735  -3.551
  751    H    ALA  96           H        ALA  96   6.955   7.781  -4.585
  752    HA   ALA  96           HA       ALA  96   6.113   6.553  -2.224
  753   1HB   ALA  96          1HB       ALA  96   5.694   4.799  -3.541
  754   2HB   ALA  96          2HB       ALA  96   7.364   4.709  -4.099
  755   3HB   ALA  96          3HB       ALA  96   6.235   5.823  -4.870
  756    H    TYR  97           H        TYR  97   7.350   4.362  -1.570
  757    HA   TYR  97           HA       TYR  97   9.948   5.292  -0.599
  758   1HB   TYR  97          2HB       TYR  97   8.390   4.627   1.131
  759   2HB   TYR  97          1HB       TYR  97   8.151   3.060   0.368
  760    HD1  TYR  97           1HD      TYR  97  10.821   5.182   1.878
  761    HD2  TYR  97           2HD      TYR  97   9.423   1.246   1.069
  762    HE1  TYR  97           1HE      TYR  97  12.659   4.259   3.225
  763    HE2  TYR  97           2HE      TYR  97  11.257   0.312   2.414
  764    HH   TYR  97           HH       TYR  97  12.900   1.823   4.587
  765    H    GLU  98           H        GLU  98   8.730   3.339  -3.005
  766    HA   GLU  98           HA       GLU  98  10.721   2.524  -4.417
  767   1HB   GLU  98          2HB       GLU  98  11.788   0.487  -3.558
  768   2HB   GLU  98          1HB       GLU  98  12.089   1.851  -2.496
  769   1HG   GLU  98          2HG       GLU  98  10.183   1.013  -1.073
  770   2HG   GLU  98          1HG       GLU  98  10.195  -0.442  -2.067
  771    H    PHE  99           H        PHE  99  10.687  -0.095  -4.983
  772    HA   PHE  99           HA       PHE  99   7.835  -0.806  -5.193
  773   1HB   PHE  99          2HB       PHE  99   9.615  -0.117  -7.281
  774   2HB   PHE  99          1HB       PHE  99   9.341  -1.849  -7.405
  775    HD1  PHE  99           1HD      PHE  99   7.649  -2.501  -8.786
  776    HD2  PHE  99           2HD      PHE  99   7.328   1.235  -6.776
  777    HE1  PHE  99           1HE      PHE  99   5.511  -2.077  -9.927
  778    HE2  PHE  99           2HE      PHE  99   5.188   1.666  -7.913
  779    HZ   PHE  99           HZ       PHE  99   4.277   0.008  -9.489
  780    H    LEU 100           H        LEU 100   7.952  -2.318  -3.511
  781    HA   LEU 100           HA       LEU 100   9.928  -4.226  -3.117
  782   1HB   LEU 100          2HB       LEU 100   7.964  -3.594  -1.629
  783   2HB   LEU 100          1HB       LEU 100   6.999  -4.679  -2.609
  784    HG   LEU 100           HG       LEU 100   8.309  -6.575  -1.917
  785   1HD1  LEU 100          1HD1      LEU 100  10.498  -6.066  -1.637
  786   2HD1  LEU 100          2HD1      LEU 100  10.002  -5.922   0.049
  787   3HD1  LEU 100          3HD1      LEU 100  10.155  -4.478  -0.952
  788   1HD2  LEU 100          1HD2      LEU 100   8.000  -5.242   0.690
  789   2HD2  LEU 100          2HD2      LEU 100   7.337  -6.768   0.104
  790   3HD2  LEU 100          3HD2      LEU 100   6.579  -5.244  -0.357
  791    H    GLU 101           H        GLU 101   9.614  -6.639  -3.383
  792    HA   GLU 101           HA       GLU 101   8.963  -7.160  -6.177
  793   1HB   GLU 101          2HB       GLU 101  10.248  -9.024  -4.178
  794   2HB   GLU 101          1HB       GLU 101  10.206  -9.209  -5.927
  795   1HG   GLU 101          2HG       GLU 101  11.850  -7.674  -6.271
  796   2HG   GLU 101          1HG       GLU 101  11.449  -6.754  -4.821
  797    H    LYS 102           H        LYS 102   7.012  -7.877  -6.688
  798    HA   LYS 102           HA       LYS 102   5.068  -8.723  -4.878
  799   1HB   LYS 102          2HB       LYS 102   5.110  -8.106  -7.550
  800   2HB   LYS 102          1HB       LYS 102   4.791  -9.833  -7.583
  801   1HG   LYS 102          2HG       LYS 102   3.189  -8.200  -5.707
  802   2HG   LYS 102          1HG       LYS 102   2.858  -8.024  -7.432
  803   1HD   LYS 102          2HD       LYS 102   1.479  -9.774  -7.058
  804   2HD   LYS 102          1HD       LYS 102   2.965 -10.705  -7.255
  805   1HE   LYS 102          2HE       LYS 102   3.247 -10.940  -4.929
  806   2HE   LYS 102          1HE       LYS 102   2.061  -9.685  -4.578
  807   1HZ   LYS 102          1HZ       LYS 102   0.306 -11.098  -5.253
  808   2HZ   LYS 102          2HZ       LYS 102   1.285 -12.018  -4.225
  809   3HZ   LYS 102          3HZ       LYS 102   1.367 -12.245  -5.900
  810    HA   PRO 103           HA       PRO 103   5.989 -13.303  -6.242
  811   1HB   PRO 103          2HB       PRO 103   8.468 -13.702  -7.355
  812   2HB   PRO 103          1HB       PRO 103   6.986 -13.486  -8.291
  813   1HG   PRO 103          2HG       PRO 103   9.110 -11.492  -7.611
  814   2HG   PRO 103          1HG       PRO 103   8.250 -11.736  -9.143
  815   1HD   PRO 103          2HD       PRO 103   7.600  -9.749  -7.462
  816   2HD   PRO 103          1HD       PRO 103   6.369 -10.604  -8.413
  817    H    PHE 104           H        PHE 104   8.220 -14.800  -5.789
  818    HA   PHE 104           HA       PHE 104   9.759 -15.463  -4.242
  819   1HB   PHE 104          2HB       PHE 104  10.218 -12.753  -4.367
  820   2HB   PHE 104          1HB       PHE 104   9.880 -12.997  -2.658
  821    HD1  PHE 104           1HD      PHE 104  11.791 -13.133  -1.412
  822    HD2  PHE 104           2HD      PHE 104  11.726 -14.924  -5.272
  823    HE1  PHE 104           1HE      PHE 104  14.090 -13.942  -1.072
  824    HE2  PHE 104           2HE      PHE 104  14.025 -15.737  -4.938
  825    HZ   PHE 104           HZ       PHE 104  15.209 -15.247  -2.834
  826    H    SER 105           H        SER 105   7.936 -13.035  -2.371
  827    HA   SER 105           HA       SER 105   6.087 -14.709  -1.183
  828   1HB   SER 105          2HB       SER 105   7.744 -16.059  -0.180
  829   2HB   SER 105          1HB       SER 105   8.738 -14.669   0.250
  830    HG   SER 105           HG       SER 105   6.235 -15.394   1.373
  831    H    VAL 106           H        VAL 106   5.141 -13.799   0.824
  832    HA   VAL 106           HA       VAL 106   5.187 -10.889   0.691
  833    HB   VAL 106           HB       VAL 106   3.019 -11.994   0.702
  834   1HG1  VAL 106          1HG1      VAL 106   2.395 -12.982   3.071
  835   2HG1  VAL 106          2HG1      VAL 106   4.125 -13.319   3.115
  836   3HG1  VAL 106          3HG1      VAL 106   3.132 -13.976   1.816
  837   1HG2  VAL 106          1HG2      VAL 106   3.643 -10.414   3.190
  838   2HG2  VAL 106          2HG2      VAL 106   2.006 -10.817   2.672
  839   3HG2  VAL 106          3HG2      VAL 106   3.032  -9.810   1.650
  840    H    GLU 107           H        GLU 107   6.182 -13.475   2.832
  841    HA   GLU 107           HA       GLU 107   6.381 -12.284   5.272
  842   1HB   GLU 107          2HB       GLU 107   7.175 -14.614   4.467
  843   2HB   GLU 107          1HB       GLU 107   8.720 -13.818   4.192
  844   1HG   GLU 107          2HG       GLU 107   8.448 -13.017   6.641
  845   2HG   GLU 107          1HG       GLU 107   7.290 -14.343   6.754
  846    H    ARG 108           H        ARG 108   8.299 -11.634   2.425
  847    HA   ARG 108           HA       ARG 108  10.301 -10.058   3.710
  848   1HB   ARG 108          2HB       ARG 108   9.439  -9.768   0.835
  849   2HB   ARG 108          1HB       ARG 108  11.024  -9.463   1.529
  850   1HG   ARG 108          2HG       ARG 108  10.132 -12.212   1.884
  851   2HG   ARG 108          1HG       ARG 108  10.258 -11.726   0.192
  852   1HD   ARG 108          2HD       ARG 108  12.525 -11.360   0.326
  853   2HD   ARG 108          1HD       ARG 108  12.478 -11.042   2.060
  854    HE   ARG 108           HE       ARG 108  11.784 -13.695   1.742
  855   1HH1  ARG 108          1HH1      ARG 108  14.546 -11.682   1.029
  856   2HH1  ARG 108          2HH1      ARG 108  15.687 -12.972   1.196
  857   1HH2  ARG 108          1HH2      ARG 108  13.285 -15.394   1.964
  858   2HH2  ARG 108          2HH2      ARG 108  14.972 -15.080   1.728
  859    H    PHE 109           H        PHE 109   7.240  -9.407   2.100
  860    HA   PHE 109           HA       PHE 109   7.270  -6.627   2.081
  861   1HB   PHE 109          2HB       PHE 109   5.516  -7.658   0.890
  862   2HB   PHE 109          1HB       PHE 109   5.058  -8.666   2.255
  863    HD1  PHE 109           1HD      PHE 109   5.572  -4.982   2.028
  864    HD2  PHE 109           2HD      PHE 109   2.854  -8.181   2.731
  865    HE1  PHE 109           1HE      PHE 109   3.828  -3.360   2.644
  866    HE2  PHE 109           2HE      PHE 109   1.106  -6.565   3.345
  867    HZ   PHE 109           HZ       PHE 109   1.592  -4.153   3.305
  868    H    LEU 110           H        LEU 110   6.765  -8.885   4.672
  869    HA   LEU 110           HA       LEU 110   5.506  -7.287   6.567
  870   1HB   LEU 110          2HB       LEU 110   6.603  -9.812   6.490
  871   2HB   LEU 110          1HB       LEU 110   7.577  -8.987   7.689
  872    HG   LEU 110           HG       LEU 110   4.593  -8.852   7.868
  873   1HD1  LEU 110          1HD1      LEU 110   4.746 -10.860   9.379
  874   2HD1  LEU 110          2HD1      LEU 110   6.337 -11.164   8.681
  875   3HD1  LEU 110          3HD1      LEU 110   4.903 -11.189   7.654
  876   1HD2  LEU 110          1HD2      LEU 110   6.915  -8.227   9.531
  877   2HD2  LEU 110          2HD2      LEU 110   5.652  -9.123  10.374
  878   3HD2  LEU 110          3HD2      LEU 110   5.272  -7.590   9.588
  879    H    LEU 111           H        LEU 111   8.909  -7.552   5.707
  880    HA   LEU 111           HA       LEU 111  10.001  -6.020   7.773
  881   1HB   LEU 111          2HB       LEU 111  10.886  -6.526   4.950
  882   2HB   LEU 111          1HB       LEU 111  11.825  -5.537   6.052
  883    HG   LEU 111           HG       LEU 111  11.870  -7.528   7.617
  884   1HD1  LEU 111          1HD1      LEU 111  10.598  -8.771   5.209
  885   2HD1  LEU 111          2HD1      LEU 111  10.163  -8.932   6.911
  886   3HD1  LEU 111          3HD1      LEU 111  11.612  -9.724   6.293
  887   1HD2  LEU 111          1HD2      LEU 111  13.679  -6.764   5.961
  888   2HD2  LEU 111          2HD2      LEU 111  13.172  -8.147   4.990
  889   3HD2  LEU 111          3HD2      LEU 111  13.790  -8.395   6.623
  890    H    THR 112           H        THR 112   9.293  -4.958   4.435
  891    HA   THR 112           HA       THR 112   9.812  -2.298   4.624
  892    HB   THR 112           HB       THR 112   7.432  -3.527   3.218
  893    HG1  THR 112           1HG      THR 112  10.107  -3.106   2.384
  894   1HG2  THR 112          1HG2      THR 112   8.538  -1.429   1.719
  895   2HG2  THR 112          2HG2      THR 112   8.292  -0.812   3.353
  896   3HG2  THR 112          3HG2      THR 112   6.941  -1.514   2.463
  897    H    ILE 113           H        ILE 113   6.753  -3.853   5.532
  898    HA   ILE 113           HA       ILE 113   5.330  -1.595   6.311
  899    HB   ILE 113           HB       ILE 113   5.230  -4.389   7.457
  900   1HG1  ILE 113          2HG1      ILE 113   4.698  -4.251   5.069
  901   2HG1  ILE 113          1HG1      ILE 113   3.259  -4.636   6.008
  902   1HG2  ILE 113          1HG2      ILE 113   3.316  -2.093   7.821
  903   2HG2  ILE 113          2HG2      ILE 113   4.285  -2.877   9.072
  904   3HG2  ILE 113          3HG2      ILE 113   2.981  -3.765   8.278
  905   1HD1  ILE 113          1HD1      ILE 113   3.127  -1.925   5.900
  906   2HD1  ILE 113          2HD1      ILE 113   2.306  -3.026   4.793
  907   3HD1  ILE 113          3HD1      ILE 113   3.855  -2.313   4.342
  908    H    LYS 114           H        LYS 114   6.709  -3.861   8.674
  909    HA   LYS 114           HA       LYS 114   6.707  -2.132  10.845
  910   1HB   LYS 114          2HB       LYS 114   7.003  -4.426  11.283
  911   2HB   LYS 114          1HB       LYS 114   8.353  -4.556  10.173
  912   1HG   LYS 114          2HG       LYS 114   8.593  -2.823  12.593
  913   2HG   LYS 114          1HG       LYS 114   8.741  -4.572  12.752
  914   1HD   LYS 114          2HD       LYS 114  10.491  -2.676  11.203
  915   2HD   LYS 114          1HD       LYS 114  10.942  -3.783  12.495
  916   1HE   LYS 114          2HE       LYS 114  10.179  -4.462   9.663
  917   2HE   LYS 114          1HE       LYS 114  11.735  -4.707  10.452
  918   1HZ   LYS 114          1HZ       LYS 114  10.725  -6.793  10.456
  919   2HZ   LYS 114          2HZ       LYS 114   9.209  -6.179  10.889
  920   3HZ   LYS 114          3HZ       LYS 114  10.463  -6.219  12.025
  921    H    HIS 115           H        HIS 115   8.725  -2.112   8.101
  922    HA   HIS 115           HA       HIS 115  10.870  -0.632   9.395
  923   1HB   HIS 115          2HB       HIS 115  11.365  -2.345   7.652
  924   2HB   HIS 115          1HB       HIS 115  10.547  -1.325   6.473
  925    HD1  HIS 115           1HD      HIS 115  12.928  -0.050   9.110
  926    HD2  HIS 115           2HD      HIS 115  12.759  -0.620   4.998
  927    HE1  HIS 115           1HE      HIS 115  14.983   1.071   8.190
  928    HE2  HIS 115           2HE      HIS 115  14.907   0.629   5.711
  929    H    ALA 116           H        ALA 116   7.972  -0.070   7.643
  930    HA   ALA 116           HA       ALA 116   8.688   2.575   6.728
  931   1HB   ALA 116          1HB       ALA 116   6.033   2.523   6.398
  932   2HB   ALA 116          2HB       ALA 116   6.345   0.789   6.488
  933   3HB   ALA 116          3HB       ALA 116   7.158   1.768   5.268
  934    H    PHE 117           H        PHE 117   6.534   1.209   9.209
  935    HA   PHE 117           HA       PHE 117   5.506   3.595  10.208
  936   1HB   PHE 117          2HB       PHE 117   5.986   0.905  11.463
  937   2HB   PHE 117          1HB       PHE 117   5.308   2.235  12.397
  938    HD1  PHE 117           1HD      PHE 117   3.085   3.092  11.908
  939    HD2  PHE 117           2HD      PHE 117   4.717  -0.178   9.728
  940    HE1  PHE 117           1HE      PHE 117   0.844   2.552  11.048
  941    HE2  PHE 117           2HE      PHE 117   2.484  -0.719   8.869
  942    HZ   PHE 117           HZ       PHE 117   0.542   0.645   9.523
  943    H    GLU 118           H        GLU 118   8.605   2.083  10.729
  944    HA   GLU 118           HA       GLU 118   9.416   3.369  13.063
  945   1HB   GLU 118          2HB       GLU 118  10.975   2.389  10.687
  946   2HB   GLU 118          1HB       GLU 118  11.751   3.066  12.112
  947   1HG   GLU 118          2HG       GLU 118  10.849   1.327  13.498
  948   2HG   GLU 118          1HG       GLU 118   9.899   0.697  12.153
  949    H    GLU 119           H        GLU 119   8.971   4.623   9.887
  950    HA   GLU 119           HA       GLU 119  10.528   7.025  10.485
  951   1HB   GLU 119          2HB       GLU 119   9.043   6.445   7.929
  952   2HB   GLU 119          1HB       GLU 119  10.368   7.573   8.182
  953   1HG   GLU 119          2HG       GLU 119  11.622   5.334   8.865
  954   2HG   GLU 119          1HG       GLU 119  10.413   4.642   7.785
  955    H    TYR 120           H        TYR 120   8.028   6.412  11.880
  956    HA   TYR 120           HA       TYR 120   6.431   8.728  11.003
  957   1HB   TYR 120          2HB       TYR 120   5.246   6.567  10.721
  958   2HB   TYR 120          1HB       TYR 120   5.437   6.259  12.443
  959    HD1  TYR 120           1HD      TYR 120   3.348   6.366  13.427
  960    HD2  TYR 120           2HD      TYR 120   4.423   9.329  10.570
  961    HE1  TYR 120           1HE      TYR 120   1.243   7.556  13.876
  962    HE2  TYR 120           2HE      TYR 120   2.323  10.527  11.012
  963    HH   TYR 120           HH       TYR 120   0.402   9.953  13.663
  964    H    SER 121           H        SER 121   8.719   8.653  12.838
  965    HA   SER 121           HA       SER 121   7.370   9.785  15.187
  966   1HB   SER 121          2HB       SER 121   9.306   8.842  16.564
  967   2HB   SER 121          1HB       SER 121   8.100   7.681  16.007
  968    HG   SER 121           HG       SER 121  10.609   7.437  15.667
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  -1.162   3.338  16.074
    2   2H    MET   1          2HT       MET   1  -2.756   3.518  16.685
    3   3H    MET   1          3HT       MET   1  -2.507   2.997  15.068
    4    HA   MET   1           HA       MET   1  -1.490   1.497  17.370
    5   1HB   MET   1          2HB       MET   1  -4.044   2.011  17.329
    6   2HB   MET   1          1HB       MET   1  -4.081   0.882  15.982
    7   1HG   MET   1          2HG       MET   1  -2.838  -0.710  17.594
    8   2HG   MET   1          1HG       MET   1  -3.432   0.373  18.850
    9   1HE   MET   1          1HE       MET   1  -5.006  -3.218  17.871
   10   2HE   MET   1          2HE       MET   1  -5.307  -2.557  19.478
   11   3HE   MET   1          3HE       MET   1  -3.699  -2.437  18.762
   12    H    LYS   2           H        LYS   2  -0.496   2.126  14.636
   13    HA   LYS   2           HA       LYS   2   0.511   1.048  12.907
   14   1HB   LYS   2          2HB       LYS   2   0.016  -1.407  14.597
   15   2HB   LYS   2          1HB       LYS   2   1.093  -1.323  13.210
   16   1HG   LYS   2          2HG       LYS   2   1.458   0.477  15.576
   17   2HG   LYS   2          1HG       LYS   2   2.117  -1.159  15.546
   18   1HD   LYS   2          2HD       LYS   2   3.034  -0.352  13.196
   19   2HD   LYS   2          1HD       LYS   2   2.884   1.234  13.956
   20   1HE   LYS   2          2HE       LYS   2   4.162  -0.853  15.595
   21   2HE   LYS   2          1HE       LYS   2   5.064  -0.349  14.166
   22   1HZ   LYS   2          1HZ       LYS   2   5.801   1.169  15.671
   23   2HZ   LYS   2          2HZ       LYS   2   4.359   1.187  16.556
   24   3HZ   LYS   2          3HZ       LYS   2   4.459   2.015  15.085
   25    H    ARG   3           H        ARG   3  -0.854   1.343  11.227
   26    HA   ARG   3           HA       ARG   3  -2.560  -0.913  10.508
   27   1HB   ARG   3          2HB       ARG   3  -3.623   1.897  10.292
   28   2HB   ARG   3          1HB       ARG   3  -4.500   0.387  10.095
   29   1HG   ARG   3          2HG       ARG   3  -5.204   0.964  12.174
   30   2HG   ARG   3          1HG       ARG   3  -3.763   0.041  12.607
   31   1HD   ARG   3          2HD       ARG   3  -2.767   1.836  13.480
   32   2HD   ARG   3          1HD       ARG   3  -3.148   2.823  12.068
   33    HE   ARG   3           HE       ARG   3  -5.388   2.378  13.818
   34   1HH1  ARG   3          1HH1      ARG   3  -2.616   4.398  13.166
   35   2HH1  ARG   3          2HH1      ARG   3  -3.268   5.773  13.994
   36   1HH2  ARG   3          1HH2      ARG   3  -6.246   4.185  14.905
   37   2HH2  ARG   3          2HH2      ARG   3  -5.327   5.651  14.983
   38    H    VAL   4           H        VAL   4  -2.494  -1.362   8.364
   39    HA   VAL   4           HA       VAL   4  -1.272   0.657   6.595
   40    HB   VAL   4           HB       VAL   4  -0.854  -2.314   6.293
   41   1HG1  VAL   4          1HG1      VAL   4   1.095  -1.518   4.926
   42   2HG1  VAL   4          2HG1      VAL   4   0.449   0.113   5.073
   43   3HG1  VAL   4          3HG1      VAL   4  -0.489  -1.132   4.254
   44   1HG2  VAL   4          1HG2      VAL   4   1.426  -1.909   7.214
   45   2HG2  VAL   4          2HG2      VAL   4   0.138  -1.715   8.402
   46   3HG2  VAL   4          3HG2      VAL   4   0.901  -0.294   7.690
   47    H    LEU   5           H        LEU   5  -1.787   0.365   4.293
   48    HA   LEU   5           HA       LEU   5  -4.487  -0.754   3.941
   49   1HB   LEU   5          2HB       LEU   5  -4.387   1.684   3.716
   50   2HB   LEU   5          1HB       LEU   5  -3.157   1.528   2.476
   51    HG   LEU   5           HG       LEU   5  -4.799   0.348   1.038
   52   1HD1  LEU   5          1HD1      LEU   5  -7.070   0.164   1.603
   53   2HD1  LEU   5          2HD1      LEU   5  -6.895   1.219   3.003
   54   3HD1  LEU   5          3HD1      LEU   5  -6.197  -0.399   3.028
   55   1HD2  LEU   5          1HD2      LEU   5  -5.271   3.137   2.007
   56   2HD2  LEU   5          2HD2      LEU   5  -6.332   2.431   0.787
   57   3HD2  LEU   5          3HD2      LEU   5  -4.603   2.580   0.473
   58    H    VAL   6           H        VAL   6  -4.749  -2.343   2.503
   59    HA   VAL   6           HA       VAL   6  -2.478  -2.964   0.730
   60    HB   VAL   6           HB       VAL   6  -4.676  -4.827   1.639
   61   1HG1  VAL   6          1HG1      VAL   6  -3.657  -5.370  -0.547
   62   2HG1  VAL   6          2HG1      VAL   6  -3.336  -6.589   0.686
   63   3HG1  VAL   6          3HG1      VAL   6  -2.078  -5.436   0.236
   64   1HG2  VAL   6          1HG2      VAL   6  -3.237  -5.704   3.251
   65   2HG2  VAL   6          2HG2      VAL   6  -3.013  -3.960   3.394
   66   3HG2  VAL   6          3HG2      VAL   6  -1.819  -4.935   2.539
   67    H    VAL   7           H        VAL   7  -3.049  -1.650  -1.010
   68    HA   VAL   7           HA       VAL   7  -5.676  -1.940  -2.204
   69    HB   VAL   7           HB       VAL   7  -3.338  -0.376  -3.298
   70   1HG1  VAL   7          1HG1      VAL   7  -5.661  -1.006  -4.525
   71   2HG1  VAL   7          2HG1      VAL   7  -4.741   0.464  -4.844
   72   3HG1  VAL   7          3HG1      VAL   7  -6.110   0.505  -3.734
   73   1HG2  VAL   7          1HG2      VAL   7  -5.548   0.675  -1.539
   74   2HG2  VAL   7          2HG2      VAL   7  -4.149   1.558  -2.150
   75   3HG2  VAL   7          3HG2      VAL   7  -3.930   0.277  -0.959
   76    H    ASP   8           H        ASP   8  -6.148  -3.472  -3.599
   77    HA   ASP   8           HA       ASP   8  -4.340  -4.197  -5.715
   78   1HB   ASP   8          2HB       ASP   8  -3.483  -5.625  -3.921
   79   2HB   ASP   8          1HB       ASP   8  -5.100  -6.258  -3.629
   80    H    ASP   9           H        ASP   9  -5.415  -5.003  -7.469
   81    HA   ASP   9           HA       ASP   9  -8.319  -4.980  -7.297
   82   1HB   ASP   9          2HB       ASP   9  -7.252  -3.703  -9.093
   83   2HB   ASP   9          1HB       ASP   9  -6.485  -5.166  -9.699
   84    H    GLU  10           H        GLU  10  -7.475  -7.113  -5.941
   85    HA   GLU  10           HA       GLU  10  -8.495  -9.309  -7.533
   86   1HB   GLU  10          2HB       GLU  10  -5.801  -9.061  -7.493
   87   2HB   GLU  10          1HB       GLU  10  -6.043 -10.032  -6.047
   88   1HG   GLU  10          2HG       GLU  10  -7.452 -10.887  -8.503
   89   2HG   GLU  10          1HG       GLU  10  -5.702 -11.094  -8.456
   90    H    GLU  11           H        GLU  11 -10.182  -9.766  -6.249
   91    HA   GLU  11           HA       GLU  11 -11.382 -10.480  -4.454
   92   1HB   GLU  11          2HB       GLU  11  -9.113 -11.989  -4.452
   93   2HB   GLU  11          1HB       GLU  11  -9.050 -11.285  -2.842
   94   1HG   GLU  11          2HG       GLU  11 -10.207 -13.232  -2.471
   95   2HG   GLU  11          1HG       GLU  11 -11.513 -12.065  -2.675
   96    H    SER  12           H        SER  12 -11.698 -10.169  -2.051
   97    HA   SER  12           HA       SER  12 -11.543  -7.459  -1.403
   98   1HB   SER  12          2HB       SER  12 -12.430  -8.055   0.738
   99   2HB   SER  12          1HB       SER  12 -13.134  -9.170  -0.431
  100    HG   SER  12           HG       SER  12 -11.639 -10.730   0.229
  101    H    ILE  13           H        ILE  13  -9.703 -10.161   0.032
  102    HA   ILE  13           HA       ILE  13  -7.663  -8.204   0.868
  103    HB   ILE  13           HB       ILE  13  -7.932 -10.969   2.006
  104   1HG1  ILE  13          2HG1      ILE  13 -10.072  -9.684   2.301
  105   2HG1  ILE  13          1HG1      ILE  13  -9.280 -10.129   3.809
  106   1HG2  ILE  13          1HG2      ILE  13  -5.928 -10.270   2.758
  107   2HG2  ILE  13          2HG2      ILE  13  -6.922  -9.476   3.978
  108   3HG2  ILE  13          3HG2      ILE  13  -6.334  -8.563   2.590
  109   1HD1  ILE  13          1HD1      ILE  13  -8.356  -7.855   3.961
  110   2HD1  ILE  13          2HD1      ILE  13 -10.119  -7.880   3.947
  111   3HD1  ILE  13          3HD1      ILE  13  -9.232  -7.426   2.492
  112    H    THR  14           H        THR  14  -5.445  -8.993   0.887
  113    HA   THR  14           HA       THR  14  -4.877 -10.521  -1.526
  114    HB   THR  14           HB       THR  14  -2.591  -9.712  -1.277
  115    HG1  THR  14           1HG      THR  14  -2.214  -8.207   0.501
  116   1HG2  THR  14          1HG2      THR  14  -2.897  -7.337  -1.478
  117   2HG2  THR  14          2HG2      THR  14  -4.487  -7.443  -0.724
  118   3HG2  THR  14          3HG2      THR  14  -4.212  -8.168  -2.307
  119    H    SER  15           H        SER  15  -3.869 -12.494  -1.540
  120    HA   SER  15           HA       SER  15  -4.145 -14.137   0.719
  121   1HB   SER  15          2HB       SER  15  -2.756 -15.769  -0.656
  122   2HB   SER  15          1HB       SER  15  -4.234 -15.175  -1.413
  123    HG   SER  15           HG       SER  15  -1.895 -15.108  -2.465
  124    H    SER  16           H        SER  16  -2.750 -14.921   2.207
  125    HA   SER  16           HA       SER  16  -0.843 -15.241   3.416
  126   1HB   SER  16          2HB       SER  16   0.723 -13.599   1.438
  127   2HB   SER  16          1HB       SER  16   1.302 -14.874   2.511
  128    HG   SER  16           HG       SER  16  -0.065 -15.065   0.083
  129    H    LEU  17           H        LEU  17  -2.263 -12.286   2.759
  130    HA   LEU  17           HA       LEU  17  -0.477 -10.759   4.476
  131   1HB   LEU  17          2HB       LEU  17  -2.449 -10.151   2.458
  132   2HB   LEU  17          1HB       LEU  17  -2.799  -9.257   3.920
  133    HG   LEU  17           HG       LEU  17  -1.087  -8.474   1.915
  134   1HD1  LEU  17          1HD1      LEU  17  -0.859  -6.564   3.138
  135   2HD1  LEU  17          2HD1      LEU  17  -0.656  -7.430   4.661
  136   3HD1  LEU  17          3HD1      LEU  17  -2.257  -7.287   3.936
  137   1HD2  LEU  17          1HD2      LEU  17   1.138  -8.567   2.634
  138   2HD2  LEU  17          2HD2      LEU  17   0.532 -10.210   2.843
  139   3HD2  LEU  17          3HD2      LEU  17   0.688  -9.143   4.238
  140    H    SER  18           H        SER  18  -3.877 -11.782   4.451
  141    HA   SER  18           HA       SER  18  -4.751 -10.733   6.824
  142   1HB   SER  18          2HB       SER  18  -6.499 -12.282   6.757
  143   2HB   SER  18          1HB       SER  18  -5.973 -12.228   5.074
  144    HG   SER  18           HG       SER  18  -4.874 -14.144   5.378
  145    H    ALA  19           H        ALA  19  -3.076 -13.845   6.400
  146    HA   ALA  19           HA       ALA  19  -3.045 -14.561   9.122
  147   1HB   ALA  19          1HB       ALA  19  -2.646 -16.176   7.344
  148   2HB   ALA  19          2HB       ALA  19  -1.303 -16.162   8.486
  149   3HB   ALA  19          3HB       ALA  19  -1.140 -15.360   6.924
  150    H    ILE  20           H        ILE  20  -0.543 -13.040   7.100
  151    HA   ILE  20           HA       ILE  20   1.446 -12.755   9.009
  152    HB   ILE  20           HB       ILE  20   0.745 -11.007   6.654
  153   1HG1  ILE  20          2HG1      ILE  20   3.008 -12.967   7.021
  154   2HG1  ILE  20          1HG1      ILE  20   1.468 -13.381   6.275
  155   1HG2  ILE  20          1HG2      ILE  20   2.919 -10.729   8.662
  156   2HG2  ILE  20          2HG2      ILE  20   1.994  -9.487   7.818
  157   3HG2  ILE  20          3HG2      ILE  20   3.271 -10.362   6.974
  158   1HD1  ILE  20          1HD1      ILE  20   3.532 -11.442   5.283
  159   2HD1  ILE  20          2HD1      ILE  20   1.905 -11.558   4.612
  160   3HD1  ILE  20          3HD1      ILE  20   2.994 -12.943   4.530
  161    H    LEU  21           H        LEU  21  -0.606 -10.046   7.942
  162    HA   LEU  21           HA       LEU  21  -0.050  -8.242   9.903
  163   1HB   LEU  21          2HB       LEU  21  -2.756  -8.777   8.690
  164   2HB   LEU  21          1HB       LEU  21  -2.280  -7.297   9.505
  165    HG   LEU  21           HG       LEU  21  -0.439  -7.984   7.371
  166   1HD1  LEU  21          1HD1      LEU  21  -1.842  -8.639   5.790
  167   2HD1  LEU  21          2HD1      LEU  21  -2.577  -7.038   5.864
  168   3HD1  LEU  21          3HD1      LEU  21  -3.240  -8.357   6.827
  169   1HD2  LEU  21          1HD2      LEU  21  -2.161  -5.599   8.007
  170   2HD2  LEU  21          2HD2      LEU  21  -0.963  -5.649   6.714
  171   3HD2  LEU  21          3HD2      LEU  21  -0.455  -5.822   8.395
  172    H    GLU  22           H        GLU  22  -2.151 -11.040  10.136
  173    HA   GLU  22           HA       GLU  22  -3.329 -10.363  12.631
  174   1HB   GLU  22          2HB       GLU  22  -3.264 -12.712  10.863
  175   2HB   GLU  22          1HB       GLU  22  -3.537 -13.053  12.565
  176   1HG   GLU  22          2HG       GLU  22  -5.339 -11.215  12.402
  177   2HG   GLU  22          1HG       GLU  22  -5.218 -11.479  10.663
  178    H    GLU  23           H        GLU  23  -0.350 -11.911  11.696
  179    HA   GLU  23           HA       GLU  23   0.187 -12.935  14.342
  180   1HB   GLU  23          2HB       GLU  23   1.071 -14.261  12.606
  181   2HB   GLU  23          1HB       GLU  23   1.713 -12.867  11.749
  182   1HG   GLU  23          2HG       GLU  23   3.635 -12.922  12.866
  183   2HG   GLU  23          1HG       GLU  23   2.835 -13.193  14.413
  184    H    GLU  24           H        GLU  24   1.096 -10.185  12.354
  185    HA   GLU  24           HA       GLU  24   3.081  -9.226  14.192
  186   1HB   GLU  24          2HB       GLU  24   1.787  -8.062  11.743
  187   2HB   GLU  24          1HB       GLU  24   2.896  -7.129  12.737
  188   1HG   GLU  24          2HG       GLU  24   3.583  -9.765  11.464
  189   2HG   GLU  24          1HG       GLU  24   3.936  -8.192  10.750
  190    H    GLY  25           H        GLY  25  -0.290  -8.502  13.477
  191   1HA   GLY  25          2HA       GLY  25  -1.789  -7.778  15.185
  192   2HA   GLY  25          1HA       GLY  25  -0.429  -7.031  16.004
  193    H    TYR  26           H        TYR  26  -0.848  -6.656  12.579
  194    HA   TYR  26           HA       TYR  26  -1.090  -3.792  12.908
  195   1HB   TYR  26          2HB       TYR  26  -0.729  -5.609  10.539
  196   2HB   TYR  26          1HB       TYR  26  -1.100  -3.904  10.328
  197    HD1  TYR  26           1HD      TYR  26   0.480  -2.218  11.467
  198    HD2  TYR  26           2HD      TYR  26   1.480  -6.299  10.816
  199    HE1  TYR  26           1HE      TYR  26   2.863  -1.660  11.684
  200    HE2  TYR  26           2HE      TYR  26   3.868  -5.754  11.031
  201    HH   TYR  26           HH       TYR  26   5.040  -2.573  10.987
  202    H    HIS  27           H        HIS  27  -2.590  -2.883  10.934
  203    HA   HIS  27           HA       HIS  27  -5.230  -4.141  11.188
  204   1HB   HIS  27          2HB       HIS  27  -4.673  -1.981  12.666
  205   2HB   HIS  27          1HB       HIS  27  -5.107  -1.166  11.167
  206    HD1  HIS  27           1HD      HIS  27  -7.482  -2.746  10.217
  207    HD2  HIS  27           2HD      HIS  27  -6.880  -1.780  14.213
  208    HE1  HIS  27           1HE      HIS  27  -9.757  -2.852  11.284
  209    HE2  HIS  27           2HE      HIS  27  -9.380  -2.180  13.683
  210    HA   PRO  28           HA       PRO  28  -4.410  -3.187   6.790
  211   1HB   PRO  28          2HB       PRO  28  -5.205  -5.533   5.778
  212   2HB   PRO  28          1HB       PRO  28  -3.618  -5.341   6.535
  213   1HG   PRO  28          2HG       PRO  28  -6.116  -6.551   7.646
  214   2HG   PRO  28          1HG       PRO  28  -4.436  -7.090   7.818
  215   1HD   PRO  28          2HD       PRO  28  -5.831  -5.639   9.715
  216   2HD   PRO  28          1HD       PRO  28  -4.063  -5.709   9.598
  217    H    ASP  29           H        ASP  29  -5.843  -2.089   5.639
  218    HA   ASP  29           HA       ASP  29  -8.680  -2.689   6.039
  219   1HB   ASP  29          2HB       ASP  29  -7.798  -0.377   6.630
  220   2HB   ASP  29          1HB       ASP  29  -7.651  -0.120   4.893
  221    H    THR  30           H        THR  30  -6.346  -3.183   3.916
  222    HA   THR  30           HA       THR  30  -6.177  -3.620   1.680
  223    HB   THR  30           HB       THR  30  -7.845  -5.216   0.889
  224    HG1  THR  30           1HG      THR  30  -9.758  -4.420   1.585
  225   1HG2  THR  30          1HG2      THR  30  -7.310  -6.894   2.291
  226   2HG2  THR  30          2HG2      THR  30  -7.715  -5.970   3.737
  227   3HG2  THR  30          3HG2      THR  30  -6.182  -5.690   2.912
  228    H    ALA  31           H        ALA  31  -7.399  -3.623  -0.490
  229    HA   ALA  31           HA       ALA  31  -9.463  -1.686  -0.862
  230   1HB   ALA  31          1HB       ALA  31  -8.187   0.133  -0.998
  231   2HB   ALA  31          2HB       ALA  31  -7.498  -0.549  -2.472
  232   3HB   ALA  31          3HB       ALA  31  -6.708  -0.823  -0.919
  233    H    LYS  32           H        LYS  32  -9.758  -1.277  -3.304
  234    HA   LYS  32           HA       LYS  32  -9.262  -3.825  -4.683
  235   1HB   LYS  32          2HB       LYS  32 -11.260  -1.741  -5.538
  236   2HB   LYS  32          1HB       LYS  32 -11.218  -3.449  -5.955
  237   1HG   LYS  32          2HG       LYS  32 -11.787  -4.031  -3.654
  238   2HG   LYS  32          1HG       LYS  32 -11.819  -2.319  -3.229
  239   1HD   LYS  32          2HD       LYS  32 -13.668  -1.936  -4.731
  240   2HD   LYS  32          1HD       LYS  32 -13.582  -3.598  -5.317
  241   1HE   LYS  32          2HE       LYS  32 -14.653  -4.427  -3.514
  242   2HE   LYS  32          1HE       LYS  32 -13.872  -3.301  -2.405
  243   1HZ   LYS  32          1HZ       LYS  32 -16.054  -2.534  -4.263
  244   2HZ   LYS  32          2HZ       LYS  32 -15.398  -1.600  -3.015
  245   3HZ   LYS  32          3HZ       LYS  32 -16.306  -2.980  -2.650
  246    H    THR  33           H        THR  33  -9.110  -0.326  -5.089
  247    HA   THR  33           HA       THR  33  -6.913  -0.562  -6.913
  248    HB   THR  33           HB       THR  33  -9.130   0.975  -8.141
  249    HG1  THR  33           1HG      THR  33 -10.364  -0.751  -7.839
  250   1HG2  THR  33          1HG2      THR  33  -6.749  -0.508  -9.023
  251   2HG2  THR  33          2HG2      THR  33  -7.458   0.984  -9.640
  252   3HG2  THR  33          3HG2      THR  33  -8.148  -0.575 -10.092
  253    H    LEU  34           H        LEU  34  -6.717   1.873  -7.974
  254    HA   LEU  34           HA       LEU  34  -6.066   3.504  -5.763
  255   1HB   LEU  34          2HB       LEU  34  -6.374   4.358  -8.642
  256   2HB   LEU  34          1HB       LEU  34  -5.459   5.186  -7.396
  257    HG   LEU  34           HG       LEU  34  -4.797   2.433  -8.439
  258   1HD1  LEU  34          1HD1      LEU  34  -3.326   3.329  -9.932
  259   2HD1  LEU  34          2HD1      LEU  34  -3.111   4.811  -9.001
  260   3HD1  LEU  34          3HD1      LEU  34  -4.571   4.579  -9.962
  261   1HD2  LEU  34          1HD2      LEU  34  -4.119   3.227  -6.061
  262   2HD2  LEU  34          2HD2      LEU  34  -2.955   4.233  -6.924
  263   3HD2  LEU  34          3HD2      LEU  34  -2.911   2.480  -7.106
  264    H    ARG  35           H        ARG  35  -8.763   3.539  -8.048
  265    HA   ARG  35           HA       ARG  35  -9.946   5.935  -7.179
  266   1HB   ARG  35          2HB       ARG  35 -10.506   4.562  -9.259
  267   2HB   ARG  35          1HB       ARG  35 -11.470   3.541  -8.200
  268   1HG   ARG  35          2HG       ARG  35 -12.585   5.788  -7.502
  269   2HG   ARG  35          1HG       ARG  35 -11.925   6.367  -9.033
  270   1HD   ARG  35          2HD       ARG  35 -13.867   4.112  -8.584
  271   2HD   ARG  35          1HD       ARG  35 -14.133   5.612  -9.472
  272    HE   ARG  35           HE       ARG  35 -12.104   4.456 -10.827
  273   1HH1  ARG  35          1HH1      ARG  35 -15.233   3.307  -9.798
  274   2HH1  ARG  35          2HH1      ARG  35 -15.406   2.209 -11.127
  275   1HH2  ARG  35          1HH2      ARG  35 -12.328   3.014 -12.575
  276   2HH2  ARG  35          2HH2      ARG  35 -13.755   2.041 -12.701
  277    H    GLU  36           H        GLU  36 -10.534   2.563  -6.240
  278    HA   GLU  36           HA       GLU  36 -12.460   3.172  -4.249
  279   1HB   GLU  36          2HB       GLU  36 -11.693   0.886  -5.464
  280   2HB   GLU  36          1HB       GLU  36 -10.826   0.717  -3.943
  281   1HG   GLU  36          2HG       GLU  36 -12.830  -0.355  -3.534
  282   2HG   GLU  36          1HG       GLU  36 -13.085   1.244  -2.839
  283    H    ALA  37           H        ALA  37  -8.963   2.852  -4.261
  284    HA   ALA  37           HA       ALA  37  -8.647   2.870  -1.431
  285   1HB   ALA  37          1HB       ALA  37  -6.251   3.677  -2.194
  286   2HB   ALA  37          2HB       ALA  37  -6.834   3.150  -3.773
  287   3HB   ALA  37          3HB       ALA  37  -6.776   2.010  -2.429
  288    H    GLU  38           H        GLU  38  -9.079   5.322  -3.849
  289    HA   GLU  38           HA       GLU  38  -8.075   7.507  -2.324
  290   1HB   GLU  38          2HB       GLU  38  -9.732   7.206  -4.781
  291   2HB   GLU  38          1HB       GLU  38  -9.725   8.761  -3.961
  292   1HG   GLU  38          2HG       GLU  38  -7.250   8.770  -4.133
  293   2HG   GLU  38          1HG       GLU  38  -7.357   7.300  -5.099
  294    H    LYS  39           H        LYS  39 -11.303   6.174  -2.907
  295    HA   LYS  39           HA       LYS  39 -12.718   8.028  -1.331
  296   1HB   LYS  39          2HB       LYS  39 -13.916   6.650  -2.886
  297   2HB   LYS  39          1HB       LYS  39 -13.330   5.178  -2.124
  298   1HG   LYS  39          2HG       LYS  39 -14.966   7.099  -0.535
  299   2HG   LYS  39          1HG       LYS  39 -15.755   6.018  -1.685
  300   1HD   LYS  39          2HD       LYS  39 -14.210   4.232  -0.458
  301   2HD   LYS  39          1HD       LYS  39 -14.352   5.401   0.856
  302   1HE   LYS  39          2HE       LYS  39 -16.752   5.255   0.798
  303   2HE   LYS  39          1HE       LYS  39 -16.695   4.233  -0.638
  304   1HZ   LYS  39          1HZ       LYS  39 -15.484   3.452   1.953
  305   2HZ   LYS  39          2HZ       LYS  39 -15.759   2.470   0.603
  306   3HZ   LYS  39          3HZ       LYS  39 -17.065   3.043   1.513
  307    H    LYS  40           H        LYS  40 -10.967   5.094  -0.555
  308    HA   LYS  40           HA       LYS  40 -11.955   4.926   2.135
  309   1HB   LYS  40          2HB       LYS  40  -9.677   3.555   0.717
  310   2HB   LYS  40          1HB       LYS  40 -10.111   3.235   2.390
  311   1HG   LYS  40          2HG       LYS  40 -12.504   2.899   1.191
  312   2HG   LYS  40          1HG       LYS  40 -11.416   2.386  -0.099
  313   1HD   LYS  40          2HD       LYS  40 -10.342   0.811   1.432
  314   2HD   LYS  40          1HD       LYS  40 -11.419   1.332   2.729
  315   1HE   LYS  40          2HE       LYS  40 -12.366  -0.654   1.902
  316   2HE   LYS  40          1HE       LYS  40 -13.334   0.645   1.205
  317   1HZ   LYS  40          1HZ       LYS  40 -12.877  -0.903  -0.507
  318   2HZ   LYS  40          2HZ       LYS  40 -11.226  -0.950  -0.138
  319   3HZ   LYS  40          3HZ       LYS  40 -11.903   0.445  -0.812
  320    H    ILE  41           H        ILE  41  -9.010   6.148   0.584
  321    HA   ILE  41           HA       ILE  41  -7.744   6.791   3.078
  322    HB   ILE  41           HB       ILE  41  -7.089   7.583   0.242
  323   1HG1  ILE  41          2HG1      ILE  41  -5.672   5.670   2.102
  324   2HG1  ILE  41          1HG1      ILE  41  -6.871   5.164   0.917
  325   1HG2  ILE  41          1HG2      ILE  41  -5.930   8.449   2.811
  326   2HG2  ILE  41          2HG2      ILE  41  -5.949   9.255   1.244
  327   3HG2  ILE  41          3HG2      ILE  41  -4.780   7.974   1.562
  328   1HD1  ILE  41          1HD1      ILE  41  -5.110   6.663  -0.568
  329   2HD1  ILE  41          2HD1      ILE  41  -5.159   4.903  -0.468
  330   3HD1  ILE  41          3HD1      ILE  41  -4.069   5.815   0.575
  331    H    LYS  42           H        LYS  42  -9.829   8.460   0.830
  332    HA   LYS  42           HA       LYS  42  -9.348  11.103   1.392
  333   1HB   LYS  42          2HB       LYS  42 -11.064  10.015  -0.202
  334   2HB   LYS  42          1HB       LYS  42 -12.157  10.087   1.173
  335   1HG   LYS  42          2HG       LYS  42 -11.208  12.617   1.147
  336   2HG   LYS  42          1HG       LYS  42 -11.163  12.224  -0.572
  337   1HD   LYS  42          2HD       LYS  42 -13.624  11.387   0.773
  338   2HD   LYS  42          1HD       LYS  42 -13.358  13.132   0.788
  339   1HE   LYS  42          2HE       LYS  42 -13.148  11.466  -1.708
  340   2HE   LYS  42          1HE       LYS  42 -14.657  12.210  -1.180
  341   1HZ   LYS  42          1HZ       LYS  42 -13.927  13.906  -2.433
  342   2HZ   LYS  42          2HZ       LYS  42 -12.305  13.430  -2.354
  343   3HZ   LYS  42          3HZ       LYS  42 -12.997  14.293  -1.074
  344    H    GLU  43           H        GLU  43 -10.777   8.708   3.450
  345    HA   GLU  43           HA       GLU  43 -11.310  10.786   5.460
  346   1HB   GLU  43          2HB       GLU  43 -12.663   8.098   5.197
  347   2HB   GLU  43          1HB       GLU  43 -13.017   9.320   6.411
  348   1HG   GLU  43          2HG       GLU  43 -14.341  10.461   5.035
  349   2HG   GLU  43          1HG       GLU  43 -13.206  10.335   3.693
  350    H    LEU  44           H        LEU  44 -10.665   7.281   5.281
  351    HA   LEU  44           HA       LEU  44  -9.620   7.038   7.862
  352   1HB   LEU  44          2HB       LEU  44  -9.995   5.371   5.593
  353   2HB   LEU  44          1HB       LEU  44  -8.340   5.160   6.130
  354    HG   LEU  44           HG       LEU  44  -9.797   3.503   7.153
  355   1HD1  LEU  44          1HD1      LEU  44  -8.121   3.793   8.642
  356   2HD1  LEU  44          2HD1      LEU  44  -9.435   4.419   9.640
  357   3HD1  LEU  44          3HD1      LEU  44  -8.384   5.533   8.766
  358   1HD2  LEU  44          1HD2      LEU  44 -11.885   4.758   7.098
  359   2HD2  LEU  44          2HD2      LEU  44 -11.263   5.864   8.323
  360   3HD2  LEU  44          3HD2      LEU  44 -11.547   4.172   8.728
  361    H    PHE  45           H        PHE  45  -7.724   7.526   8.755
  362    HA   PHE  45           HA       PHE  45  -5.702   8.823   7.129
  363   1HB   PHE  45          2HB       PHE  45  -6.554   9.547   9.485
  364   2HB   PHE  45          1HB       PHE  45  -5.440   8.320  10.078
  365    HD1  PHE  45           1HD      PHE  45  -5.793  11.668   8.877
  366    HD2  PHE  45           2HD      PHE  45  -2.999   8.509   9.440
  367    HE1  PHE  45           1HE      PHE  45  -3.943  13.283   8.722
  368    HE2  PHE  45           2HE      PHE  45  -1.144  10.117   9.287
  369    HZ   PHE  45           HZ       PHE  45  -1.614  12.507   8.928
  370    H    PHE  46           H        PHE  46  -5.052   6.930   5.943
  371    HA   PHE  46           HA       PHE  46  -3.857   4.710   7.320
  372   1HB   PHE  46          2HB       PHE  46  -4.035   5.518   4.424
  373   2HB   PHE  46          1HB       PHE  46  -3.096   4.123   4.941
  374    HD1  PHE  46           1HD      PHE  46  -6.275   5.286   3.941
  375    HD2  PHE  46           2HD      PHE  46  -4.352   2.351   6.347
  376    HE1  PHE  46           1HE      PHE  46  -8.309   3.905   3.869
  377    HE2  PHE  46           2HE      PHE  46  -6.383   0.961   6.279
  378    HZ   PHE  46           HZ       PHE  46  -8.365   1.743   5.042
  379    HA   PRO  47           HA       PRO  47   0.102   6.832   7.621
  380   1HB   PRO  47          2HB       PRO  47   1.336   5.046   9.193
  381   2HB   PRO  47          1HB       PRO  47   0.068   6.106   9.824
  382   1HG   PRO  47          2HG       PRO  47  -0.101   3.241   8.989
  383   2HG   PRO  47          1HG       PRO  47  -0.813   4.036  10.405
  384   1HD   PRO  47          2HD       PRO  47  -2.198   3.485   8.099
  385   2HD   PRO  47          1HD       PRO  47  -2.619   4.795   9.218
  386    H    VAL  48           H        VAL  48  -0.504   3.603   6.477
  387    HA   VAL  48           HA       VAL  48   1.808   3.781   4.710
  388    HB   VAL  48           HB       VAL  48   1.241   1.243   6.218
  389   1HG1  VAL  48          1HG1      VAL  48   2.713   1.654   3.981
  390   2HG1  VAL  48          2HG1      VAL  48   3.020   0.372   5.153
  391   3HG1  VAL  48          3HG1      VAL  48   3.935   1.878   5.233
  392   1HG2  VAL  48          1HG2      VAL  48   1.763   2.825   7.892
  393   2HG2  VAL  48          2HG2      VAL  48   3.088   3.491   6.937
  394   3HG2  VAL  48          3HG2      VAL  48   3.213   1.864   7.607
  395    H    ILE  49           H        ILE  49   1.261   3.223   2.703
  396    HA   ILE  49           HA       ILE  49  -1.147   1.582   2.283
  397    HB   ILE  49           HB       ILE  49   0.024   3.453   0.233
  398   1HG1  ILE  49          2HG1      ILE  49  -0.532   4.750   2.270
  399   2HG1  ILE  49          1HG1      ILE  49  -1.581   5.151   0.913
  400   1HG2  ILE  49          1HG2      ILE  49  -2.374   1.760   0.475
  401   2HG2  ILE  49          2HG2      ILE  49  -1.458   2.238  -0.954
  402   3HG2  ILE  49          3HG2      ILE  49  -2.624   3.352  -0.240
  403   1HD1  ILE  49          1HD1      ILE  49  -2.256   3.420   3.275
  404   2HD1  ILE  49          2HD1      ILE  49  -3.299   3.646   1.872
  405   3HD1  ILE  49          3HD1      ILE  49  -2.896   5.020   2.901
  406    H    VAL  50           H        VAL  50  -1.077   0.025   0.553
  407    HA   VAL  50           HA       VAL  50   1.574  -0.548  -0.541
  408    HB   VAL  50           HB       VAL  50  -0.122  -2.572   0.926
  409   1HG1  VAL  50          1HG1      VAL  50   2.278  -3.780   0.279
  410   2HG1  VAL  50          2HG1      VAL  50   1.844  -2.905  -1.189
  411   3HG1  VAL  50          3HG1      VAL  50   0.721  -4.074  -0.497
  412   1HG2  VAL  50          1HG2      VAL  50   2.630  -2.452   1.713
  413   2HG2  VAL  50          2HG2      VAL  50   1.182  -2.193   2.681
  414   3HG2  VAL  50          3HG2      VAL  50   1.911  -0.846   1.809
  415    H    LEU  51           H        LEU  51   0.941   0.004  -2.560
  416    HA   LEU  51           HA       LEU  51  -1.492  -0.944  -3.736
  417   1HB   LEU  51          2HB       LEU  51  -0.410   1.206  -4.342
  418   2HB   LEU  51          1HB       LEU  51   0.900   0.304  -5.079
  419    HG   LEU  51           HG       LEU  51  -0.727  -0.689  -6.673
  420   1HD1  LEU  51          1HD1      LEU  51  -2.762  -0.561  -5.441
  421   2HD1  LEU  51          2HD1      LEU  51  -2.938   0.460  -6.869
  422   3HD1  LEU  51          3HD1      LEU  51  -2.629   1.192  -5.294
  423   1HD2  LEU  51          1HD2      LEU  51  -0.335   2.278  -6.523
  424   2HD2  LEU  51          2HD2      LEU  51  -1.210   1.537  -7.863
  425   3HD2  LEU  51          3HD2      LEU  51   0.472   1.101  -7.558
  426    H    ASP  52           H        ASP  52  -1.585  -2.192  -5.711
  427    HA   ASP  52           HA       ASP  52   0.609  -3.970  -6.335
  428   1HB   ASP  52          2HB       ASP  52  -0.978  -4.866  -4.359
  429   2HB   ASP  52          1HB       ASP  52  -1.925  -5.404  -5.742
  430    H    VAL  53           H        VAL  53   0.328  -2.722  -8.285
  431    HA   VAL  53           HA       VAL  53  -2.009  -2.597  -9.793
  432    HB   VAL  53           HB       VAL  53  -0.599  -2.032 -11.700
  433   1HG1  VAL  53          1HG1      VAL  53  -0.806  -0.121 -10.500
  434   2HG1  VAL  53          2HG1      VAL  53   0.934  -0.338 -10.313
  435   3HG1  VAL  53          3HG1      VAL  53  -0.160  -0.845  -9.027
  436   1HG2  VAL  53          1HG2      VAL  53   1.432  -2.892 -11.970
  437   2HG2  VAL  53          2HG2      VAL  53   1.294  -3.697 -10.408
  438   3HG2  VAL  53          3HG2      VAL  53   1.989  -2.080 -10.507
  439    H    TRP  54           H        TRP  54  -2.956  -4.716  -9.671
  440    HA   TRP  54           HA       TRP  54  -1.706  -7.027 -10.706
  441   1HB   TRP  54          2HB       TRP  54  -3.592  -7.399  -9.329
  442   2HB   TRP  54          1HB       TRP  54  -4.588  -6.269 -10.239
  443    HD1  TRP  54           HD       TRP  54  -2.634  -9.454 -11.331
  444    HE1  TRP  54           1HE      TRP  54  -4.245 -10.932 -12.684
  445    HE3  TRP  54           3HE      TRP  54  -6.849  -6.577 -11.012
  446    HZ2  TRP  54           2HZ      TRP  54  -6.945 -10.893 -13.506
  447    HZ3  TRP  54           3HZ      TRP  54  -8.903  -7.369 -12.109
  448    HH2  TRP  54           HH       TRP  54  -8.949  -9.482 -13.331
  449    H    MET  55           H        MET  55  -4.660  -5.935 -12.268
  450    HA   MET  55           HA       MET  55  -3.271  -5.353 -14.749
  451   1HB   MET  55          2HB       MET  55  -3.733  -7.860 -14.630
  452   2HB   MET  55          1HB       MET  55  -5.439  -7.447 -14.739
  453   1HG   MET  55          2HG       MET  55  -4.704  -8.005 -16.917
  454   2HG   MET  55          1HG       MET  55  -4.936  -6.258 -16.873
  455   1HE   MET  55          1HE       MET  55  -2.964  -6.924 -19.433
  456   2HE   MET  55          2HE       MET  55  -2.106  -5.463 -18.946
  457   3HE   MET  55          3HE       MET  55  -3.848  -5.587 -18.698
  458    HA   PRO  56           HA       PRO  56  -7.322  -3.124 -14.187
  459   1HB   PRO  56          2HB       PRO  56  -6.582  -0.935 -12.754
  460   2HB   PRO  56          1HB       PRO  56  -7.100  -2.450 -12.014
  461   1HG   PRO  56          2HG       PRO  56  -4.448  -1.246 -12.071
  462   2HG   PRO  56          1HG       PRO  56  -5.040  -2.593 -11.091
  463   1HD   PRO  56          2HD       PRO  56  -3.474  -2.654 -13.550
  464   2HD   PRO  56          1HD       PRO  56  -3.833  -3.968 -12.417
  465    H    ASP  57           H        ASP  57  -4.955  -0.519 -13.917
  466    HA   ASP  57           HA       ASP  57  -4.640  -0.064 -16.696
  467   1HB   ASP  57          2HB       ASP  57  -7.044   0.537 -16.437
  468   2HB   ASP  57          1HB       ASP  57  -6.569   1.799 -15.306
  469    H    GLY  58           H        GLY  58  -5.167   2.125 -13.923
  470   1HA   GLY  58          2HA       GLY  58  -3.094   3.878 -14.464
  471   2HA   GLY  58          1HA       GLY  58  -3.751   3.587 -12.861
  472    H    ASP  59           H        ASP  59  -1.053   4.223 -13.378
  473    HA   ASP  59           HA       ASP  59   0.305   1.680 -12.813
  474   1HB   ASP  59          2HB       ASP  59   1.696   4.238 -13.581
  475   2HB   ASP  59          1HB       ASP  59   2.310   2.591 -13.676
  476    H    GLY  60           H        GLY  60  -1.208   3.438 -10.956
  477   1HA   GLY  60          2HA       GLY  60  -1.052   4.139  -8.783
  478   2HA   GLY  60          1HA       GLY  60   0.384   3.137  -8.687
  479    H    VAL  61           H        VAL  61   0.710   5.543 -11.073
  480    HA   VAL  61           HA       VAL  61   2.616   6.951  -9.428
  481    HB   VAL  61           HB       VAL  61   1.805   7.513 -12.284
  482   1HG1  VAL  61          1HG1      VAL  61   4.380   8.158 -10.880
  483   2HG1  VAL  61          2HG1      VAL  61   3.028   9.283 -11.001
  484   3HG1  VAL  61          3HG1      VAL  61   3.835   8.716 -12.463
  485   1HG2  VAL  61          1HG2      VAL  61   4.126   5.841 -11.339
  486   2HG2  VAL  61          2HG2      VAL  61   3.612   6.123 -13.002
  487   3HG2  VAL  61          3HG2      VAL  61   2.598   5.174 -11.915
  488    H    ASN  62           H        ASN  62  -0.419   7.686 -11.136
  489    HA   ASN  62           HA       ASN  62  -0.514  10.401 -10.410
  490   1HB   ASN  62          2HB       ASN  62  -2.892  10.158 -11.109
  491   2HB   ASN  62          1HB       ASN  62  -1.747   9.586 -12.305
  492   1HD2  ASN  62          1HD2      ASN  62  -2.770   8.008 -13.327
  493   2HD2  ASN  62          2HD2      ASN  62  -3.520   6.646 -12.575
  494    H    PHE  63           H        PHE  63  -0.995   7.551  -8.641
  495    HA   PHE  63           HA       PHE  63  -2.905   8.665  -6.773
  496   1HB   PHE  63          2HB       PHE  63  -2.823   6.226  -7.492
  497   2HB   PHE  63          1HB       PHE  63  -1.374   6.078  -6.507
  498    HD1  PHE  63           1HD      PHE  63  -4.356   8.095  -5.660
  499    HD2  PHE  63           2HD      PHE  63  -2.148   4.534  -4.911
  500    HE1  PHE  63           1HE      PHE  63  -5.750   7.648  -3.686
  501    HE2  PHE  63           2HE      PHE  63  -3.542   4.083  -2.936
  502    HZ   PHE  63           HZ       PHE  63  -5.348   5.643  -2.325
  503    H    ILE  64           H        ILE  64   0.539   8.242  -7.045
  504    HA   ILE  64           HA       ILE  64   1.431   8.275  -4.454
  505    HB   ILE  64           HB       ILE  64   2.675  10.021  -6.575
  506   1HG1  ILE  64          2HG1      ILE  64   2.332   7.924  -7.674
  507   2HG1  ILE  64          1HG1      ILE  64   4.016   7.966  -7.172
  508   1HG2  ILE  64          1HG2      ILE  64   4.300   8.389  -4.738
  509   2HG2  ILE  64          2HG2      ILE  64   3.394   9.713  -4.006
  510   3HG2  ILE  64          3HG2      ILE  64   4.537  10.042  -5.308
  511   1HD1  ILE  64          1HD1      ILE  64   1.782   6.491  -5.807
  512   2HD1  ILE  64          2HD1      ILE  64   3.452   6.563  -5.244
  513   3HD1  ILE  64          3HD1      ILE  64   3.072   5.789  -6.783
  514    H    ASP  65           H        ASP  65   0.448  11.085  -6.392
  515    HA   ASP  65           HA       ASP  65   0.999  13.011  -4.398
  516   1HB   ASP  65          2HB       ASP  65   0.306  13.146  -7.027
  517   2HB   ASP  65          1HB       ASP  65  -1.213  13.606  -6.266
  518    H    PHE  66           H        PHE  66  -1.929  11.211  -5.248
  519    HA   PHE  66           HA       PHE  66  -3.695  12.492  -3.500
  520   1HB   PHE  66          2HB       PHE  66  -4.321  10.855  -5.297
  521   2HB   PHE  66          1HB       PHE  66  -3.753   9.565  -4.242
  522    HD1  PHE  66           1HD      PHE  66  -4.877   9.271  -1.994
  523    HD2  PHE  66           2HD      PHE  66  -6.478  11.718  -5.086
  524    HE1  PHE  66           1HE      PHE  66  -7.088   9.181  -0.917
  525    HE2  PHE  66           2HE      PHE  66  -8.691  11.633  -4.015
  526    HZ   PHE  66           HZ       PHE  66  -8.997  10.363  -1.927
  527    H    ILE  67           H        ILE  67  -1.237  10.089  -2.968
  528    HA   ILE  67           HA       ILE  67  -2.066   9.185  -0.426
  529    HB   ILE  67           HB       ILE  67   0.796   9.366  -1.367
  530   1HG1  ILE  67          2HG1      ILE  67  -0.110   8.224  -3.162
  531   2HG1  ILE  67          1HG1      ILE  67   0.266   6.898  -2.072
  532   1HG2  ILE  67          1HG2      ILE  67   1.125   8.499   0.663
  533   2HG2  ILE  67          2HG2      ILE  67   0.464   7.008  -0.008
  534   3HG2  ILE  67          3HG2      ILE  67  -0.583   8.118   0.877
  535   1HD1  ILE  67          1HD1      ILE  67  -1.827   6.275  -2.595
  536   2HD1  ILE  67          2HD1      ILE  67  -2.336   7.916  -2.992
  537   3HD1  ILE  67          3HD1      ILE  67  -2.250   7.403  -1.307
  538    H    LYS  68           H        LYS  68   0.233  11.718  -1.416
  539    HA   LYS  68           HA       LYS  68   0.616  12.576   1.317
  540   1HB   LYS  68          2HB       LYS  68   1.556  13.754  -1.303
  541   2HB   LYS  68          1HB       LYS  68   2.011  14.364   0.282
  542   1HG   LYS  68          2HG       LYS  68   2.627  11.685   0.438
  543   2HG   LYS  68          1HG       LYS  68   3.051  12.108  -1.221
  544   1HD   LYS  68          2HD       LYS  68   3.904  14.043   0.825
  545   2HD   LYS  68          1HD       LYS  68   4.684  12.462   0.914
  546   1HE   LYS  68          2HE       LYS  68   5.790  12.749  -1.040
  547   2HE   LYS  68          1HE       LYS  68   4.474  13.664  -1.774
  548   1HZ   LYS  68          1HZ       LYS  68   5.239  15.422   0.007
  549   2HZ   LYS  68          2HZ       LYS  68   5.992  15.310  -1.504
  550   3HZ   LYS  68          3HZ       LYS  68   6.712  14.605  -0.144
  551    H    GLU  69           H        GLU  69  -1.654  13.189  -1.133
  552    HA   GLU  69           HA       GLU  69  -2.246  15.909  -0.518
  553   1HB   GLU  69          2HB       GLU  69  -2.820  14.689  -2.662
  554   2HB   GLU  69          1HB       GLU  69  -4.111  13.901  -1.767
  555   1HG   GLU  69          2HG       GLU  69  -5.148  16.043  -1.316
  556   2HG   GLU  69          1HG       GLU  69  -3.826  16.874  -2.134
  557    H    ASN  70           H        ASN  70  -3.499  12.790   0.539
  558    HA   ASN  70           HA       ASN  70  -5.016  14.191   2.641
  559   1HB   ASN  70          2HB       ASN  70  -5.864  11.489   1.667
  560   2HB   ASN  70          1HB       ASN  70  -6.825  12.749   2.433
  561   1HD2  ASN  70          1HD2      ASN  70  -4.996  12.064  -0.516
  562   2HD2  ASN  70          2HD2      ASN  70  -6.048  12.926  -1.579
  563    H    SER  71           H        SER  71  -2.279  12.664   2.295
  564    HA   SER  71           HA       SER  71  -2.309  11.588   4.964
  565   1HB   SER  71          2HB       SER  71  -2.546   9.833   2.658
  566   2HB   SER  71          1HB       SER  71  -1.103   9.472   3.604
  567    HG   SER  71           HG       SER  71  -2.339   8.635   5.070
  568    HA   PRO  72           HA       PRO  72   1.672  13.480   3.407
  569   1HB   PRO  72          2HB       PRO  72   1.417  15.236   5.731
  570   2HB   PRO  72          1HB       PRO  72   1.615  15.663   4.030
  571   1HG   PRO  72          2HG       PRO  72  -0.697  16.076   5.363
  572   2HG   PRO  72          1HG       PRO  72  -0.651  15.685   3.635
  573   1HD   PRO  72          2HD       PRO  72  -1.245  13.901   5.966
  574   2HD   PRO  72          1HD       PRO  72  -2.045  13.989   4.382
  575    H    ASP  73           H        ASP  73   0.468  12.262   6.363
  576    HA   ASP  73           HA       ASP  73   3.189  11.788   7.368
  577   1HB   ASP  73          2HB       ASP  73   1.628  13.003   8.880
  578   2HB   ASP  73          1HB       ASP  73   0.580  11.589   8.881
  579    H    SER  74           H        SER  74   1.880  10.256   5.249
  580    HA   SER  74           HA       SER  74   1.629   7.638   6.572
  581   1HB   SER  74          2HB       SER  74  -0.374   8.343   5.318
  582   2HB   SER  74          1HB       SER  74   0.602   8.499   3.858
  583    HG   SER  74           HG       SER  74   0.052   6.484   3.587
  584    H    VAL  75           H        VAL  75   1.978   6.066   4.250
  585    HA   VAL  75           HA       VAL  75   4.555   6.770   3.126
  586    HB   VAL  75           HB       VAL  75   4.297   4.181   4.652
  587   1HG1  VAL  75          1HG1      VAL  75   6.625   5.525   3.264
  588   2HG1  VAL  75          2HG1      VAL  75   5.747   4.110   2.683
  589   3HG1  VAL  75          3HG1      VAL  75   6.701   4.009   4.163
  590   1HG2  VAL  75          1HG2      VAL  75   4.401   5.877   6.299
  591   2HG2  VAL  75          2HG2      VAL  75   5.608   6.789   5.392
  592   3HG2  VAL  75          3HG2      VAL  75   6.043   5.252   6.138
  593    H    VAL  76           H        VAL  76   4.820   5.999   1.155
  594    HA   VAL  76           HA       VAL  76   2.834   4.054   0.176
  595    HB   VAL  76           HB       VAL  76   4.383   5.787  -1.700
  596   1HG1  VAL  76          1HG1      VAL  76   2.565   3.843  -2.103
  597   2HG1  VAL  76          2HG1      VAL  76   2.819   5.191  -3.211
  598   3HG1  VAL  76          3HG1      VAL  76   1.505   5.250  -2.035
  599   1HG2  VAL  76          1HG2      VAL  76   2.415   6.725   0.274
  600   2HG2  VAL  76          2HG2      VAL  76   2.109   7.229  -1.388
  601   3HG2  VAL  76          3HG2      VAL  76   3.646   7.620  -0.618
  602    H    ILE  77           H        ILE  77   3.625   2.083  -0.019
  603    HA   ILE  77           HA       ILE  77   6.447   1.683  -0.652
  604    HB   ILE  77           HB       ILE  77   4.334  -0.371   0.024
  605   1HG1  ILE  77          2HG1      ILE  77   4.779   1.222   1.871
  606   2HG1  ILE  77          1HG1      ILE  77   5.307  -0.415   2.253
  607   1HG2  ILE  77          1HG2      ILE  77   6.293  -1.178  -1.295
  608   2HG2  ILE  77          2HG2      ILE  77   6.129  -1.926   0.293
  609   3HG2  ILE  77          3HG2      ILE  77   7.333  -0.664   0.033
  610   1HD1  ILE  77          1HD1      ILE  77   7.582   0.595   1.231
  611   2HD1  ILE  77          2HD1      ILE  77   7.161   0.642   2.942
  612   3HD1  ILE  77          3HD1      ILE  77   6.867   2.051   1.924
  613    H    VAL  78           H        VAL  78   3.228   0.930  -1.914
  614    HA   VAL  78           HA       VAL  78   2.520   0.096  -3.926
  615    HB   VAL  78           HB       VAL  78   4.785   1.813  -4.965
  616   1HG1  VAL  78          1HG1      VAL  78   2.155   1.182  -6.290
  617   2HG1  VAL  78          2HG1      VAL  78   3.623   0.247  -6.572
  618   3HG1  VAL  78          3HG1      VAL  78   3.572   1.957  -6.996
  619   1HG2  VAL  78          1HG2      VAL  78   2.218   2.481  -3.691
  620   2HG2  VAL  78          2HG2      VAL  78   2.568   3.345  -5.188
  621   3HG2  VAL  78          3HG2      VAL  78   3.698   3.430  -3.835
  622    H    ILE  79           H        ILE  79   3.396  -2.041  -3.223
  623    HA   ILE  79           HA       ILE  79   5.859  -3.053  -4.010
  624    HB   ILE  79           HB       ILE  79   3.275  -4.590  -3.803
  625   1HG1  ILE  79          2HG1      ILE  79   5.353  -3.892  -1.720
  626   2HG1  ILE  79          1HG1      ILE  79   3.677  -3.357  -1.757
  627   1HG2  ILE  79          1HG2      ILE  79   5.643  -6.013  -3.006
  628   2HG2  ILE  79          2HG2      ILE  79   5.812  -5.416  -4.657
  629   3HG2  ILE  79          3HG2      ILE  79   4.441  -6.437  -4.223
  630   1HD1  ILE  79          1HD1      ILE  79   3.762  -5.054  -0.151
  631   2HD1  ILE  79          2HD1      ILE  79   4.746  -6.095  -1.179
  632   3HD1  ILE  79          3HD1      ILE  79   3.053  -5.809  -1.579
  633    H    THR  80           H        THR  80   3.337  -4.796  -5.552
  634    HA   THR  80           HA       THR  80   2.868  -5.297  -7.719
  635    HB   THR  80           HB       THR  80   2.857  -3.615  -9.297
  636    HG1  THR  80           1HG      THR  80   4.665  -2.754  -9.844
  637   1HG2  THR  80          1HG2      THR  80   2.095  -2.768  -6.896
  638   2HG2  THR  80          2HG2      THR  80   2.069  -1.741  -8.329
  639   3HG2  THR  80          3HG2      THR  80   3.410  -1.630  -7.189
  640    H    GLY  81           H        GLY  81   4.299  -5.128 -10.047
  641   1HA   GLY  81          2HA       GLY  81   6.614  -5.469 -10.812
  642   2HA   GLY  81          1HA       GLY  81   6.872  -6.402  -9.346
  643    H    HIS  82           H        HIS  82   7.555  -8.217 -10.512
  644    HA   HIS  82           HA       HIS  82   7.306 -10.241 -11.516
  645   1HB   HIS  82          2HB       HIS  82   5.020  -9.881 -10.000
  646   2HB   HIS  82          1HB       HIS  82   4.383 -10.304 -11.587
  647    HD1  HIS  82           1HD      HIS  82   4.007 -12.728 -11.798
  648    HD2  HIS  82           2HD      HIS  82   7.243 -11.891  -9.330
  649    HE1  HIS  82           1HE      HIS  82   4.866 -14.965 -11.034
  650    HE2  HIS  82           2HE      HIS  82   6.776 -14.431  -9.481
  651    H    GLY  83           H        GLY  83   7.620  -8.079 -13.209
  652   1HA   GLY  83          2HA       GLY  83   6.907  -9.130 -15.689
  653   2HA   GLY  83          1HA       GLY  83   5.691  -7.932 -15.274
  654    H    SER  84           H        SER  84   6.796  -5.825 -14.350
  655    HA   SER  84           HA       SER  84   9.116  -5.167 -16.034
  656   1HB   SER  84          2HB       SER  84   6.698  -3.390 -15.632
  657   2HB   SER  84          1HB       SER  84   8.122  -3.010 -16.599
  658    HG   SER  84           HG       SER  84   7.545  -4.553 -18.060
  659    H    VAL  85           H        VAL  85   9.624  -2.637 -15.331
  660    HA   VAL  85           HA       VAL  85   9.516  -2.353 -12.445
  661    HB   VAL  85           HB       VAL  85  12.030  -2.010 -12.343
  662   1HG1  VAL  85          1HG1      VAL  85  11.628  -4.866 -12.953
  663   2HG1  VAL  85          2HG1      VAL  85  10.513  -4.159 -11.784
  664   3HG1  VAL  85          3HG1      VAL  85  12.252  -4.091 -11.496
  665   1HG2  VAL  85          1HG2      VAL  85  13.425  -2.943 -13.997
  666   2HG2  VAL  85          2HG2      VAL  85  12.232  -1.985 -14.875
  667   3HG2  VAL  85          3HG2      VAL  85  12.073  -3.740 -14.802
  668    H    ASP  86           H        ASP  86   8.599  -0.876 -14.827
  669    HA   ASP  86           HA       ASP  86  10.256   1.521 -14.829
  670   1HB   ASP  86          2HB       ASP  86   7.667   0.969 -16.302
  671   2HB   ASP  86          1HB       ASP  86   8.750   2.330 -16.573
  672    H    THR  87           H        THR  87   6.747   0.865 -14.303
  673    HA   THR  87           HA       THR  87   6.012   3.286 -13.281
  674    HB   THR  87           HB       THR  87   4.561   1.220 -13.672
  675    HG1  THR  87           1HG      THR  87   3.096   1.888 -12.001
  676   1HG2  THR  87          1HG2      THR  87   6.026  -0.006 -11.773
  677   2HG2  THR  87          2HG2      THR  87   4.376  -0.459 -12.197
  678   3HG2  THR  87          3HG2      THR  87   4.675   0.584 -10.808
  679    H    ALA  88           H        ALA  88   7.842   0.757 -11.737
  680    HA   ALA  88           HA       ALA  88   7.711   1.565  -9.076
  681   1HB   ALA  88          1HB       ALA  88  10.173   0.434 -10.383
  682   2HB   ALA  88          2HB       ALA  88   8.754  -0.546 -10.015
  683   3HB   ALA  88          3HB       ALA  88   9.641   0.245  -8.714
  684    H    VAL  89           H        VAL  89  10.274   2.254 -11.429
  685    HA   VAL  89           HA       VAL  89  11.590   4.174  -9.873
  686    HB   VAL  89           HB       VAL  89  12.751   4.810 -11.929
  687   1HG1  VAL  89          1HG1      VAL  89  13.252   2.657 -10.713
  688   2HG1  VAL  89          2HG1      VAL  89  13.780   2.728 -12.394
  689   3HG1  VAL  89          3HG1      VAL  89  12.322   1.833 -11.965
  690   1HG2  VAL  89          1HG2      VAL  89  12.081   4.285 -14.064
  691   2HG2  VAL  89          2HG2      VAL  89  10.522   4.545 -13.285
  692   3HG2  VAL  89          3HG2      VAL  89  11.117   2.906 -13.539
  693    H    LYS  90           H        LYS  90   8.762   4.368 -11.851
  694    HA   LYS  90           HA       LYS  90   8.825   7.233 -12.156
  695   1HB   LYS  90          2HB       LYS  90   7.785   5.911 -13.889
  696   2HB   LYS  90          1HB       LYS  90   6.687   5.178 -12.729
  697   1HG   LYS  90          2HG       LYS  90   5.521   7.230 -12.421
  698   2HG   LYS  90          1HG       LYS  90   6.728   8.120 -13.351
  699   1HD   LYS  90          2HD       LYS  90   5.384   5.844 -14.695
  700   2HD   LYS  90          1HD       LYS  90   4.419   7.293 -14.405
  701   1HE   LYS  90          2HE       LYS  90   5.303   8.102 -16.285
  702   2HE   LYS  90          1HE       LYS  90   6.807   8.282 -15.383
  703   1HZ   LYS  90          1HZ       LYS  90   7.380   7.069 -17.271
  704   2HZ   LYS  90          2HZ       LYS  90   6.005   6.087 -17.191
  705   3HZ   LYS  90          3HZ       LYS  90   7.252   5.891 -16.064
  706    H    ALA  91           H        ALA  91   7.361   4.907  -9.987
  707    HA   ALA  91           HA       ALA  91   5.766   6.970  -8.685
  708   1HB   ALA  91          1HB       ALA  91   4.884   5.116  -7.325
  709   2HB   ALA  91          2HB       ALA  91   5.984   4.011  -8.149
  710   3HB   ALA  91          3HB       ALA  91   4.708   4.824  -9.055
  711    H    ILE  92           H        ILE  92   8.605   4.983  -8.082
  712    HA   ILE  92           HA       ILE  92   8.835   5.852  -5.346
  713    HB   ILE  92           HB       ILE  92  10.685   4.462  -5.130
  714   1HG1  ILE  92          2HG1      ILE  92  11.055   4.665  -8.126
  715   2HG1  ILE  92          1HG1      ILE  92  12.098   5.349  -6.885
  716   1HG2  ILE  92          1HG2      ILE  92   9.990   2.535  -6.986
  717   2HG2  ILE  92          2HG2      ILE  92   8.511   3.468  -6.779
  718   3HG2  ILE  92          3HG2      ILE  92   9.293   2.740  -5.381
  719   1HD1  ILE  92          1HD1      ILE  92  13.018   3.315  -7.932
  720   2HD1  ILE  92          2HD1      ILE  92  11.645   2.403  -7.305
  721   3HD1  ILE  92          3HD1      ILE  92  12.788   3.152  -6.192
  722    H    LYS  93           H        LYS  93  10.674   7.036  -4.510
  723    HA   LYS  93           HA       LYS  93  12.171   8.753  -4.466
  724   1HB   LYS  93          2HB       LYS  93  12.581   7.601  -7.041
  725   2HB   LYS  93          1HB       LYS  93  12.620   9.349  -7.218
  726   1HG   LYS  93          2HG       LYS  93  14.184   9.120  -5.071
  727   2HG   LYS  93          1HG       LYS  93  14.477   7.540  -5.800
  728   1HD   LYS  93          2HD       LYS  93  15.002   8.704  -7.942
  729   2HD   LYS  93          1HD       LYS  93  14.869  10.241  -7.084
  730   1HE   LYS  93          2HE       LYS  93  16.782   8.020  -6.372
  731   2HE   LYS  93          1HE       LYS  93  17.203   9.454  -7.309
  732   1HZ   LYS  93          1HZ       LYS  93  17.392  10.657  -5.464
  733   2HZ   LYS  93          2HZ       LYS  93  17.328   9.208  -4.595
  734   3HZ   LYS  93          3HZ       LYS  93  15.918  10.111  -4.840
  735    H    LYS  94           H        LYS  94   9.132   8.887  -5.489
  736    HA   LYS  94           HA       LYS  94   9.192  11.809  -5.786
  737   1HB   LYS  94          2HB       LYS  94   7.977   9.797  -7.537
  738   2HB   LYS  94          1HB       LYS  94   6.909  11.122  -7.097
  739   1HG   LYS  94          2HG       LYS  94   9.523  12.084  -7.862
  740   2HG   LYS  94          1HG       LYS  94   8.793  11.100  -9.131
  741   1HD   LYS  94          2HD       LYS  94   6.793  12.478  -9.081
  742   2HD   LYS  94          1HD       LYS  94   7.461  13.432  -7.754
  743   1HE   LYS  94          2HE       LYS  94   9.451  13.646  -9.566
  744   2HE   LYS  94          1HE       LYS  94   8.058  13.507 -10.639
  745   1HZ   LYS  94          1HZ       LYS  94   8.868  15.810  -9.644
  746   2HZ   LYS  94          2HZ       LYS  94   7.813  15.357  -8.402
  747   3HZ   LYS  94          3HZ       LYS  94   7.243  15.496  -9.988
  748    H    GLY  95           H        GLY  95   8.790   9.998  -3.472
  749   1HA   GLY  95          2HA       GLY  95   7.339  11.019  -1.680
  750   2HA   GLY  95          1HA       GLY  95   6.011  10.727  -2.793
  751    H    ALA  96           H        ALA  96   7.523   8.144  -3.557
  752    HA   ALA  96           HA       ALA  96   6.161   6.503  -1.602
  753   1HB   ALA  96          1HB       ALA  96   6.136   4.877  -3.166
  754   2HB   ALA  96          2HB       ALA  96   7.795   5.194  -3.676
  755   3HB   ALA  96          3HB       ALA  96   6.482   6.217  -4.260
  756    H    TYR  97           H        TYR  97   7.647   4.243  -1.458
  757    HA   TYR  97           HA       TYR  97  10.157   5.096  -0.173
  758   1HB   TYR  97          2HB       TYR  97   8.428   4.607   1.496
  759   2HB   TYR  97          1HB       TYR  97   8.206   3.007   0.803
  760    HD1  TYR  97           1HD      TYR  97  10.818   5.162   2.367
  761    HD2  TYR  97           2HD      TYR  97   9.402   1.214   1.662
  762    HE1  TYR  97           1HE      TYR  97  12.551   4.276   3.870
  763    HE2  TYR  97           2HE      TYR  97  11.128   0.317   3.163
  764    HH   TYR  97           HH       TYR  97  12.630   1.852   5.360
  765    H    GLU  98           H        GLU  98   9.657   4.034  -2.825
  766    HA   GLU  98           HA       GLU  98  10.858   2.735  -4.270
  767   1HB   GLU  98          2HB       GLU  98  12.788   1.757  -3.619
  768   2HB   GLU  98          1HB       GLU  98  12.490   2.631  -2.129
  769   1HG   GLU  98          2HG       GLU  98  11.181   0.391  -1.537
  770   2HG   GLU  98          1HG       GLU  98  12.325  -0.268  -2.703
  771    H    PHE  99           H        PHE  99  10.265   0.978  -5.417
  772    HA   PHE  99           HA       PHE  99   7.913  -0.386  -4.658
  773   1HB   PHE  99          2HB       PHE  99   9.741  -0.359  -6.962
  774   2HB   PHE  99          1HB       PHE  99   8.897  -1.880  -6.719
  775    HD1  PHE  99           1HD      PHE  99   7.555   1.473  -5.928
  776    HD2  PHE  99           2HD      PHE  99   7.482  -1.840  -8.600
  777    HE1  PHE  99           1HE      PHE  99   5.565   2.409  -7.033
  778    HE2  PHE  99           2HE      PHE  99   5.493  -0.908  -9.709
  779    HZ   PHE  99           HZ       PHE  99   4.531   1.219  -8.923
  780    H    LEU 100           H        LEU 100   7.605  -2.219  -3.573
  781    HA   LEU 100           HA       LEU 100   9.796  -3.560  -2.340
  782   1HB   LEU 100          2HB       LEU 100   7.310  -3.233  -1.568
  783   2HB   LEU 100          1HB       LEU 100   7.037  -4.710  -2.465
  784    HG   LEU 100           HG       LEU 100   7.628  -5.891  -0.679
  785   1HD1  LEU 100          1HD1      LEU 100   9.892  -5.854  -1.645
  786   2HD1  LEU 100          2HD1      LEU 100   9.904  -5.978   0.113
  787   3HD1  LEU 100          3HD1      LEU 100  10.268  -4.438  -0.665
  788   1HD2  LEU 100          1HD2      LEU 100   8.477  -3.326   0.649
  789   2HD2  LEU 100          2HD2      LEU 100   8.065  -4.846   1.443
  790   3HD2  LEU 100          3HD2      LEU 100   6.823  -3.934   0.585
  791    H    GLU 101           H        GLU 101  11.044  -5.049  -3.256
  792    HA   GLU 101           HA       GLU 101  10.265  -6.341  -5.708
  793   1HB   GLU 101          2HB       GLU 101  12.735  -6.168  -4.064
  794   2HB   GLU 101          1HB       GLU 101  12.565  -7.570  -5.111
  795   1HG   GLU 101          2HG       GLU 101  12.935  -6.384  -6.967
  796   2HG   GLU 101          1HG       GLU 101  11.947  -5.030  -6.417
  797    H    LYS 102           H        LYS 102  10.778  -8.775  -5.892
  798    HA   LYS 102           HA       LYS 102  10.210 -10.915  -5.399
  799   1HB   LYS 102          2HB       LYS 102  10.597  -9.906  -2.579
  800   2HB   LYS 102          1HB       LYS 102  10.260 -11.587  -2.965
  801   1HG   LYS 102          2HG       LYS 102  12.564 -10.199  -4.258
  802   2HG   LYS 102          1HG       LYS 102  12.705 -10.807  -2.607
  803   1HD   LYS 102          2HD       LYS 102  12.616 -12.990  -3.258
  804   2HD   LYS 102          1HD       LYS 102  11.580 -12.645  -4.646
  805   1HE   LYS 102          2HE       LYS 102  13.583 -11.537  -5.710
  806   2HE   LYS 102          1HE       LYS 102  14.549 -12.217  -4.401
  807   1HZ   LYS 102          1HZ       LYS 102  13.128 -13.624  -6.567
  808   2HZ   LYS 102          2HZ       LYS 102  13.502 -14.428  -5.127
  809   3HZ   LYS 102          3HZ       LYS 102  14.740 -13.775  -6.080
  810    HA   PRO 103           HA       PRO 103   5.850  -9.327  -4.537
  811   1HB   PRO 103          2HB       PRO 103   5.337 -10.304  -7.260
  812   2HB   PRO 103          1HB       PRO 103   4.944  -8.743  -6.539
  813   1HG   PRO 103          2HG       PRO 103   6.879  -9.016  -8.390
  814   2HG   PRO 103          1HG       PRO 103   6.986  -7.828  -7.077
  815   1HD   PRO 103          2HD       PRO 103   8.333 -10.487  -7.344
  816   2HD   PRO 103          1HD       PRO 103   8.967  -8.958  -6.707
  817    H    PHE 104           H        PHE 104   7.406 -12.204  -5.404
  818    HA   PHE 104           HA       PHE 104   5.133 -13.929  -5.460
  819   1HB   PHE 104          2HB       PHE 104   7.595 -14.274  -6.358
  820   2HB   PHE 104          1HB       PHE 104   7.852 -14.943  -4.750
  821    HD1  PHE 104           1HD      PHE 104   7.062 -15.755  -8.013
  822    HD2  PHE 104           2HD      PHE 104   5.889 -16.629  -4.017
  823    HE1  PHE 104           1HE      PHE 104   6.121 -17.901  -8.763
  824    HE2  PHE 104           2HE      PHE 104   4.947 -18.778  -4.760
  825    HZ   PHE 104           HZ       PHE 104   5.063 -19.416  -7.135
  826    H    SER 105           H        SER 105   7.728 -13.478  -3.050
  827    HA   SER 105           HA       SER 105   6.045 -14.773  -1.044
  828   1HB   SER 105          2HB       SER 105   8.842 -13.787  -0.549
  829   2HB   SER 105          1HB       SER 105   7.984 -15.121   0.224
  830    HG   SER 105           HG       SER 105   8.250 -16.343  -1.602
  831    H    VAL 106           H        VAL 106   4.802 -13.597   0.236
  832    HA   VAL 106           HA       VAL 106   5.089 -10.736   0.396
  833    HB   VAL 106           HB       VAL 106   2.862 -11.733   0.340
  834   1HG1  VAL 106          1HG1      VAL 106   3.847 -13.173   2.757
  835   2HG1  VAL 106          2HG1      VAL 106   2.928 -13.779   1.380
  836   3HG1  VAL 106          3HG1      VAL 106   2.130 -12.801   2.611
  837   1HG2  VAL 106          1HG2      VAL 106   2.426 -10.737   2.940
  838   2HG2  VAL 106          2HG2      VAL 106   2.241  -9.889   1.406
  839   3HG2  VAL 106          3HG2      VAL 106   3.778  -9.831   2.267
  840    H    GLU 107           H        GLU 107   5.888 -13.493   2.406
  841    HA   GLU 107           HA       GLU 107   6.149 -12.448   4.902
  842   1HB   GLU 107          2HB       GLU 107   6.757 -14.786   4.006
  843   2HB   GLU 107          1HB       GLU 107   8.358 -14.111   3.739
  844   1HG   GLU 107          2HG       GLU 107   8.390 -13.467   6.151
  845   2HG   GLU 107          1HG       GLU 107   6.897 -14.383   6.346
  846    H    ARG 108           H        ARG 108   8.207 -11.852   2.127
  847    HA   ARG 108           HA       ARG 108  10.269 -10.485   3.546
  848   1HB   ARG 108          2HB       ARG 108  10.262 -11.521   1.136
  849   2HB   ARG 108          1HB       ARG 108   9.647  -9.943   0.664
  850   1HG   ARG 108          2HG       ARG 108  11.651  -8.991   0.842
  851   2HG   ARG 108          1HG       ARG 108  11.974  -9.763   2.395
  852   1HD   ARG 108          2HD       ARG 108  12.789 -11.723   1.361
  853   2HD   ARG 108          1HD       ARG 108  12.153 -11.247  -0.213
  854    HE   ARG 108           HE       ARG 108  14.068 -10.066  -0.566
  855   1HH1  ARG 108          1HH1      ARG 108  13.725 -10.591   2.866
  856   2HH1  ARG 108          2HH1      ARG 108  15.267  -9.902   3.252
  857   1HH2  ARG 108          1HH2      ARG 108  16.096  -9.160  -0.061
  858   2HH2  ARG 108          2HH2      ARG 108  16.611  -9.086   1.591
  859    H    PHE 109           H        PHE 109   7.334  -9.522   1.861
  860    HA   PHE 109           HA       PHE 109   7.640  -6.753   1.906
  861   1HB   PHE 109          2HB       PHE 109   5.848  -7.529   0.615
  862   2HB   PHE 109          1HB       PHE 109   5.265  -8.595   1.883
  863    HD1  PHE 109           1HD      PHE 109   6.063  -4.971   2.091
  864    HD2  PHE 109           2HD      PHE 109   3.050  -7.973   2.158
  865    HE1  PHE 109           1HE      PHE 109   4.401  -3.283   2.749
  866    HE2  PHE 109           2HE      PHE 109   1.382  -6.291   2.816
  867    HZ   PHE 109           HZ       PHE 109   2.056  -3.943   3.114
  868    H    LEU 110           H        LEU 110   6.769  -9.011   4.409
  869    HA   LEU 110           HA       LEU 110   5.565  -7.417   6.306
  870   1HB   LEU 110          2HB       LEU 110   6.503  -9.970   6.202
  871   2HB   LEU 110          1HB       LEU 110   7.569  -9.244   7.388
  872    HG   LEU 110           HG       LEU 110   4.583  -9.008   7.613
  873   1HD1  LEU 110          1HD1      LEU 110   4.806 -10.911   9.264
  874   2HD1  LEU 110          2HD1      LEU 110   6.370 -11.247   8.519
  875   3HD1  LEU 110          3HD1      LEU 110   4.895 -11.343   7.557
  876   1HD2  LEU 110          1HD2      LEU 110   6.904  -8.204   9.174
  877   2HD2  LEU 110          2HD2      LEU 110   5.727  -9.120  10.116
  878   3HD2  LEU 110          3HD2      LEU 110   5.231  -7.656   9.267
  879    H    LEU 111           H        LEU 111   9.006  -7.841   5.653
  880    HA   LEU 111           HA       LEU 111  10.041  -6.385   7.788
  881   1HB   LEU 111          2HB       LEU 111  11.074  -6.859   5.007
  882   2HB   LEU 111          1HB       LEU 111  11.996  -5.980   6.212
  883    HG   LEU 111           HG       LEU 111  11.732  -8.065   7.684
  884   1HD1  LEU 111          1HD1      LEU 111  10.822  -9.112   5.022
  885   2HD1  LEU 111          2HD1      LEU 111  10.058  -9.297   6.601
  886   3HD1  LEU 111          3HD1      LEU 111  11.555 -10.157   6.239
  887   1HD2  LEU 111          1HD2      LEU 111  13.477  -7.654   5.333
  888   2HD2  LEU 111          2HD2      LEU 111  13.502  -9.256   6.070
  889   3HD2  LEU 111          3HD2      LEU 111  13.890  -7.834   7.038
  890    H    THR 112           H        THR 112   9.542  -5.234   4.448
  891    HA   THR 112           HA       THR 112  10.200  -2.601   4.754
  892    HB   THR 112           HB       THR 112   7.935  -3.726   3.098
  893    HG1  THR 112           1HG      THR 112  10.682  -3.294   2.569
  894   1HG2  THR 112          1HG2      THR 112   9.334  -1.449   1.990
  895   2HG2  THR 112          2HG2      THR 112   8.487  -1.050   3.485
  896   3HG2  THR 112          3HG2      THR 112   7.603  -1.758   2.133
  897    H    ILE 113           H        ILE 113   7.108  -4.114   5.570
  898    HA   ILE 113           HA       ILE 113   5.614  -1.845   6.164
  899    HB   ILE 113           HB       ILE 113   5.564  -4.602   7.390
  900   1HG1  ILE 113          2HG1      ILE 113   4.894  -4.365   5.018
  901   2HG1  ILE 113          1HG1      ILE 113   3.559  -4.884   6.042
  902   1HG2  ILE 113          1HG2      ILE 113   3.725  -2.283   7.937
  903   2HG2  ILE 113          2HG2      ILE 113   4.700  -3.185   9.097
  904   3HG2  ILE 113          3HG2      ILE 113   3.327  -3.961   8.307
  905   1HD1  ILE 113          1HD1      ILE 113   3.234  -2.199   6.093
  906   2HD1  ILE 113          2HD1      ILE 113   2.430  -3.288   4.961
  907   3HD1  ILE 113          3HD1      ILE 113   3.896  -2.435   4.476
  908    H    LYS 114           H        LYS 114   7.155  -3.898   8.641
  909    HA   LYS 114           HA       LYS 114   7.022  -2.028  10.710
  910   1HB   LYS 114          2HB       LYS 114   7.450  -4.400  11.104
  911   2HB   LYS 114          1HB       LYS 114   9.005  -4.273  10.296
  912   1HG   LYS 114          2HG       LYS 114   8.536  -2.463  12.587
  913   2HG   LYS 114          1HG       LYS 114   8.736  -4.180  12.941
  914   1HD   LYS 114          2HD       LYS 114  10.933  -4.089  12.560
  915   2HD   LYS 114          1HD       LYS 114  10.702  -3.242  11.029
  916   1HE   LYS 114          2HE       LYS 114  11.672  -1.506  12.053
  917   2HE   LYS 114          1HE       LYS 114  10.119  -1.295  12.857
  918   1HZ   LYS 114          1HZ       LYS 114  11.289  -1.505  14.727
  919   2HZ   LYS 114          2HZ       LYS 114  12.638  -2.151  13.939
  920   3HZ   LYS 114          3HZ       LYS 114  11.353  -3.159  14.384
  921    H    HIS 115           H        HIS 115   8.992  -2.060   7.953
  922    HA   HIS 115           HA       HIS 115  11.099  -0.433   9.126
  923   1HB   HIS 115          2HB       HIS 115  11.461  -2.261   7.355
  924   2HB   HIS 115          1HB       HIS 115  10.819  -1.089   6.208
  925    HD1  HIS 115           1HD      HIS 115  12.342   1.320   7.831
  926    HD2  HIS 115           2HD      HIS 115  13.991  -2.091   6.124
  927    HE1  HIS 115           1HE      HIS 115  14.757   1.881   7.406
  928    HE2  HIS 115           2HE      HIS 115  15.755  -0.229   6.458
  929    H    ALA 116           H        ALA 116   8.157  -0.105   7.382
  930    HA   ALA 116           HA       ALA 116   8.710   2.558   6.394
  931   1HB   ALA 116          1HB       ALA 116   6.079   2.298   6.001
  932   2HB   ALA 116          2HB       ALA 116   6.508   0.595   6.154
  933   3HB   ALA 116          3HB       ALA 116   7.280   1.591   4.921
  934    H    PHE 117           H        PHE 117   6.897   1.046   9.008
  935    HA   PHE 117           HA       PHE 117   5.577   3.381   9.907
  936   1HB   PHE 117          2HB       PHE 117   6.151   0.688  11.075
  937   2HB   PHE 117          1HB       PHE 117   5.552   1.964  12.129
  938    HD1  PHE 117           1HD      PHE 117   3.428   3.225  11.243
  939    HD2  PHE 117           2HD      PHE 117   4.636  -0.657   9.986
  940    HE1  PHE 117           1HE      PHE 117   1.127   2.747  10.520
  941    HE2  PHE 117           2HE      PHE 117   2.336  -1.142   9.260
  942    HZ   PHE 117           HZ       PHE 117   0.578   0.566   9.525
  943    H    GLU 118           H        GLU 118   8.717   1.976  10.599
  944    HA   GLU 118           HA       GLU 118   9.271   3.796  12.765
  945   1HB   GLU 118          2HB       GLU 118  11.070   1.877  11.282
  946   2HB   GLU 118          1HB       GLU 118  11.528   2.781  12.719
  947   1HG   GLU 118          2HG       GLU 118   9.327   0.735  12.560
  948   2HG   GLU 118          1HG       GLU 118  10.931   0.477  13.242
  949    H    GLU 119           H        GLU 119   9.657   3.785   9.338
  950    HA   GLU 119           HA       GLU 119  11.686   5.865   9.372
  951   1HB   GLU 119          2HB       GLU 119  10.262   4.450   7.128
  952   2HB   GLU 119          1HB       GLU 119  11.426   5.743   6.873
  953   1HG   GLU 119          2HG       GLU 119  12.131   3.293   8.444
  954   2HG   GLU 119          1HG       GLU 119  12.237   3.327   6.684
  955    H    TYR 120           H        TYR 120   8.634   6.064  10.171
  956    HA   TYR 120           HA       TYR 120   8.371   8.772   9.198
  957   1HB   TYR 120          2HB       TYR 120   7.190   6.832   7.673
  958   2HB   TYR 120          1HB       TYR 120   5.881   7.267   8.766
  959    HD1  TYR 120           1HD      TYR 120   5.646   9.940   9.073
  960    HD2  TYR 120           2HD      TYR 120   7.293   7.973   5.679
  961    HE1  TYR 120           1HE      TYR 120   5.154  11.917   7.696
  962    HE2  TYR 120           2HE      TYR 120   6.807   9.945   4.293
  963    HH   TYR 120           HH       TYR 120   6.489  12.646   4.982
  964    H    SER 121           H        SER 121   8.798   7.704  11.765
  965    HA   SER 121           HA       SER 121   6.404   8.706  13.107
  966   1HB   SER 121          2HB       SER 121   6.632   6.831  14.809
  967   2HB   SER 121          1HB       SER 121   6.004   6.359  13.230
  968    HG   SER 121           HG       SER 121   8.691   6.082  14.111
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   0.051   2.463  18.484
    2   2H    MET   1          2HT       MET   1   0.078   0.757  18.294
    3   3H    MET   1          3HT       MET   1  -1.141   1.499  19.249
    4    HA   MET   1           HA       MET   1  -2.197   1.006  17.304
    5   1HB   MET   1          2HB       MET   1  -1.218   3.829  17.516
    6   2HB   MET   1          1HB       MET   1  -2.228   3.371  16.153
    7   1HG   MET   1          2HG       MET   1  -3.810   4.104  17.614
    8   2HG   MET   1          1HG       MET   1  -3.774   2.390  18.023
    9   1HE   MET   1          1HE       MET   1  -2.498   1.592  20.743
   10   2HE   MET   1          2HE       MET   1  -4.085   1.729  19.987
   11   3HE   MET   1          3HE       MET   1  -3.779   2.503  21.541
   12    H    LYS   2           H        LYS   2  -2.046   0.202  15.295
   13    HA   LYS   2           HA       LYS   2  -0.042   1.115  13.440
   14   1HB   LYS   2          2HB       LYS   2   0.446  -1.195  15.072
   15   2HB   LYS   2          1HB       LYS   2   0.361  -1.654  13.378
   16   1HG   LYS   2          2HG       LYS   2   2.563  -1.157  13.484
   17   2HG   LYS   2          1HG       LYS   2   1.950   0.459  13.129
   18   1HD   LYS   2          2HD       LYS   2   2.537   1.252  15.146
   19   2HD   LYS   2          1HD       LYS   2   1.986  -0.203  15.981
   20   1HE   LYS   2          2HE       LYS   2   4.133  -0.705  16.296
   21   2HE   LYS   2          1HE       LYS   2   4.226  -1.031  14.566
   22   1HZ   LYS   2          1HZ       LYS   2   5.749   0.755  15.830
   23   2HZ   LYS   2          2HZ       LYS   2   4.484   1.757  15.322
   24   3HZ   LYS   2          3HZ       LYS   2   5.358   0.855  14.188
   25    H    ARG   3           H        ARG   3  -1.003   1.190  11.530
   26    HA   ARG   3           HA       ARG   3  -2.779  -0.979  10.715
   27   1HB   ARG   3          2HB       ARG   3  -3.676   1.847  10.251
   28   2HB   ARG   3          1HB       ARG   3  -4.623   0.367  10.220
   29   1HG   ARG   3          2HG       ARG   3  -5.316   1.365  12.178
   30   2HG   ARG   3          1HG       ARG   3  -4.077   0.245  12.745
   31   1HD   ARG   3          2HD       ARG   3  -2.940   1.932  13.635
   32   2HD   ARG   3          1HD       ARG   3  -2.818   2.702  12.054
   33    HE   ARG   3           HE       ARG   3  -5.348   3.148  13.316
   34   1HH1  ARG   3          1HH1      ARG   3  -2.037   4.240  13.150
   35   2HH1  ARG   3          2HH1      ARG   3  -2.409   5.845  13.684
   36   1HH2  ARG   3          1HH2      ARG   3  -5.837   5.259  14.020
   37   2HH2  ARG   3          2HH2      ARG   3  -4.566   6.424  14.178
   38    H    VAL   4           H        VAL   4  -2.742  -1.397   8.550
   39    HA   VAL   4           HA       VAL   4  -1.195   0.437   6.845
   40    HB   VAL   4           HB       VAL   4  -1.003  -2.580   6.836
   41   1HG1  VAL   4          1HG1      VAL   4   0.071  -0.474   5.003
   42   2HG1  VAL   4          2HG1      VAL   4  -0.699  -2.012   4.612
   43   3HG1  VAL   4          3HG1      VAL   4   0.950  -1.985   5.237
   44   1HG2  VAL   4          1HG2      VAL   4   1.089  -0.529   7.551
   45   2HG2  VAL   4          2HG2      VAL   4   1.262  -2.282   7.608
   46   3HG2  VAL   4          3HG2      VAL   4   0.161  -1.469   8.720
   47    H    LEU   5           H        LEU   5  -1.685   0.332   4.575
   48    HA   LEU   5           HA       LEU   5  -4.385  -0.713   4.037
   49   1HB   LEU   5          2HB       LEU   5  -4.188   1.765   4.044
   50   2HB   LEU   5          1HB       LEU   5  -3.018   1.645   2.745
   51    HG   LEU   5           HG       LEU   5  -4.768   0.609   1.315
   52   1HD1  LEU   5          1HD1      LEU   5  -6.940   0.319   1.977
   53   2HD1  LEU   5          2HD1      LEU   5  -6.833   1.538   3.247
   54   3HD1  LEU   5          3HD1      LEU   5  -6.093  -0.046   3.479
   55   1HD2  LEU   5          1HD2      LEU   5  -6.089   3.097   2.070
   56   2HD2  LEU   5          2HD2      LEU   5  -5.300   2.643   0.559
   57   3HD2  LEU   5          3HD2      LEU   5  -4.341   3.258   1.905
   58    H    VAL   6           H        VAL   6  -4.682  -2.036   2.328
   59    HA   VAL   6           HA       VAL   6  -2.353  -2.501   0.570
   60    HB   VAL   6           HB       VAL   6  -4.406  -4.580   1.295
   61   1HG1  VAL   6          1HG1      VAL   6  -3.141  -4.880  -0.814
   62   2HG1  VAL   6          2HG1      VAL   6  -2.829  -6.147   0.374
   63   3HG1  VAL   6          3HG1      VAL   6  -1.646  -4.864   0.121
   64   1HG2  VAL   6          1HG2      VAL   6  -2.933  -5.462   2.933
   65   2HG2  VAL   6          2HG2      VAL   6  -3.094  -3.739   3.275
   66   3HG2  VAL   6          3HG2      VAL   6  -1.646  -4.348   2.472
   67    H    VAL   7           H        VAL   7  -2.868  -1.444  -1.273
   68    HA   VAL   7           HA       VAL   7  -5.567  -1.683  -2.366
   69    HB   VAL   7           HB       VAL   7  -3.236  -0.119  -3.488
   70   1HG1  VAL   7          1HG1      VAL   7  -5.234  -0.776  -4.955
   71   2HG1  VAL   7          2HG1      VAL   7  -4.755   0.921  -4.919
   72   3HG1  VAL   7          3HG1      VAL   7  -6.150   0.378  -3.985
   73   1HG2  VAL   7          1HG2      VAL   7  -5.174   0.505  -1.339
   74   2HG2  VAL   7          2HG2      VAL   7  -4.826   1.785  -2.501
   75   3HG2  VAL   7          3HG2      VAL   7  -3.517   1.060  -1.568
   76    H    ASP   8           H        ASP   8  -6.030  -3.310  -3.702
   77    HA   ASP   8           HA       ASP   8  -4.237  -4.014  -5.842
   78   1HB   ASP   8          2HB       ASP   8  -3.264  -5.348  -4.040
   79   2HB   ASP   8          1HB       ASP   8  -4.841  -6.038  -3.673
   80    H    ASP   9           H        ASP   9  -5.212  -5.507  -7.360
   81    HA   ASP   9           HA       ASP   9  -8.102  -5.219  -7.401
   82   1HB   ASP   9          2HB       ASP   9  -6.902  -4.612  -9.420
   83   2HB   ASP   9          1HB       ASP   9  -6.151  -6.199  -9.502
   84    H    GLU  10           H        GLU  10  -7.537  -6.877  -5.421
   85    HA   GLU  10           HA       GLU  10  -8.309  -9.514  -6.469
   86   1HB   GLU  10          2HB       GLU  10  -6.029  -8.813  -4.779
   87   2HB   GLU  10          1HB       GLU  10  -7.034 -10.073  -4.078
   88   1HG   GLU  10          2HG       GLU  10  -6.852 -11.292  -6.267
   89   2HG   GLU  10          1HG       GLU  10  -5.638 -10.102  -6.738
   90    H    GLU  11           H        GLU  11  -9.977 -10.504  -5.438
   91    HA   GLU  11           HA       GLU  11 -11.425  -8.912  -3.486
   92   1HB   GLU  11          2HB       GLU  11 -12.080 -11.183  -5.292
   93   2HB   GLU  11          1HB       GLU  11 -13.032 -11.017  -3.822
   94   1HG   GLU  11          2HG       GLU  11 -14.266  -9.834  -5.365
   95   2HG   GLU  11          1HG       GLU  11 -13.336  -8.568  -4.565
   96    H    SER  12           H        SER  12 -12.238  -9.779  -1.510
   97    HA   SER  12           HA       SER  12 -12.061 -10.852   0.483
   98   1HB   SER  12          2HB       SER  12 -10.746 -13.205  -0.829
   99   2HB   SER  12          1HB       SER  12 -11.937 -13.173   0.473
  100    HG   SER  12           HG       SER  12 -13.421 -13.356  -0.986
  101    H    ILE  13           H        ILE  13 -10.143  -9.058   0.211
  102    HA   ILE  13           HA       ILE  13  -8.105  -8.381   0.924
  103    HB   ILE  13           HB       ILE  13  -8.137 -11.011   2.340
  104   1HG1  ILE  13          2HG1      ILE  13 -10.154  -9.613   2.760
  105   2HG1  ILE  13          1HG1      ILE  13  -9.193  -9.916   4.203
  106   1HG2  ILE  13          1HG2      ILE  13  -5.953 -10.212   2.545
  107   2HG2  ILE  13          2HG2      ILE  13  -6.742  -9.701   4.037
  108   3HG2  ILE  13          3HG2      ILE  13  -6.494  -8.544   2.730
  109   1HD1  ILE  13          1HD1      ILE  13  -8.144  -7.569   3.266
  110   2HD1  ILE  13          2HD1      ILE  13  -9.344  -7.727   4.547
  111   3HD1  ILE  13          3HD1      ILE  13  -9.859  -7.412   2.890
  112    H    THR  14           H        THR  14  -5.748  -8.985   0.965
  113    HA   THR  14           HA       THR  14  -5.129 -10.510  -1.434
  114    HB   THR  14           HB       THR  14  -2.986  -9.451  -1.390
  115    HG1  THR  14           1HG      THR  14  -2.140  -9.220   0.506
  116   1HG2  THR  14          1HG2      THR  14  -3.476  -7.078  -1.275
  117   2HG2  THR  14          2HG2      THR  14  -4.991  -7.420  -0.438
  118   3HG2  THR  14          3HG2      THR  14  -4.766  -7.949  -2.105
  119    H    SER  15           H        SER  15  -4.586 -12.577  -1.302
  120    HA   SER  15           HA       SER  15  -4.333 -14.068   0.989
  121   1HB   SER  15          2HB       SER  15  -3.521 -15.849  -0.367
  122   2HB   SER  15          1HB       SER  15  -4.597 -14.903  -1.395
  123    HG   SER  15           HG       SER  15  -2.671 -13.838  -2.179
  124    H    SER  16           H        SER  16  -2.710 -14.771   2.296
  125    HA   SER  16           HA       SER  16  -0.600 -15.034   3.165
  126   1HB   SER  16          2HB       SER  16   0.593 -13.105   1.197
  127   2HB   SER  16          1HB       SER  16   1.346 -14.478   2.009
  128    HG   SER  16           HG       SER  16   0.764 -15.676   0.397
  129    H    LEU  17           H        LEU  17  -2.080 -11.981   2.529
  130    HA   LEU  17           HA       LEU  17  -0.389 -10.557   4.404
  131   1HB   LEU  17          2HB       LEU  17  -2.352  -9.884   2.367
  132   2HB   LEU  17          1HB       LEU  17  -2.614  -8.976   3.836
  133    HG   LEU  17           HG       LEU  17  -0.918  -8.285   1.777
  134   1HD1  LEU  17          1HD1      LEU  17  -0.494  -6.393   3.018
  135   2HD1  LEU  17          2HD1      LEU  17  -0.435  -7.276   4.543
  136   3HD1  LEU  17          3HD1      LEU  17  -1.983  -6.989   3.749
  137   1HD2  LEU  17          1HD2      LEU  17   1.318  -8.484   2.438
  138   2HD2  LEU  17          2HD2      LEU  17   0.639 -10.093   2.683
  139   3HD2  LEU  17          3HD2      LEU  17   0.884  -9.021   4.061
  140    H    SER  18           H        SER  18  -3.776 -11.609   4.202
  141    HA   SER  18           HA       SER  18  -4.740 -10.608   6.577
  142   1HB   SER  18          2HB       SER  18  -6.206 -11.714   5.000
  143   2HB   SER  18          1HB       SER  18  -5.380 -13.253   5.249
  144    HG   SER  18           HG       SER  18  -6.459 -13.546   7.041
  145    H    ALA  19           H        ALA  19  -3.055 -13.698   6.076
  146    HA   ALA  19           HA       ALA  19  -3.170 -14.545   8.765
  147   1HB   ALA  19          1HB       ALA  19  -1.689 -15.352   6.337
  148   2HB   ALA  19          2HB       ALA  19  -2.639 -16.320   7.465
  149   3HB   ALA  19          3HB       ALA  19  -0.995 -15.836   7.885
  150    H    ILE  20           H        ILE  20  -0.615 -12.905   6.919
  151    HA   ILE  20           HA       ILE  20   1.297 -12.744   8.944
  152    HB   ILE  20           HB       ILE  20   0.764 -10.912   6.606
  153   1HG1  ILE  20          2HG1      ILE  20   2.961 -12.936   6.999
  154   2HG1  ILE  20          1HG1      ILE  20   1.433 -13.312   6.209
  155   1HG2  ILE  20          1HG2      ILE  20   2.836 -10.774   8.731
  156   2HG2  ILE  20          2HG2      ILE  20   2.008  -9.475   7.872
  157   3HG2  ILE  20          3HG2      ILE  20   3.299 -10.376   7.076
  158   1HD1  ILE  20          1HD1      ILE  20   3.544 -11.379   5.303
  159   2HD1  ILE  20          2HD1      ILE  20   1.937 -11.480   4.582
  160   3HD1  ILE  20          3HD1      ILE  20   3.021 -12.869   4.516
  161    H    LEU  21           H        LEU  21  -0.609  -9.960   7.813
  162    HA   LEU  21           HA       LEU  21  -0.153  -8.223   9.857
  163   1HB   LEU  21          2HB       LEU  21  -2.785  -8.639   8.449
  164   2HB   LEU  21          1HB       LEU  21  -2.299  -7.188   9.306
  165    HG   LEU  21           HG       LEU  21  -0.359  -7.943   7.281
  166   1HD1  LEU  21          1HD1      LEU  21  -1.679  -8.483   5.592
  167   2HD1  LEU  21          2HD1      LEU  21  -2.387  -6.871   5.682
  168   3HD1  LEU  21          3HD1      LEU  21  -3.125  -8.208   6.563
  169   1HD2  LEU  21          1HD2      LEU  21  -1.793  -5.552   8.261
  170   2HD2  LEU  21          2HD2      LEU  21  -1.192  -5.502   6.603
  171   3HD2  LEU  21          3HD2      LEU  21  -0.078  -5.799   7.936
  172    H    GLU  22           H        GLU  22  -2.326 -10.972   9.873
  173    HA   GLU  22           HA       GLU  22  -3.656 -10.291  12.302
  174   1HB   GLU  22          2HB       GLU  22  -3.505 -12.726  10.587
  175   2HB   GLU  22          1HB       GLU  22  -4.179 -12.852  12.205
  176   1HG   GLU  22          2HG       GLU  22  -5.855 -11.196  11.673
  177   2HG   GLU  22          1HG       GLU  22  -5.151 -10.964  10.073
  178    H    GLU  23           H        GLU  23  -0.730 -12.015  11.496
  179    HA   GLU  23           HA       GLU  23  -0.432 -13.129  14.146
  180   1HB   GLU  23          2HB       GLU  23   0.441 -14.488  12.427
  181   2HB   GLU  23          1HB       GLU  23   1.250 -13.135  11.650
  182   1HG   GLU  23          2HG       GLU  23   3.093 -13.420  12.847
  183   2HG   GLU  23          1HG       GLU  23   2.190 -13.563  14.355
  184    H    GLU  24           H        GLU  24   0.807 -10.427  12.277
  185    HA   GLU  24           HA       GLU  24   2.775  -9.661  14.207
  186   1HB   GLU  24          2HB       GLU  24   1.607  -8.312  11.791
  187   2HB   GLU  24          1HB       GLU  24   2.750  -7.494  12.847
  188   1HG   GLU  24          2HG       GLU  24   3.232 -10.017  11.281
  189   2HG   GLU  24          1HG       GLU  24   3.903  -8.420  10.952
  190    H    GLY  25           H        GLY  25  -0.556  -8.783  13.527
  191   1HA   GLY  25          2HA       GLY  25  -2.039  -8.010  15.203
  192   2HA   GLY  25          1HA       GLY  25  -0.657  -7.418  16.109
  193    H    TYR  26           H        TYR  26  -1.555  -6.878  12.722
  194    HA   TYR  26           HA       TYR  26  -1.423  -3.988  13.231
  195   1HB   TYR  26          2HB       TYR  26  -1.073  -5.662  10.759
  196   2HB   TYR  26          1HB       TYR  26  -1.399  -3.941  10.641
  197    HD1  TYR  26           1HD      TYR  26   0.257  -2.306  11.365
  198    HD2  TYR  26           2HD      TYR  26   1.064  -6.476  11.545
  199    HE1  TYR  26           1HE      TYR  26   2.652  -1.824  11.623
  200    HE2  TYR  26           2HE      TYR  26   3.463  -6.008  11.803
  201    HH   TYR  26           HH       TYR  26   4.817  -2.972  11.220
  202    H    HIS  27           H        HIS  27  -2.815  -2.878  11.316
  203    HA   HIS  27           HA       HIS  27  -5.534  -3.991  11.454
  204   1HB   HIS  27          2HB       HIS  27  -4.673  -1.651  12.722
  205   2HB   HIS  27          1HB       HIS  27  -5.493  -1.085  11.271
  206    HD1  HIS  27           1HD      HIS  27  -6.233  -3.596  14.044
  207    HD2  HIS  27           2HD      HIS  27  -8.132  -0.739  11.700
  208    HE1  HIS  27           1HE      HIS  27  -8.619  -3.550  14.840
  209    HE2  HIS  27           2HE      HIS  27  -9.763  -1.856  13.367
  210    HA   PRO  28           HA       PRO  28  -4.390  -3.180   7.092
  211   1HB   PRO  28          2HB       PRO  28  -5.038  -5.581   6.097
  212   2HB   PRO  28          1HB       PRO  28  -3.514  -5.304   6.948
  213   1HG   PRO  28          2HG       PRO  28  -6.016  -6.609   7.914
  214   2HG   PRO  28          1HG       PRO  28  -4.329  -7.031   8.248
  215   1HD   PRO  28          2HD       PRO  28  -5.993  -5.588   9.942
  216   2HD   PRO  28          1HD       PRO  28  -4.222  -5.607  10.023
  217    H    ASP  29           H        ASP  29  -5.668  -2.481   5.491
  218    HA   ASP  29           HA       ASP  29  -8.504  -3.225   5.476
  219   1HB   ASP  29          2HB       ASP  29  -8.043  -0.975   6.643
  220   2HB   ASP  29          1HB       ASP  29  -7.654  -0.376   5.035
  221    H    THR  30           H        THR  30  -7.268  -4.549   3.797
  222    HA   THR  30           HA       THR  30  -6.193  -3.455   1.490
  223    HB   THR  30           HB       THR  30  -6.394  -5.599   0.508
  224    HG1  THR  30           1HG      THR  30  -8.624  -5.871   2.200
  225   1HG2  THR  30          1HG2      THR  30  -5.351  -6.932   2.004
  226   2HG2  THR  30          2HG2      THR  30  -6.487  -6.560   3.301
  227   3HG2  THR  30          3HG2      THR  30  -5.222  -5.407   2.878
  228    H    ALA  31           H        ALA  31  -6.965  -2.603  -0.325
  229    HA   ALA  31           HA       ALA  31  -9.876  -2.288  -0.561
  230   1HB   ALA  31          1HB       ALA  31  -8.352  -0.262  -0.453
  231   2HB   ALA  31          2HB       ALA  31  -9.485  -0.317  -1.803
  232   3HB   ALA  31          3HB       ALA  31  -7.789  -0.722  -2.059
  233    H    LYS  32           H        LYS  32  -9.859  -1.571  -3.327
  234    HA   LYS  32           HA       LYS  32  -9.164  -4.159  -4.549
  235   1HB   LYS  32          2HB       LYS  32 -11.411  -2.522  -5.639
  236   2HB   LYS  32          1HB       LYS  32 -11.174  -4.264  -5.680
  237   1HG   LYS  32          2HG       LYS  32 -11.855  -4.494  -3.418
  238   2HG   LYS  32          1HG       LYS  32 -11.821  -2.749  -3.166
  239   1HD   LYS  32          2HD       LYS  32 -13.822  -2.426  -4.185
  240   2HD   LYS  32          1HD       LYS  32 -13.565  -3.735  -5.340
  241   1HE   LYS  32          2HE       LYS  32 -13.751  -5.126  -3.024
  242   2HE   LYS  32          1HE       LYS  32 -14.824  -3.769  -2.680
  243   1HZ   LYS  32          1HZ       LYS  32 -15.626  -4.429  -5.129
  244   2HZ   LYS  32          2HZ       LYS  32 -16.312  -5.071  -3.722
  245   3HZ   LYS  32          3HZ       LYS  32 -15.141  -5.950  -4.568
  246    H    THR  33           H        THR  33  -9.237  -0.688  -4.897
  247    HA   THR  33           HA       THR  33  -7.204  -0.783  -6.906
  248    HB   THR  33           HB       THR  33  -8.678   0.678  -8.486
  249    HG1  THR  33           1HG      THR  33 -10.671  -0.842  -7.165
  250   1HG2  THR  33          1HG2      THR  33  -7.929  -1.906  -8.637
  251   2HG2  THR  33          2HG2      THR  33  -8.868  -1.066  -9.874
  252   3HG2  THR  33          3HG2      THR  33  -9.684  -2.068  -8.674
  253    H    LEU  34           H        LEU  34  -6.971   1.625  -7.818
  254    HA   LEU  34           HA       LEU  34  -6.293   3.213  -5.607
  255   1HB   LEU  34          2HB       LEU  34  -6.726   4.142  -8.446
  256   2HB   LEU  34          1HB       LEU  34  -5.780   4.955  -7.213
  257    HG   LEU  34           HG       LEU  34  -5.033   2.179  -8.043
  258   1HD1  LEU  34          1HD1      LEU  34  -4.164   4.670  -9.498
  259   2HD1  LEU  34          2HD1      LEU  34  -5.327   3.499 -10.118
  260   3HD1  LEU  34          3HD1      LEU  34  -3.658   3.013  -9.825
  261   1HD2  LEU  34          1HD2      LEU  34  -4.054   3.800  -6.140
  262   2HD2  LEU  34          2HD2      LEU  34  -3.061   4.308  -7.505
  263   3HD2  LEU  34          3HD2      LEU  34  -3.075   2.617  -7.006
  264    H    ARG  35           H        ARG  35  -9.102   3.259  -7.750
  265    HA   ARG  35           HA       ARG  35 -10.272   5.631  -6.816
  266   1HB   ARG  35          2HB       ARG  35 -10.979   3.525  -8.580
  267   2HB   ARG  35          1HB       ARG  35 -12.306   3.702  -7.441
  268   1HG   ARG  35          2HG       ARG  35 -11.262   6.211  -8.566
  269   2HG   ARG  35          1HG       ARG  35 -12.056   5.127  -9.710
  270   1HD   ARG  35          2HD       ARG  35 -13.918   6.189  -9.003
  271   2HD   ARG  35          1HD       ARG  35 -13.816   5.029  -7.679
  272    HE   ARG  35           HE       ARG  35 -12.362   7.456  -7.187
  273   1HH1  ARG  35          1HH1      ARG  35 -15.490   5.917  -7.001
  274   2HH1  ARG  35          2HH1      ARG  35 -16.067   6.960  -5.744
  275   1HH2  ARG  35          1HH2      ARG  35 -13.120   8.827  -5.533
  276   2HH2  ARG  35          2HH2      ARG  35 -14.721   8.611  -4.910
  277    H    GLU  36           H        GLU  36 -10.815   2.258  -5.819
  278    HA   GLU  36           HA       GLU  36 -12.617   2.824  -3.739
  279   1HB   GLU  36          2HB       GLU  36 -10.925   0.507  -4.519
  280   2HB   GLU  36          1HB       GLU  36 -11.513   0.540  -2.862
  281   1HG   GLU  36          2HG       GLU  36 -13.425   0.991  -5.103
  282   2HG   GLU  36          1HG       GLU  36 -12.881  -0.645  -4.734
  283    H    ALA  37           H        ALA  37  -9.119   2.802  -3.905
  284    HA   ALA  37           HA       ALA  37  -8.597   2.869  -1.129
  285   1HB   ALA  37          1HB       ALA  37  -6.408   3.970  -1.928
  286   2HB   ALA  37          2HB       ALA  37  -7.026   3.676  -3.553
  287   3HB   ALA  37          3HB       ALA  37  -6.758   2.323  -2.454
  288    H    GLU  38           H        GLU  38  -8.591   5.529  -3.526
  289    HA   GLU  38           HA       GLU  38  -8.197   7.658  -1.859
  290   1HB   GLU  38          2HB       GLU  38 -10.086   7.537  -4.216
  291   2HB   GLU  38          1HB       GLU  38  -9.481   9.015  -3.480
  292   1HG   GLU  38          2HG       GLU  38  -7.272   8.578  -4.193
  293   2HG   GLU  38          1HG       GLU  38  -7.674   6.923  -4.651
  294    H    LYS  39           H        LYS  39 -11.234   5.954  -2.470
  295    HA   LYS  39           HA       LYS  39 -12.928   7.661  -1.019
  296   1HB   LYS  39          2HB       LYS  39 -13.828   5.950  -2.488
  297   2HB   LYS  39          1HB       LYS  39 -13.106   4.681  -1.509
  298   1HG   LYS  39          2HG       LYS  39 -14.933   6.503  -0.091
  299   2HG   LYS  39          1HG       LYS  39 -15.670   5.461  -1.311
  300   1HD   LYS  39          2HD       LYS  39 -13.993   3.742   0.027
  301   2HD   LYS  39          1HD       LYS  39 -14.575   4.797   1.316
  302   1HE   LYS  39          2HE       LYS  39 -16.475   3.650   1.362
  303   2HE   LYS  39          1HE       LYS  39 -16.804   4.164  -0.292
  304   1HZ   LYS  39          1HZ       LYS  39 -15.455   1.688   0.611
  305   2HZ   LYS  39          2HZ       LYS  39 -15.371   2.231  -0.989
  306   3HZ   LYS  39          3HZ       LYS  39 -16.866   1.831  -0.309
  307    H    LYS  40           H        LYS  40 -11.016   4.853  -0.051
  308    HA   LYS  40           HA       LYS  40 -11.848   4.890   2.675
  309   1HB   LYS  40          2HB       LYS  40  -9.625   3.533   1.183
  310   2HB   LYS  40          1HB       LYS  40  -9.759   3.413   2.932
  311   1HG   LYS  40          2HG       LYS  40 -11.476   1.976   2.830
  312   2HG   LYS  40          1HG       LYS  40 -12.230   2.815   1.474
  313   1HD   LYS  40          2HD       LYS  40 -11.120   1.580  -0.086
  314   2HD   LYS  40          1HD       LYS  40  -9.702   1.359   0.941
  315   1HE   LYS  40          2HE       LYS  40 -12.139   0.080   1.947
  316   2HE   LYS  40          1HE       LYS  40 -11.571  -0.556   0.404
  317   1HZ   LYS  40          1HZ       LYS  40 -10.596  -1.768   2.233
  318   2HZ   LYS  40          2HZ       LYS  40  -9.973  -0.343   2.899
  319   3HZ   LYS  40          3HZ       LYS  40  -9.389  -0.908   1.415
  320    H    ILE  41           H        ILE  41  -8.987   6.050   0.945
  321    HA   ILE  41           HA       ILE  41  -7.659   7.032   3.265
  322    HB   ILE  41           HB       ILE  41  -7.218   7.900   0.412
  323   1HG1  ILE  41          2HG1      ILE  41  -5.827   5.669   1.905
  324   2HG1  ILE  41          1HG1      ILE  41  -7.129   5.409   0.749
  325   1HG2  ILE  41          1HG2      ILE  41  -5.443   7.965   2.847
  326   2HG2  ILE  41          2HG2      ILE  41  -6.147   9.352   2.014
  327   3HG2  ILE  41          3HG2      ILE  41  -4.927   8.366   1.208
  328   1HD1  ILE  41          1HD1      ILE  41  -5.616   6.721  -0.882
  329   2HD1  ILE  41          2HD1      ILE  41  -5.236   5.039  -0.511
  330   3HD1  ILE  41          3HD1      ILE  41  -4.336   6.340   0.269
  331    H    LYS  42           H        LYS  42 -10.195   8.263   1.302
  332    HA   LYS  42           HA       LYS  42  -9.836  11.008   1.498
  333   1HB   LYS  42          2HB       LYS  42 -11.921   9.229   0.746
  334   2HB   LYS  42          1HB       LYS  42 -12.599  10.478   1.780
  335   1HG   LYS  42          2HG       LYS  42 -10.903  11.043  -0.637
  336   2HG   LYS  42          1HG       LYS  42 -12.666  10.991  -0.655
  337   1HD   LYS  42          2HD       LYS  42 -12.407  13.219  -0.296
  338   2HD   LYS  42          1HD       LYS  42 -12.325  12.679   1.383
  339   1HE   LYS  42          2HE       LYS  42 -10.051  12.995   1.514
  340   2HE   LYS  42          1HE       LYS  42  -9.816  12.788  -0.221
  341   1HZ   LYS  42          1HZ       LYS  42 -10.631  14.950  -0.634
  342   2HZ   LYS  42          2HZ       LYS  42  -9.533  15.106   0.643
  343   3HZ   LYS  42          3HZ       LYS  42 -11.196  15.135   0.949
  344    H    GLU  43           H        GLU  43 -10.675   8.728   3.941
  345    HA   GLU  43           HA       GLU  43 -11.029  10.939   5.838
  346   1HB   GLU  43          2HB       GLU  43 -12.506   8.313   6.014
  347   2HB   GLU  43          1HB       GLU  43 -12.737   9.737   7.019
  348   1HG   GLU  43          2HG       GLU  43 -13.932  10.845   5.424
  349   2HG   GLU  43          1HG       GLU  43 -13.138  10.008   4.090
  350    H    LEU  44           H        LEU  44 -10.567   7.402   5.766
  351    HA   LEU  44           HA       LEU  44  -9.244   7.219   8.225
  352   1HB   LEU  44          2HB       LEU  44  -9.875   5.483   6.025
  353   2HB   LEU  44          1HB       LEU  44  -8.226   5.190   6.545
  354    HG   LEU  44           HG       LEU  44  -9.909   3.715   7.632
  355   1HD1  LEU  44          1HD1      LEU  44  -8.068   3.696   8.941
  356   2HD1  LEU  44          2HD1      LEU  44  -9.137   4.543  10.060
  357   3HD1  LEU  44          3HD1      LEU  44  -8.001   5.454   9.063
  358   1HD2  LEU  44          1HD2      LEU  44 -11.471   4.545   9.196
  359   2HD2  LEU  44          2HD2      LEU  44 -11.658   5.538   7.750
  360   3HD2  LEU  44          3HD2      LEU  44 -10.778   6.166   9.143
  361    H    PHE  45           H        PHE  45  -7.397   8.150   8.785
  362    HA   PHE  45           HA       PHE  45  -5.468   8.980   6.814
  363   1HB   PHE  45          2HB       PHE  45  -6.013  10.311   8.872
  364   2HB   PHE  45          1HB       PHE  45  -5.211   9.066   9.826
  365    HD1  PHE  45           1HD      PHE  45  -4.714  11.711   7.317
  366    HD2  PHE  45           2HD      PHE  45  -2.839   8.929   9.935
  367    HE1  PHE  45           1HE      PHE  45  -2.557  12.838   6.964
  368    HE2  PHE  45           2HE      PHE  45  -0.678  10.052   9.587
  369    HZ   PHE  45           HZ       PHE  45  -0.534  12.009   8.099
  370    H    PHE  46           H        PHE  46  -5.278   6.608   6.150
  371    HA   PHE  46           HA       PHE  46  -3.985   4.704   7.712
  372   1HB   PHE  46          2HB       PHE  46  -4.129   5.155   4.746
  373   2HB   PHE  46          1HB       PHE  46  -3.168   3.840   5.410
  374    HD1  PHE  46           1HD      PHE  46  -6.426   4.927   4.442
  375    HD2  PHE  46           2HD      PHE  46  -4.336   2.129   6.875
  376    HE1  PHE  46           1HE      PHE  46  -8.438   3.513   4.537
  377    HE2  PHE  46           2HE      PHE  46  -6.345   0.711   6.975
  378    HZ   PHE  46           HZ       PHE  46  -8.398   1.402   5.806
  379    HA   PRO  47           HA       PRO  47   0.109   6.476   7.909
  380   1HB   PRO  47          2HB       PRO  47   1.169   4.104   9.076
  381   2HB   PRO  47          1HB       PRO  47   0.674   5.580   9.900
  382   1HG   PRO  47          2HG       PRO  47  -0.577   3.087  10.078
  383   2HG   PRO  47          1HG       PRO  47  -1.244   4.634  10.619
  384   1HD   PRO  47          2HD       PRO  47  -1.842   3.066   8.178
  385   2HD   PRO  47          1HD       PRO  47  -2.864   4.201   9.078
  386    H    VAL  48           H        VAL  48  -0.425   3.187   6.763
  387    HA   VAL  48           HA       VAL  48   1.783   3.546   4.852
  388    HB   VAL  48           HB       VAL  48   0.964   0.910   6.067
  389   1HG1  VAL  48          1HG1      VAL  48   2.958   1.775   4.056
  390   2HG1  VAL  48          2HG1      VAL  48   2.043   0.271   4.175
  391   3HG1  VAL  48          3HG1      VAL  48   3.456   0.527   5.199
  392   1HG2  VAL  48          1HG2      VAL  48   1.865   1.973   7.897
  393   2HG2  VAL  48          2HG2      VAL  48   2.970   2.943   6.922
  394   3HG2  VAL  48          3HG2      VAL  48   3.296   1.229   7.183
  395    H    ILE  49           H        ILE  49   1.319   3.156   2.767
  396    HA   ILE  49           HA       ILE  49  -1.203   1.791   2.103
  397    HB   ILE  49           HB       ILE  49  -0.313   4.047   0.369
  398   1HG1  ILE  49          2HG1      ILE  49  -0.268   4.958   2.698
  399   2HG1  ILE  49          1HG1      ILE  49  -1.470   5.718   1.662
  400   1HG2  ILE  49          1HG2      ILE  49  -2.760   2.498   0.914
  401   2HG2  ILE  49          2HG2      ILE  49  -2.143   3.160  -0.601
  402   3HG2  ILE  49          3HG2      ILE  49  -2.993   4.206   0.537
  403   1HD1  ILE  49          1HD1      ILE  49  -1.846   4.568   4.180
  404   2HD1  ILE  49          2HD1      ILE  49  -2.646   3.503   3.026
  405   3HD1  ILE  49          3HD1      ILE  49  -3.071   5.213   3.088
  406    H    VAL  50           H        VAL  50  -0.355  -0.096   1.216
  407    HA   VAL  50           HA       VAL  50   1.832   0.171  -0.706
  408    HB   VAL  50           HB       VAL  50   0.634  -2.343   0.463
  409   1HG1  VAL  50          1HG1      VAL  50   3.413  -2.251  -0.530
  410   2HG1  VAL  50          2HG1      VAL  50   2.139  -2.166  -1.747
  411   3HG1  VAL  50          3HG1      VAL  50   2.208  -3.534  -0.637
  412   1HG2  VAL  50          1HG2      VAL  50   3.274  -1.680   1.426
  413   2HG2  VAL  50          2HG2      VAL  50   1.811  -2.068   2.330
  414   3HG2  VAL  50          3HG2      VAL  50   2.115  -0.410   1.815
  415    H    LEU  51           H        LEU  51   1.438   0.052  -2.832
  416    HA   LEU  51           HA       LEU  51  -1.243  -0.649  -3.728
  417   1HB   LEU  51          2HB       LEU  51  -0.100   1.401  -4.561
  418   2HB   LEU  51          1HB       LEU  51   1.096   0.379  -5.335
  419    HG   LEU  51           HG       LEU  51  -0.685  -0.614  -6.737
  420   1HD1  LEU  51          1HD1      LEU  51  -2.613  -0.362  -5.373
  421   2HD1  LEU  51          2HD1      LEU  51  -2.868   0.618  -6.816
  422   3HD1  LEU  51          3HD1      LEU  51  -2.410   1.388  -5.297
  423   1HD2  LEU  51          1HD2      LEU  51  -0.087   2.305  -6.778
  424   2HD2  LEU  51          2HD2      LEU  51  -1.242   1.643  -7.934
  425   3HD2  LEU  51          3HD2      LEU  51   0.414   1.036  -7.894
  426    H    ASP  52           H        ASP  52  -1.509  -2.014  -5.640
  427    HA   ASP  52           HA       ASP  52   0.569  -3.941  -6.219
  428   1HB   ASP  52          2HB       ASP  52  -1.096  -4.579  -4.150
  429   2HB   ASP  52          1HB       ASP  52  -1.957  -5.283  -5.514
  430    H    VAL  53           H        VAL  53   0.476  -3.278  -8.317
  431    HA   VAL  53           HA       VAL  53  -1.958  -3.055  -9.788
  432    HB   VAL  53           HB       VAL  53   0.879  -3.242 -10.813
  433   1HG1  VAL  53          1HG1      VAL  53  -0.380  -3.601 -12.702
  434   2HG1  VAL  53          2HG1      VAL  53  -0.276  -1.841 -12.696
  435   3HG1  VAL  53          3HG1      VAL  53  -1.736  -2.640 -12.114
  436   1HG2  VAL  53          1HG2      VAL  53   0.506  -1.387  -9.219
  437   2HG2  VAL  53          2HG2      VAL  53  -0.782  -0.787 -10.263
  438   3HG2  VAL  53          3HG2      VAL  53   0.880  -0.832 -10.851
  439    H    TRP  54           H        TRP  54  -2.528  -5.366  -8.934
  440    HA   TRP  54           HA       TRP  54  -1.348  -7.623 -10.144
  441   1HB   TRP  54          2HB       TRP  54  -2.744  -7.842  -8.162
  442   2HB   TRP  54          1HB       TRP  54  -4.143  -7.240  -9.043
  443    HD1  TRP  54           HD       TRP  54  -5.738  -9.208  -9.395
  444    HE1  TRP  54           1HE      TRP  54  -5.509 -11.663 -10.134
  445    HE3  TRP  54           3HE      TRP  54  -0.646  -9.471  -9.773
  446    HZ2  TRP  54           2HZ      TRP  54  -3.444 -13.471 -10.792
  447    HZ3  TRP  54           3HZ      TRP  54   0.376 -11.602 -10.463
  448    HH2  TRP  54           HH       TRP  54  -0.994 -13.559 -10.960
  449    H    MET  55           H        MET  55  -4.732  -6.793 -10.803
  450    HA   MET  55           HA       MET  55  -4.145  -6.714 -13.666
  451   1HB   MET  55          2HB       MET  55  -6.248  -8.497 -12.427
  452   2HB   MET  55          1HB       MET  55  -6.009  -8.249 -14.151
  453   1HG   MET  55          2HG       MET  55  -3.877  -9.347 -12.345
  454   2HG   MET  55          1HG       MET  55  -5.046 -10.361 -13.188
  455   1HE   MET  55          1HE       MET  55  -4.194 -11.603 -15.218
  456   2HE   MET  55          2HE       MET  55  -3.800 -10.678 -16.667
  457   3HE   MET  55          3HE       MET  55  -5.317 -10.382 -15.817
  458    HA   PRO  56           HA       PRO  56  -7.684  -3.888 -12.166
  459   1HB   PRO  56          2HB       PRO  56  -6.449  -1.628 -11.427
  460   2HB   PRO  56          1HB       PRO  56  -6.655  -2.972 -10.299
  461   1HG   PRO  56          2HG       PRO  56  -4.248  -2.189 -11.887
  462   2HG   PRO  56          1HG       PRO  56  -4.347  -2.703 -10.196
  463   1HD   PRO  56          2HD       PRO  56  -3.618  -4.357 -12.256
  464   2HD   PRO  56          1HD       PRO  56  -4.365  -4.917 -10.747
  465    H    ASP  57           H        ASP  57  -7.694  -1.272 -12.852
  466    HA   ASP  57           HA       ASP  57  -6.575  -1.114 -15.560
  467   1HB   ASP  57          2HB       ASP  57  -9.430  -0.439 -14.825
  468   2HB   ASP  57          1HB       ASP  57  -8.694  -0.205 -16.407
  469    H    GLY  58           H        GLY  58  -5.866   0.118 -12.957
  470   1HA   GLY  58          2HA       GLY  58  -6.449   2.944 -13.548
  471   2HA   GLY  58          1HA       GLY  58  -5.958   2.322 -11.981
  472    H    ASP  59           H        ASP  59  -3.759   1.747 -11.645
  473    HA   ASP  59           HA       ASP  59  -1.515   2.101 -11.785
  474   1HB   ASP  59          2HB       ASP  59  -2.021   0.731 -13.939
  475   2HB   ASP  59          1HB       ASP  59  -1.756   2.258 -14.776
  476    H    GLY  60           H        GLY  60  -2.719   4.330 -11.103
  477   1HA   GLY  60          2HA       GLY  60  -2.054   6.479 -12.951
  478   2HA   GLY  60          1HA       GLY  60  -2.883   6.647 -11.413
  479    H    VAL  61           H        VAL  61   0.001   7.117 -13.047
  480    HA   VAL  61           HA       VAL  61   1.915   6.753 -11.027
  481    HB   VAL  61           HB       VAL  61   1.902   8.673 -13.362
  482   1HG1  VAL  61          1HG1      VAL  61   4.098   7.841 -11.486
  483   2HG1  VAL  61          2HG1      VAL  61   3.521   9.471 -11.835
  484   3HG1  VAL  61          3HG1      VAL  61   4.400   8.565 -13.066
  485   1HG2  VAL  61          1HG2      VAL  61   3.446   6.116 -13.223
  486   2HG2  VAL  61          2HG2      VAL  61   2.914   7.027 -14.635
  487   3HG2  VAL  61          3HG2      VAL  61   1.745   6.101 -13.692
  488    H    ASN  62           H        ASN  62  -0.220   9.434 -11.827
  489    HA   ASN  62           HA       ASN  62   0.997  11.286 -10.025
  490   1HB   ASN  62          2HB       ASN  62  -0.971  11.383 -12.050
  491   2HB   ASN  62          1HB       ASN  62  -1.746  11.950 -10.574
  492   1HD2  ASN  62          1HD2      ASN  62   0.575  12.608 -13.015
  493   2HD2  ASN  62          2HD2      ASN  62   0.994  14.202 -12.495
  494    H    PHE  63           H        PHE  63  -0.859   8.567  -9.452
  495    HA   PHE  63           HA       PHE  63  -2.610   9.419  -7.431
  496   1HB   PHE  63          2HB       PHE  63  -2.807   7.213  -8.470
  497   2HB   PHE  63          1HB       PHE  63  -1.264   6.730  -7.773
  498    HD1  PHE  63           1HD      PHE  63  -4.442   8.264  -6.559
  499    HD2  PHE  63           2HD      PHE  63  -1.417   5.331  -5.964
  500    HE1  PHE  63           1HE      PHE  63  -5.603   7.486  -4.536
  501    HE2  PHE  63           2HE      PHE  63  -2.574   4.547  -3.938
  502    HZ   PHE  63           HZ       PHE  63  -4.669   5.627  -3.222
  503    H    ILE  64           H        ILE  64   0.784   8.454  -7.330
  504    HA   ILE  64           HA       ILE  64   1.208   8.136  -4.638
  505    HB   ILE  64           HB       ILE  64   3.077   9.629  -6.479
  506   1HG1  ILE  64          2HG1      ILE  64   3.650   6.809  -6.056
  507   2HG1  ILE  64          1HG1      ILE  64   2.075   7.045  -6.808
  508   1HG2  ILE  64          1HG2      ILE  64   4.698   8.259  -4.886
  509   2HG2  ILE  64          2HG2      ILE  64   3.330   8.420  -3.784
  510   3HG2  ILE  64          3HG2      ILE  64   4.093   9.860  -4.460
  511   1HD1  ILE  64          1HD1      ILE  64   4.758   7.441  -7.891
  512   2HD1  ILE  64          2HD1      ILE  64   3.619   8.732  -8.264
  513   3HD1  ILE  64          3HD1      ILE  64   3.242   7.069  -8.710
  514    H    ASP  65           H        ASP  65   0.606  11.096  -6.384
  515    HA   ASP  65           HA       ASP  65   1.414  12.844  -4.268
  516   1HB   ASP  65          2HB       ASP  65   0.855  13.181  -6.940
  517   2HB   ASP  65          1HB       ASP  65  -0.553  13.908  -6.171
  518    H    PHE  66           H        PHE  66  -1.579  11.301  -5.248
  519    HA   PHE  66           HA       PHE  66  -3.363  12.795  -3.675
  520   1HB   PHE  66          2HB       PHE  66  -4.215  11.324  -5.384
  521   2HB   PHE  66          1HB       PHE  66  -3.464   9.924  -4.629
  522    HD1  PHE  66           1HD      PHE  66  -4.360   9.058  -2.483
  523    HD2  PHE  66           2HD      PHE  66  -6.332  12.112  -4.694
  524    HE1  PHE  66           1HE      PHE  66  -6.430   8.630  -1.223
  525    HE2  PHE  66           2HE      PHE  66  -8.405  11.690  -3.438
  526    HZ   PHE  66           HZ       PHE  66  -8.455   9.946  -1.700
  527    H    ILE  67           H        ILE  67  -1.493   9.867  -2.979
  528    HA   ILE  67           HA       ILE  67  -2.500   9.391  -0.401
  529    HB   ILE  67           HB       ILE  67   0.223   8.737  -1.543
  530   1HG1  ILE  67          2HG1      ILE  67  -1.012   6.386  -1.456
  531   2HG1  ILE  67          1HG1      ILE  67  -2.447   7.400  -1.561
  532   1HG2  ILE  67          1HG2      ILE  67   0.715   8.371   0.633
  533   2HG2  ILE  67          2HG2      ILE  67  -0.164   6.869   0.350
  534   3HG2  ILE  67          3HG2      ILE  67  -0.978   8.239   1.106
  535   1HD1  ILE  67          1HD1      ILE  67  -0.471   8.188  -3.505
  536   2HD1  ILE  67          2HD1      ILE  67  -2.153   7.706  -3.733
  537   3HD1  ILE  67          3HD1      ILE  67  -0.886   6.481  -3.658
  538    H    LYS  68           H        LYS  68   0.191  11.384  -1.546
  539    HA   LYS  68           HA       LYS  68   0.962  12.174   1.116
  540   1HB   LYS  68          2HB       LYS  68   1.765  13.417  -1.520
  541   2HB   LYS  68          1HB       LYS  68   2.579  13.607   0.027
  542   1HG   LYS  68          2HG       LYS  68   2.451  10.841  -0.477
  543   2HG   LYS  68          1HG       LYS  68   2.957  11.612  -1.981
  544   1HD   LYS  68          2HD       LYS  68   5.011  11.523  -1.067
  545   2HD   LYS  68          1HD       LYS  68   4.479  12.945  -0.169
  546   1HE   LYS  68          2HE       LYS  68   4.337  11.821   1.780
  547   2HE   LYS  68          1HE       LYS  68   3.723  10.359   1.009
  548   1HZ   LYS  68          1HZ       LYS  68   6.158  10.552   2.045
  549   2HZ   LYS  68          2HZ       LYS  68   6.497  11.022   0.456
  550   3HZ   LYS  68          3HZ       LYS  68   5.782   9.519   0.760
  551    H    GLU  69           H        GLU  69  -1.303  13.218  -1.246
  552    HA   GLU  69           HA       GLU  69  -1.502  15.946  -0.517
  553   1HB   GLU  69          2HB       GLU  69  -2.372  14.856  -2.634
  554   2HB   GLU  69          1HB       GLU  69  -3.710  14.252  -1.667
  555   1HG   GLU  69          2HG       GLU  69  -4.009  16.750  -1.014
  556   2HG   GLU  69          1HG       GLU  69  -3.067  17.049  -2.473
  557    H    ASN  70           H        ASN  70  -3.064  13.007   0.619
  558    HA   ASN  70           HA       ASN  70  -4.340  14.586   2.756
  559   1HB   ASN  70          2HB       ASN  70  -5.401  11.918   1.884
  560   2HB   ASN  70          1HB       ASN  70  -6.239  13.231   2.705
  561   1HD2  ASN  70          1HD2      ASN  70  -4.652  12.425  -0.350
  562   2HD2  ASN  70          2HD2      ASN  70  -5.708  13.359  -1.348
  563    H    SER  71           H        SER  71  -1.753  12.784   2.321
  564    HA   SER  71           HA       SER  71  -1.662  11.919   5.052
  565   1HB   SER  71          2HB       SER  71  -2.323  10.007   2.945
  566   2HB   SER  71          1HB       SER  71  -0.890   9.536   3.857
  567    HG   SER  71           HG       SER  71  -2.064   9.375   5.659
  568    HA   PRO  72           HA       PRO  72   2.359  13.086   2.983
  569   1HB   PRO  72          2HB       PRO  72   2.594  15.045   5.135
  570   2HB   PRO  72          1HB       PRO  72   2.644  15.300   3.389
  571   1HG   PRO  72          2HG       PRO  72   0.578  16.132   4.930
  572   2HG   PRO  72          1HG       PRO  72   0.377  15.633   3.240
  573   1HD   PRO  72          2HD       PRO  72  -0.201  14.108   5.751
  574   2HD   PRO  72          1HD       PRO  72  -1.139  14.196   4.244
  575    H    ASP  73           H        ASP  73   1.302  12.280   6.127
  576    HA   ASP  73           HA       ASP  73   4.018  11.597   6.996
  577   1HB   ASP  73          2HB       ASP  73   2.598  12.971   8.517
  578   2HB   ASP  73          1HB       ASP  73   1.476  11.619   8.629
  579    H    SER  74           H        SER  74   2.538  10.076   4.996
  580    HA   SER  74           HA       SER  74   2.262   7.517   6.433
  581   1HB   SER  74          2HB       SER  74   0.124   8.088   5.523
  582   2HB   SER  74          1HB       SER  74   0.832   8.536   3.972
  583    HG   SER  74           HG       SER  74  -0.027   6.136   4.796
  584    H    VAL  75           H        VAL  75   2.473   5.655   4.633
  585    HA   VAL  75           HA       VAL  75   4.961   6.205   3.148
  586    HB   VAL  75           HB       VAL  75   4.207   3.602   4.500
  587   1HG1  VAL  75          1HG1      VAL  75   6.449   4.436   2.702
  588   2HG1  VAL  75          2HG1      VAL  75   5.514   2.939   2.714
  589   3HG1  VAL  75          3HG1      VAL  75   6.742   3.222   3.948
  590   1HG2  VAL  75          1HG2      VAL  75   5.026   5.753   5.833
  591   2HG2  VAL  75          2HG2      VAL  75   6.599   5.168   5.294
  592   3HG2  VAL  75          3HG2      VAL  75   5.553   4.125   6.259
  593    H    VAL  76           H        VAL  76   5.148   5.340   1.089
  594    HA   VAL  76           HA       VAL  76   2.748   3.970   0.061
  595    HB   VAL  76           HB       VAL  76   4.446   5.718  -1.687
  596   1HG1  VAL  76          1HG1      VAL  76   3.045   4.653  -3.103
  597   2HG1  VAL  76          2HG1      VAL  76   1.933   5.928  -2.604
  598   3HG1  VAL  76          3HG1      VAL  76   1.845   4.334  -1.851
  599   1HG2  VAL  76          1HG2      VAL  76   2.077   6.649  -0.066
  600   2HG2  VAL  76          2HG2      VAL  76   2.931   7.588  -1.291
  601   3HG2  VAL  76          3HG2      VAL  76   3.755   7.124   0.197
  602    H    ILE  77           H        ILE  77   3.446   1.903  -0.024
  603    HA   ILE  77           HA       ILE  77   6.018   1.354  -1.335
  604    HB   ILE  77           HB       ILE  77   4.314  -0.625   0.167
  605   1HG1  ILE  77          2HG1      ILE  77   5.009   1.323   1.598
  606   2HG1  ILE  77          1HG1      ILE  77   5.633  -0.233   2.132
  607   1HG2  ILE  77          1HG2      ILE  77   5.965  -1.552  -1.389
  608   2HG2  ILE  77          2HG2      ILE  77   6.362  -1.924   0.289
  609   3HG2  ILE  77          3HG2      ILE  77   7.238  -0.653  -0.563
  610   1HD1  ILE  77          1HD1      ILE  77   7.495   1.006   0.340
  611   2HD1  ILE  77          2HD1      ILE  77   7.710   0.511   2.021
  612   3HD1  ILE  77          3HD1      ILE  77   7.069   2.112   1.647
  613    H    VAL  78           H        VAL  78   4.915   1.907  -3.395
  614    HA   VAL  78           HA       VAL  78   2.809   0.306  -4.417
  615    HB   VAL  78           HB       VAL  78   4.878   1.792  -6.040
  616   1HG1  VAL  78          1HG1      VAL  78   1.990   1.423  -6.733
  617   2HG1  VAL  78          2HG1      VAL  78   3.166   0.158  -7.084
  618   3HG1  VAL  78          3HG1      VAL  78   3.356   1.761  -7.794
  619   1HG2  VAL  78          1HG2      VAL  78   2.688   2.779  -4.326
  620   2HG2  VAL  78          2HG2      VAL  78   2.806   3.501  -5.931
  621   3HG2  VAL  78          3HG2      VAL  78   4.182   3.569  -4.831
  622    H    ILE  79           H        ILE  79   2.886  -1.753  -4.971
  623    HA   ILE  79           HA       ILE  79   5.393  -2.841  -6.077
  624    HB   ILE  79           HB       ILE  79   3.465  -4.468  -4.430
  625   1HG1  ILE  79          2HG1      ILE  79   6.038  -3.205  -3.472
  626   2HG1  ILE  79          1HG1      ILE  79   4.429  -2.610  -3.079
  627   1HG2  ILE  79          1HG2      ILE  79   5.895  -5.637  -4.207
  628   2HG2  ILE  79          2HG2      ILE  79   6.000  -4.951  -5.829
  629   3HG2  ILE  79          3HG2      ILE  79   4.694  -6.065  -5.425
  630   1HD1  ILE  79          1HD1      ILE  79   3.920  -4.613  -1.872
  631   2HD1  ILE  79          2HD1      ILE  79   5.461  -3.975  -1.295
  632   3HD1  ILE  79          3HD1      ILE  79   5.434  -5.357  -2.390
  633    H    THR  80           H        THR  80   5.094  -4.676  -7.539
  634    HA   THR  80           HA       THR  80   2.437  -5.214  -8.530
  635    HB   THR  80           HB       THR  80   2.757  -4.404 -10.766
  636    HG1  THR  80           1HG      THR  80   4.647  -3.567 -11.479
  637   1HG2  THR  80          1HG2      THR  80   2.014  -2.700  -9.155
  638   2HG2  THR  80          2HG2      THR  80   2.924  -2.025 -10.505
  639   3HG2  THR  80          3HG2      THR  80   3.693  -2.214  -8.929
  640    H    GLY  81           H        GLY  81   4.744  -6.664  -7.398
  641   1HA   GLY  81          2HA       GLY  81   5.882  -8.630  -7.724
  642   2HA   GLY  81          1HA       GLY  81   4.614  -9.005  -8.881
  643    H    HIS  82           H        HIS  82   5.448  -9.640 -10.743
  644    HA   HIS  82           HA       HIS  82   7.984  -8.463 -11.640
  645   1HB   HIS  82          2HB       HIS  82   6.931 -11.127 -11.664
  646   2HB   HIS  82          1HB       HIS  82   7.219 -10.617 -13.325
  647    HD1  HIS  82           1HD      HIS  82   9.423 -11.443 -14.048
  648    HD2  HIS  82           2HD      HIS  82   9.471 -10.213 -10.079
  649    HE1  HIS  82           1HE      HIS  82  11.796 -11.757 -13.275
  650    HE2  HIS  82           2HE      HIS  82  11.785 -11.076 -10.849
  651    H    GLY  83           H        GLY  83   8.145  -7.339 -13.511
  652   1HA   GLY  83          2HA       GLY  83   7.307  -6.987 -15.800
  653   2HA   GLY  83          1HA       GLY  83   5.685  -7.081 -15.129
  654    H    SER  84           H        SER  84   7.024  -4.947 -16.683
  655    HA   SER  84           HA       SER  84   7.104  -2.674 -16.743
  656   1HB   SER  84          2HB       SER  84   5.151  -3.197 -14.533
  657   2HB   SER  84          1HB       SER  84   5.693  -1.546 -14.827
  658    HG   SER  84           HG       SER  84   4.686  -3.206 -16.884
  659    H    VAL  85           H        VAL  85   9.349  -2.645 -16.311
  660    HA   VAL  85           HA       VAL  85  10.270  -2.377 -13.581
  661    HB   VAL  85           HB       VAL  85  11.866  -1.985 -16.112
  662   1HG1  VAL  85          1HG1      VAL  85  13.715  -1.883 -14.828
  663   2HG1  VAL  85          2HG1      VAL  85  13.100  -3.058 -13.665
  664   3HG1  VAL  85          3HG1      VAL  85  12.577  -1.376 -13.579
  665   1HG2  VAL  85          1HG2      VAL  85  10.889  -4.168 -16.234
  666   2HG2  VAL  85          2HG2      VAL  85  11.307  -4.504 -14.554
  667   3HG2  VAL  85          3HG2      VAL  85  12.579  -4.349 -15.767
  668    H    ASP  86           H        ASP  86   9.579  -0.307 -16.314
  669    HA   ASP  86           HA       ASP  86  10.875   2.010 -15.221
  670   1HB   ASP  86          2HB       ASP  86   8.784   1.860 -17.406
  671   2HB   ASP  86          1HB       ASP  86   9.856   3.217 -17.073
  672    H    THR  87           H        THR  87   7.761   0.520 -14.852
  673    HA   THR  87           HA       THR  87   6.357   2.850 -14.004
  674    HB   THR  87           HB       THR  87   5.473   0.454 -14.724
  675    HG1  THR  87           1HG      THR  87   4.193   1.886 -12.644
  676   1HG2  THR  87          1HG2      THR  87   6.548  -0.572 -12.615
  677   2HG2  THR  87          2HG2      THR  87   4.902  -1.035 -13.047
  678   3HG2  THR  87          3HG2      THR  87   5.180   0.145 -11.765
  679    H    ALA  88           H        ALA  88   8.338   0.422 -12.472
  680    HA   ALA  88           HA       ALA  88   7.817   0.904  -9.791
  681   1HB   ALA  88          1HB       ALA  88  10.468   0.205 -11.048
  682   2HB   ALA  88          2HB       ALA  88   9.205  -0.949 -10.623
  683   3HB   ALA  88          3HB       ALA  88  10.023  -0.032  -9.359
  684    H    VAL  89           H        VAL  89  10.455   2.236 -11.747
  685    HA   VAL  89           HA       VAL  89  11.316   4.123  -9.857
  686    HB   VAL  89           HB       VAL  89  12.551   5.160 -11.684
  687   1HG1  VAL  89          1HG1      VAL  89  12.510   2.229 -11.320
  688   2HG1  VAL  89          2HG1      VAL  89  13.814   3.388 -11.059
  689   3HG1  VAL  89          3HG1      VAL  89  13.431   2.844 -12.693
  690   1HG2  VAL  89          1HG2      VAL  89  12.284   4.470 -13.988
  691   2HG2  VAL  89          2HG2      VAL  89  10.749   5.079 -13.370
  692   3HG2  VAL  89          3HG2      VAL  89  11.008   3.342 -13.531
  693    H    LYS  90           H        LYS  90   8.885   4.259 -12.388
  694    HA   LYS  90           HA       LYS  90   8.479   7.079 -12.260
  695   1HB   LYS  90          2HB       LYS  90   7.891   5.770 -14.246
  696   2HB   LYS  90          1HB       LYS  90   6.681   4.895 -13.321
  697   1HG   LYS  90          2HG       LYS  90   5.305   6.793 -13.126
  698   2HG   LYS  90          1HG       LYS  90   6.593   7.876 -13.657
  699   1HD   LYS  90          2HD       LYS  90   6.354   6.094 -15.751
  700   2HD   LYS  90          1HD       LYS  90   4.686   6.329 -15.225
  701   1HE   LYS  90          2HE       LYS  90   5.981   8.864 -15.263
  702   2HE   LYS  90          1HE       LYS  90   6.308   8.051 -16.793
  703   1HZ   LYS  90          1HZ       LYS  90   4.323   8.944 -17.320
  704   2HZ   LYS  90          2HZ       LYS  90   3.794   9.038 -15.716
  705   3HZ   LYS  90          3HZ       LYS  90   3.716   7.567 -16.547
  706    H    ALA  91           H        ALA  91   7.647   4.589 -10.142
  707    HA   ALA  91           HA       ALA  91   5.343   6.086  -9.105
  708   1HB   ALA  91          1HB       ALA  91   4.616   4.087  -8.039
  709   2HB   ALA  91          2HB       ALA  91   6.143   3.274  -8.389
  710   3HB   ALA  91          3HB       ALA  91   5.036   3.677  -9.703
  711    H    ILE  92           H        ILE  92   8.556   4.980  -8.323
  712    HA   ILE  92           HA       ILE  92   8.267   5.681  -5.522
  713    HB   ILE  92           HB       ILE  92  10.502   4.880  -5.204
  714   1HG1  ILE  92          2HG1      ILE  92  10.651   4.793  -8.223
  715   2HG1  ILE  92          1HG1      ILE  92  11.620   5.791  -7.144
  716   1HG2  ILE  92          1HG2      ILE  92  10.281   2.574  -6.145
  717   2HG2  ILE  92          2HG2      ILE  92   8.886   3.145  -7.060
  718   3HG2  ILE  92          3HG2      ILE  92   8.850   3.163  -5.297
  719   1HD1  ILE  92          1HD1      ILE  92  12.272   3.389  -6.189
  720   2HD1  ILE  92          2HD1      ILE  92  13.127   4.155  -7.526
  721   3HD1  ILE  92          3HD1      ILE  92  11.894   2.938  -7.851
  722    H    LYS  93           H        LYS  93   9.792   6.980  -8.420
  723    HA   LYS  93           HA       LYS  93  11.353   8.960  -7.186
  724   1HB   LYS  93          2HB       LYS  93  10.398   8.381  -9.896
  725   2HB   LYS  93          1HB       LYS  93  10.631  10.093  -9.586
  726   1HG   LYS  93          2HG       LYS  93  12.800   9.848  -9.925
  727   2HG   LYS  93          1HG       LYS  93  12.884   8.754  -8.542
  728   1HD   LYS  93          2HD       LYS  93  11.825   7.520 -10.979
  729   2HD   LYS  93          1HD       LYS  93  13.490   8.087 -11.125
  730   1HE   LYS  93          2HE       LYS  93  13.303   6.813  -8.625
  731   2HE   LYS  93          1HE       LYS  93  12.469   5.769  -9.776
  732   1HZ   LYS  93          1HZ       LYS  93  14.929   5.391  -9.499
  733   2HZ   LYS  93          2HZ       LYS  93  15.170   6.862 -10.299
  734   3HZ   LYS  93          3HZ       LYS  93  14.390   5.589 -11.090
  735    H    LYS  94           H        LYS  94   7.956   8.820  -7.976
  736    HA   LYS  94           HA       LYS  94   7.323  11.541  -7.797
  737   1HB   LYS  94          2HB       LYS  94   5.734   9.043  -7.300
  738   2HB   LYS  94          1HB       LYS  94   5.025  10.638  -7.092
  739   1HG   LYS  94          2HG       LYS  94   6.347  10.543  -9.614
  740   2HG   LYS  94          1HG       LYS  94   5.291   9.139  -9.464
  741   1HD   LYS  94          2HD       LYS  94   4.031  10.929 -10.444
  742   2HD   LYS  94          1HD       LYS  94   3.448  10.677  -8.799
  743   1HE   LYS  94          2HE       LYS  94   3.623  13.007  -9.035
  744   2HE   LYS  94          1HE       LYS  94   5.048  12.530  -8.113
  745   1HZ   LYS  94          1HZ       LYS  94   6.071  13.800  -9.648
  746   2HZ   LYS  94          2HZ       LYS  94   4.856  13.605 -10.808
  747   3HZ   LYS  94          3HZ       LYS  94   6.007  12.388 -10.581
  748    H    GLY  95           H        GLY  95   6.721   9.070  -5.289
  749   1HA   GLY  95          2HA       GLY  95   7.896  10.600  -3.208
  750   2HA   GLY  95          1HA       GLY  95   6.156  10.839  -3.220
  751    H    ALA  96           H        ALA  96   7.508   7.776  -4.206
  752    HA   ALA  96           HA       ALA  96   6.192   6.515  -1.939
  753   1HB   ALA  96          1HB       ALA  96   5.855   4.776  -3.294
  754   2HB   ALA  96          2HB       ALA  96   7.553   4.715  -3.770
  755   3HB   ALA  96          3HB       ALA  96   6.444   5.810  -4.594
  756    H    TYR  97           H        TYR  97   7.676   4.221  -1.625
  757    HA   TYR  97           HA       TYR  97  10.143   5.282  -0.441
  758   1HB   TYR  97          2HB       TYR  97   8.693   4.459   1.270
  759   2HB   TYR  97          1HB       TYR  97   8.382   2.973   0.383
  760    HD1  TYR  97           1HD      TYR  97  11.206   4.869   1.928
  761    HD2  TYR  97           2HD      TYR  97   9.560   1.066   0.970
  762    HE1  TYR  97           1HE      TYR  97  13.037   3.776   3.150
  763    HE2  TYR  97           2HE      TYR  97  11.384  -0.040   2.191
  764    HH   TYR  97           HH       TYR  97  12.987   0.709   4.181
  765    H    GLU  98           H        GLU  98   8.916   3.171  -2.781
  766    HA   GLU  98           HA       GLU  98  11.011   2.615  -4.291
  767   1HB   GLU  98          2HB       GLU  98  12.036   0.487  -3.499
  768   2HB   GLU  98          1HB       GLU  98  12.397   1.853  -2.458
  769   1HG   GLU  98          2HG       GLU  98  10.541   1.085  -0.961
  770   2HG   GLU  98          1HG       GLU  98  10.427  -0.363  -1.959
  771    H    PHE  99           H        PHE  99  11.021   0.044  -5.033
  772    HA   PHE  99           HA       PHE  99   8.178  -0.680  -5.322
  773   1HB   PHE  99          2HB       PHE  99   9.873   0.184  -7.344
  774   2HB   PHE  99          1HB       PHE  99   9.891  -1.568  -7.511
  775    HD1  PHE  99           1HD      PHE  99   8.392  -2.423  -9.002
  776    HD2  PHE  99           2HD      PHE  99   7.358   1.107  -6.861
  777    HE1  PHE  99           1HE      PHE  99   6.251  -2.324 -10.213
  778    HE2  PHE  99           2HE      PHE  99   5.217   1.212  -8.070
  779    HZ   PHE  99           HZ       PHE  99   4.659  -0.505  -9.743
  780    H    LEU 100           H        LEU 100   8.263  -2.230  -3.683
  781    HA   LEU 100           HA       LEU 100  10.192  -4.122  -3.199
  782   1HB   LEU 100          2HB       LEU 100   8.040  -3.603  -1.921
  783   2HB   LEU 100          1HB       LEU 100   7.253  -4.720  -3.018
  784    HG   LEU 100           HG       LEU 100   8.462  -6.570  -2.175
  785   1HD1  LEU 100          1HD1      LEU 100  10.239  -6.287  -0.446
  786   2HD1  LEU 100          2HD1      LEU 100  10.208  -4.555  -0.775
  787   3HD1  LEU 100          3HD1      LEU 100  10.676  -5.686  -2.045
  788   1HD2  LEU 100          1HD2      LEU 100   8.084  -6.338   0.330
  789   2HD2  LEU 100          2HD2      LEU 100   6.691  -6.066  -0.719
  790   3HD2  LEU 100          3HD2      LEU 100   7.549  -4.694  -0.018
  791    H    GLU 101           H        GLU 101  11.138  -5.369  -4.678
  792    HA   GLU 101           HA       GLU 101   9.543  -6.572  -6.811
  793   1HB   GLU 101          2HB       GLU 101  11.671  -7.129  -7.848
  794   2HB   GLU 101          1HB       GLU 101  11.648  -5.428  -7.404
  795   1HG   GLU 101          2HG       GLU 101  13.133  -5.744  -5.636
  796   2HG   GLU 101          1HG       GLU 101  12.862  -7.486  -5.601
  797    H    LYS 102           H        LYS 102  10.893  -8.855  -7.377
  798    HA   LYS 102           HA       LYS 102  11.007 -11.066  -6.861
  799   1HB   LYS 102          2HB       LYS 102  11.640  -9.997  -4.104
  800   2HB   LYS 102          1HB       LYS 102  11.842 -11.670  -4.605
  801   1HG   LYS 102          2HG       LYS 102  13.606 -11.148  -6.048
  802   2HG   LYS 102          1HG       LYS 102  13.215  -9.427  -6.042
  803   1HD   LYS 102          2HD       LYS 102  13.807  -9.378  -3.616
  804   2HD   LYS 102          1HD       LYS 102  14.363 -11.046  -3.772
  805   1HE   LYS 102          2HE       LYS 102  15.870 -10.204  -5.640
  806   2HE   LYS 102          1HE       LYS 102  15.474  -8.578  -5.082
  807   1HZ   LYS 102          1HZ       LYS 102  16.657 -10.689  -3.362
  808   2HZ   LYS 102          2HZ       LYS 102  16.414  -9.066  -2.954
  809   3HZ   LYS 102          3HZ       LYS 102  17.552  -9.479  -4.135
  810    HA   PRO 103           HA       PRO 103   6.668 -10.988  -5.252
  811   1HB   PRO 103          2HB       PRO 103   5.643 -12.547  -7.219
  812   2HB   PRO 103          1HB       PRO 103   5.837 -10.799  -7.389
  813   1HG   PRO 103          2HG       PRO 103   7.594 -13.003  -8.397
  814   2HG   PRO 103          1HG       PRO 103   7.065 -11.527  -9.226
  815   1HD   PRO 103          2HD       PRO 103   9.514 -11.765  -8.099
  816   2HD   PRO 103          1HD       PRO 103   8.645 -10.220  -8.173
  817    H    PHE 104           H        PHE 104   5.163 -13.058  -5.101
  818    HA   PHE 104           HA       PHE 104   4.816 -15.071  -4.102
  819   1HB   PHE 104          2HB       PHE 104   7.118 -15.546  -5.907
  820   2HB   PHE 104          1HB       PHE 104   6.850 -16.757  -4.658
  821    HD1  PHE 104           1HD      PHE 104   5.661 -15.343  -7.770
  822    HD2  PHE 104           2HD      PHE 104   4.728 -18.010  -4.588
  823    HE1  PHE 104           1HE      PHE 104   3.905 -16.372  -9.152
  824    HE2  PHE 104           2HE      PHE 104   2.971 -19.043  -5.964
  825    HZ   PHE 104           HZ       PHE 104   2.557 -18.226  -8.250
  826    H    SER 105           H        SER 105   6.258 -12.987  -2.676
  827    HA   SER 105           HA       SER 105   7.162 -14.573  -0.460
  828   1HB   SER 105          2HB       SER 105   9.157 -12.708  -1.766
  829   2HB   SER 105          1HB       SER 105   9.416 -13.672  -0.313
  830    HG   SER 105           HG       SER 105  10.071 -15.164  -1.626
  831    H    VAL 106           H        VAL 106   5.241 -13.381   0.263
  832    HA   VAL 106           HA       VAL 106   5.393 -10.534   0.581
  833    HB   VAL 106           HB       VAL 106   3.229 -11.661   0.338
  834   1HG1  VAL 106          1HG1      VAL 106   4.085 -13.030   2.853
  835   2HG1  VAL 106          2HG1      VAL 106   3.387 -13.716   1.386
  836   3HG1  VAL 106          3HG1      VAL 106   2.373 -12.800   2.502
  837   1HG2  VAL 106          1HG2      VAL 106   2.518 -10.705   2.872
  838   2HG2  VAL 106          2HG2      VAL 106   2.487  -9.825   1.346
  839   3HG2  VAL 106          3HG2      VAL 106   3.915  -9.753   2.376
  840    H    GLU 107           H        GLU 107   6.250 -13.322   2.499
  841    HA   GLU 107           HA       GLU 107   6.284 -12.335   5.060
  842   1HB   GLU 107          2HB       GLU 107   6.993 -14.645   4.137
  843   2HB   GLU 107          1HB       GLU 107   8.597 -13.935   4.020
  844   1HG   GLU 107          2HG       GLU 107   7.871 -13.272   6.561
  845   2HG   GLU 107          1HG       GLU 107   7.108 -14.847   6.357
  846    H    ARG 108           H        ARG 108   8.567 -11.723   2.451
  847    HA   ARG 108           HA       ARG 108  10.487 -10.333   4.018
  848   1HB   ARG 108          2HB       ARG 108  10.798 -11.328   1.679
  849   2HB   ARG 108          1HB       ARG 108   9.981  -9.892   1.076
  850   1HG   ARG 108          2HG       ARG 108  12.209  -9.334   0.870
  851   2HG   ARG 108          1HG       ARG 108  11.774  -8.597   2.414
  852   1HD   ARG 108          2HD       ARG 108  12.924 -10.183   3.644
  853   2HD   ARG 108          1HD       ARG 108  12.864 -11.378   2.349
  854    HE   ARG 108           HE       ARG 108  14.837 -10.547   1.571
  855   1HH1  ARG 108          1HH1      ARG 108  13.341  -8.110   3.574
  856   2HH1  ARG 108          2HH1      ARG 108  14.689  -7.028   3.480
  857   1HH2  ARG 108          1HH2      ARG 108  16.610  -9.123   1.448
  858   2HH2  ARG 108          2HH2      ARG 108  16.545  -7.602   2.273
  859    H    PHE 109           H        PHE 109   7.660  -9.374   2.152
  860    HA   PHE 109           HA       PHE 109   7.940  -6.599   2.284
  861   1HB   PHE 109          2HB       PHE 109   6.277  -7.358   0.824
  862   2HB   PHE 109          1HB       PHE 109   5.596  -8.457   2.013
  863    HD1  PHE 109           1HD      PHE 109   5.420  -5.201   0.536
  864    HD2  PHE 109           2HD      PHE 109   4.281  -7.494   3.934
  865    HE1  PHE 109           1HE      PHE 109   3.686  -3.543   1.068
  866    HE2  PHE 109           2HE      PHE 109   2.542  -5.838   4.474
  867    HZ   PHE 109           HZ       PHE 109   2.243  -3.858   3.038
  868    H    LEU 110           H        LEU 110   6.998  -8.929   4.663
  869    HA   LEU 110           HA       LEU 110   5.606  -7.362   6.495
  870   1HB   LEU 110          2HB       LEU 110   6.351  -9.928   6.386
  871   2HB   LEU 110          1HB       LEU 110   7.508  -9.341   7.562
  872    HG   LEU 110           HG       LEU 110   4.538  -8.932   7.847
  873   1HD1  LEU 110          1HD1      LEU 110   4.671 -10.791   9.499
  874   2HD1  LEU 110          2HD1      LEU 110   6.285 -11.152   8.884
  875   3HD1  LEU 110          3HD1      LEU 110   4.885 -11.293   7.820
  876   1HD2  LEU 110          1HD2      LEU 110   6.911  -8.146   9.349
  877   2HD2  LEU 110          2HD2      LEU 110   5.711  -8.985  10.333
  878   3HD2  LEU 110          3HD2      LEU 110   5.258  -7.535   9.436
  879    H    LEU 111           H        LEU 111   9.078  -8.011   6.259
  880    HA   LEU 111           HA       LEU 111   9.977  -6.636   8.474
  881   1HB   LEU 111          2HB       LEU 111  11.212  -7.135   5.793
  882   2HB   LEU 111          1HB       LEU 111  12.067  -6.234   7.031
  883    HG   LEU 111           HG       LEU 111  11.771  -8.229   8.547
  884   1HD1  LEU 111          1HD1      LEU 111  10.616  -9.316   6.021
  885   2HD1  LEU 111          2HD1      LEU 111  10.068  -9.514   7.686
  886   3HD1  LEU 111          3HD1      LEU 111  11.491 -10.387   7.115
  887   1HD2  LEU 111          1HD2      LEU 111  13.921  -8.056   7.772
  888   2HD2  LEU 111          2HD2      LEU 111  13.438  -8.178   6.080
  889   3HD2  LEU 111          3HD2      LEU 111  13.462  -9.619   7.097
  890    H    THR 112           H        THR 112   9.657  -5.352   5.162
  891    HA   THR 112           HA       THR 112  10.483  -2.765   5.622
  892    HB   THR 112           HB       THR 112   8.271  -3.668   3.769
  893    HG1  THR 112           1HG      THR 112   9.825  -4.156   2.368
  894   1HG2  THR 112          1HG2      THR 112   8.845  -1.768   2.390
  895   2HG2  THR 112          2HG2      THR 112  10.050  -1.249   3.568
  896   3HG2  THR 112          3HG2      THR 112   8.338  -1.232   3.991
  897    H    ILE 113           H        ILE 113   7.094  -3.870   5.625
  898    HA   ILE 113           HA       ILE 113   5.674  -1.727   6.254
  899    HB   ILE 113           HB       ILE 113   5.469  -4.487   7.399
  900   1HG1  ILE 113          2HG1      ILE 113   4.839  -4.030   5.047
  901   2HG1  ILE 113          1HG1      ILE 113   3.476  -4.590   6.014
  902   1HG2  ILE 113          1HG2      ILE 113   3.957  -2.080   8.285
  903   2HG2  ILE 113          2HG2      ILE 113   4.513  -3.471   9.218
  904   3HG2  ILE 113          3HG2      ILE 113   3.109  -3.622   8.159
  905   1HD1  ILE 113          1HD1      ILE 113   4.041  -1.819   5.019
  906   2HD1  ILE 113          2HD1      ILE 113   2.868  -2.146   6.297
  907   3HD1  ILE 113          3HD1      ILE 113   2.645  -2.846   4.693
  908    H    LYS 114           H        LYS 114   7.100  -3.616   8.943
  909    HA   LYS 114           HA       LYS 114   6.571  -1.821  10.970
  910   1HB   LYS 114          2HB       LYS 114   7.865  -4.175  10.863
  911   2HB   LYS 114          1HB       LYS 114   9.238  -3.093  11.050
  912   1HG   LYS 114          2HG       LYS 114   6.857  -3.172  12.888
  913   2HG   LYS 114          1HG       LYS 114   8.392  -3.990  13.187
  914   1HD   LYS 114          2HD       LYS 114   9.174  -2.126  14.111
  915   2HD   LYS 114          1HD       LYS 114   9.005  -1.307  12.558
  916   1HE   LYS 114          2HE       LYS 114   7.574   0.037  13.634
  917   2HE   LYS 114          1HE       LYS 114   6.436  -1.302  13.492
  918   1HZ   LYS 114          1HZ       LYS 114   6.331  -1.159  15.704
  919   2HZ   LYS 114          2HZ       LYS 114   7.752  -0.250  15.825
  920   3HZ   LYS 114          3HZ       LYS 114   7.832  -1.937  15.715
  921    H    HIS 115           H        HIS 115   9.594  -2.096   9.166
  922    HA   HIS 115           HA       HIS 115  10.867   0.185  10.059
  923   1HB   HIS 115          2HB       HIS 115  10.974  -1.167   7.369
  924   2HB   HIS 115          1HB       HIS 115  12.029   0.173   7.805
  925    HD1  HIS 115           1HD      HIS 115  11.219  -3.355   8.937
  926    HD2  HIS 115           2HD      HIS 115  14.278  -0.552   9.165
  927    HE1  HIS 115           1HE      HIS 115  13.153  -4.557  10.002
  928    HE2  HIS 115           2HE      HIS 115  15.023  -2.868  10.040
  929    H    ALA 116           H        ALA 116   8.210  -0.104   7.810
  930    HA   ALA 116           HA       ALA 116   8.462   2.494   6.658
  931   1HB   ALA 116          1HB       ALA 116   5.894   0.950   6.849
  932   2HB   ALA 116          2HB       ALA 116   7.182   0.480   5.739
  933   3HB   ALA 116          3HB       ALA 116   6.424   2.065   5.589
  934    H    PHE 117           H        PHE 117   6.793   1.180   9.458
  935    HA   PHE 117           HA       PHE 117   5.245   3.507  10.008
  936   1HB   PHE 117          2HB       PHE 117   5.943   1.020  11.525
  937   2HB   PHE 117          1HB       PHE 117   5.186   2.366  12.367
  938    HD1  PHE 117           1HD      PHE 117   2.891   2.962  11.949
  939    HD2  PHE 117           2HD      PHE 117   4.742  -0.222   9.817
  940    HE1  PHE 117           1HE      PHE 117   0.683   2.194  11.183
  941    HE2  PHE 117           2HE      PHE 117   2.538  -0.993   9.049
  942    HZ   PHE 117           HZ       PHE 117   0.508   0.211   9.734
  943    H    GLU 118           H        GLU 118   8.381   2.312  11.102
  944    HA   GLU 118           HA       GLU 118   8.742   4.460  12.985
  945   1HB   GLU 118          2HB       GLU 118  10.791   2.503  11.937
  946   2HB   GLU 118          1HB       GLU 118  10.931   3.499  13.379
  947   1HG   GLU 118          2HG       GLU 118   8.601   1.693  13.247
  948   2HG   GLU 118          1HG       GLU 118  10.184   0.936  13.426
  949    H    GLU 119           H        GLU 119   9.812   3.709   9.714
  950    HA   GLU 119           HA       GLU 119  11.650   5.888   9.550
  951   1HB   GLU 119          2HB       GLU 119  10.416   4.096   7.474
  952   2HB   GLU 119          1HB       GLU 119  11.540   5.385   7.068
  953   1HG   GLU 119          2HG       GLU 119  13.278   4.352   8.362
  954   2HG   GLU 119          1HG       GLU 119  12.161   3.122   8.949
  955    H    TYR 120           H        TYR 120   8.325   5.836   9.620
  956    HA   TYR 120           HA       TYR 120   8.213   8.534   8.526
  957   1HB   TYR 120          2HB       TYR 120   7.375   6.391   6.987
  958   2HB   TYR 120          1HB       TYR 120   5.881   6.979   7.708
  959    HD1  TYR 120           1HD      TYR 120   5.867   9.741   7.711
  960    HD2  TYR 120           2HD      TYR 120   7.790   7.211   4.883
  961    HE1  TYR 120           1HE      TYR 120   5.771  11.543   6.042
  962    HE2  TYR 120           2HE      TYR 120   7.700   9.007   3.206
  963    HH   TYR 120           HH       TYR 120   7.378  12.024   3.757
  964    H    SER 121           H        SER 121   8.171   7.759  11.190
  965    HA   SER 121           HA       SER 121   5.449   7.603  12.120
  966   1HB   SER 121          2HB       SER 121   6.514   7.849  14.386
  967   2HB   SER 121          1HB       SER 121   7.132   6.496  13.440
  968    HG   SER 121           HG       SER 121   8.353   9.040  13.749
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1  -2.580  -1.380  16.323
    2   2H    MET   1          2HT       MET   1  -3.333   0.103  15.901
    3   3H    MET   1          3HT       MET   1  -3.169  -0.339  17.551
    4    HA   MET   1           HA       MET   1  -1.562   1.259  17.117
    5   1HB   MET   1          2HB       MET   1  -0.875  -1.547  17.594
    6   2HB   MET   1          1HB       MET   1   0.485  -0.595  17.016
    7   1HG   MET   1          2HG       MET   1  -0.453   1.069  18.893
    8   2HG   MET   1          1HG       MET   1  -0.967  -0.473  19.577
    9   1HE   MET   1          1HE       MET   1   2.413   1.750  20.259
   10   2HE   MET   1          2HE       MET   1   1.836   0.778  21.613
   11   3HE   MET   1          3HE       MET   1   0.691   1.701  20.638
   12    H    LYS   2           H        LYS   2  -1.315  -1.397  14.770
   13    HA   LYS   2           HA       LYS   2  -0.046   0.489  12.900
   14   1HB   LYS   2          2HB       LYS   2   0.654  -2.280  13.629
   15   2HB   LYS   2          1HB       LYS   2   0.734  -1.889  11.916
   16   1HG   LYS   2          2HG       LYS   2   2.892  -1.586  12.978
   17   2HG   LYS   2          1HG       LYS   2   2.254  -0.044  12.402
   18   1HD   LYS   2          2HD       LYS   2   1.657   0.631  14.593
   19   2HD   LYS   2          1HD       LYS   2   1.913  -0.992  15.238
   20   1HE   LYS   2          2HE       LYS   2   4.355  -0.557  14.276
   21   2HE   LYS   2          1HE       LYS   2   3.882   1.119  14.552
   22   1HZ   LYS   2          1HZ       LYS   2   3.692  -0.993  16.624
   23   2HZ   LYS   2          2HZ       LYS   2   3.517   0.675  16.839
   24   3HZ   LYS   2          3HZ       LYS   2   5.030   0.028  16.454
   25    H    ARG   3           H        ARG   3  -1.147   0.886  11.110
   26    HA   ARG   3           HA       ARG   3  -2.987  -1.151  10.074
   27   1HB   ARG   3          2HB       ARG   3  -3.727   1.770  10.173
   28   2HB   ARG   3          1HB       ARG   3  -4.761   0.405   9.775
   29   1HG   ARG   3          2HG       ARG   3  -5.444   0.867  11.907
   30   2HG   ARG   3          1HG       ARG   3  -4.207  -0.353  12.211
   31   1HD   ARG   3          2HD       ARG   3  -3.212   1.101  13.566
   32   2HD   ARG   3          1HD       ARG   3  -2.838   2.079  12.147
   33    HE   ARG   3           HE       ARG   3  -5.467   2.602  13.082
   34   1HH1  ARG   3          1HH1      ARG   3  -2.109   3.250  13.778
   35   2HH1  ARG   3          2HH1      ARG   3  -2.434   4.749  14.580
   36   1HH2  ARG   3          1HH2      ARG   3  -5.897   4.575  14.135
   37   2HH2  ARG   3          2HH2      ARG   3  -4.585   5.503  14.783
   38    H    VAL   4           H        VAL   4  -2.621  -1.536   7.990
   39    HA   VAL   4           HA       VAL   4  -1.389   0.596   6.363
   40    HB   VAL   4           HB       VAL   4  -0.911  -2.364   6.014
   41   1HG1  VAL   4          1HG1      VAL   4   1.084  -0.607   4.913
   42   2HG1  VAL   4          2HG1      VAL   4  -0.512  -0.196   4.289
   43   3HG1  VAL   4          3HG1      VAL   4   0.108  -1.836   4.110
   44   1HG2  VAL   4          1HG2      VAL   4   0.941  -0.318   7.240
   45   2HG2  VAL   4          2HG2      VAL   4   1.268  -2.036   7.011
   46   3HG2  VAL   4          3HG2      VAL   4   0.024  -1.518   8.149
   47    H    LEU   5           H        LEU   5  -2.129   0.853   4.278
   48    HA   LEU   5           HA       LEU   5  -4.733  -0.306   3.715
   49   1HB   LEU   5          2HB       LEU   5  -4.216   2.162   3.510
   50   2HB   LEU   5          1HB       LEU   5  -3.238   1.762   2.111
   51    HG   LEU   5           HG       LEU   5  -5.207   0.896   0.953
   52   1HD1  LEU   5          1HD1      LEU   5  -7.453   1.340   1.992
   53   2HD1  LEU   5          2HD1      LEU   5  -6.608   1.611   3.516
   54   3HD1  LEU   5          3HD1      LEU   5  -6.522   0.037   2.728
   55   1HD2  LEU   5          1HD2      LEU   5  -6.558   3.146   1.068
   56   2HD2  LEU   5          2HD2      LEU   5  -4.939   3.097   0.374
   57   3HD2  LEU   5          3HD2      LEU   5  -5.173   3.675   2.024
   58    H    VAL   6           H        VAL   6  -5.132  -1.793   2.180
   59    HA   VAL   6           HA       VAL   6  -2.878  -2.552   0.425
   60    HB   VAL   6           HB       VAL   6  -5.031  -4.435   1.359
   61   1HG1  VAL   6          1HG1      VAL   6  -3.864  -5.014  -0.723
   62   2HG1  VAL   6          2HG1      VAL   6  -3.518  -6.158   0.575
   63   3HG1  VAL   6          3HG1      VAL   6  -2.324  -4.937   0.134
   64   1HG2  VAL   6          1HG2      VAL   6  -3.711  -5.167   3.120
   65   2HG2  VAL   6          2HG2      VAL   6  -3.490  -3.420   3.180
   66   3HG2  VAL   6          3HG2      VAL   6  -2.247  -4.441   2.458
   67    H    VAL   7           H        VAL   7  -3.555  -1.274  -1.313
   68    HA   VAL   7           HA       VAL   7  -6.216  -1.548  -2.385
   69    HB   VAL   7           HB       VAL   7  -3.796  -0.252  -3.654
   70   1HG1  VAL   7          1HG1      VAL   7  -6.720  -0.247  -4.305
   71   2HG1  VAL   7          2HG1      VAL   7  -5.343  -0.541  -5.368
   72   3HG1  VAL   7          3HG1      VAL   7  -5.677   1.090  -4.787
   73   1HG2  VAL   7          1HG2      VAL   7  -5.786   0.742  -1.663
   74   2HG2  VAL   7          2HG2      VAL   7  -5.102   1.858  -2.846
   75   3HG2  VAL   7          3HG2      VAL   7  -4.041   0.994  -1.733
   76    H    ASP   8           H        ASP   8  -6.828  -3.290  -3.484
   77    HA   ASP   8           HA       ASP   8  -5.178  -4.300  -5.632
   78   1HB   ASP   8          2HB       ASP   8  -4.303  -5.566  -3.728
   79   2HB   ASP   8          1HB       ASP   8  -5.931  -6.081  -3.301
   80    H    ASP   9           H        ASP   9  -6.325  -5.642  -7.091
   81    HA   ASP   9           HA       ASP   9  -9.184  -5.159  -7.058
   82   1HB   ASP   9          2HB       ASP   9  -7.685  -4.836  -9.093
   83   2HB   ASP   9          1HB       ASP   9  -7.616  -6.590  -9.203
   84    H    GLU  10           H        GLU  10  -8.631  -6.846  -5.035
   85    HA   GLU  10           HA       GLU  10  -9.424  -9.502  -6.031
   86   1HB   GLU  10          2HB       GLU  10  -7.267  -8.941  -4.488
   87   2HB   GLU  10          1HB       GLU  10  -8.471  -9.244  -3.243
   88   1HG   GLU  10          2HG       GLU  10  -8.227 -11.421  -3.509
   89   2HG   GLU  10          1HG       GLU  10  -8.686 -11.286  -5.205
   90    H    GLU  11           H        GLU  11 -10.360 -10.598  -3.684
   91    HA   GLU  11           HA       GLU  11 -12.979  -9.459  -3.555
   92   1HB   GLU  11          2HB       GLU  11 -12.403 -11.925  -3.388
   93   2HB   GLU  11          1HB       GLU  11 -11.857 -11.598  -1.748
   94   1HG   GLU  11          2HG       GLU  11 -13.933 -12.010  -1.099
   95   2HG   GLU  11          1HG       GLU  11 -14.375 -10.469  -1.837
   96    H    SER  12           H        SER  12 -10.291  -9.766  -1.252
   97    HA   SER  12           HA       SER  12 -11.223  -7.385   0.123
   98   1HB   SER  12          2HB       SER  12 -10.742  -8.869   2.329
   99   2HB   SER  12          1HB       SER  12 -12.349  -8.668   1.630
  100    HG   SER  12           HG       SER  12 -10.736 -10.891   1.732
  101    H    ILE  13           H        ILE  13  -9.039  -9.969   1.196
  102    HA   ILE  13           HA       ILE  13  -6.890  -7.998   1.393
  103    HB   ILE  13           HB       ILE  13  -6.706 -10.849   2.315
  104   1HG1  ILE  13          2HG1      ILE  13  -8.758  -9.824   3.275
  105   2HG1  ILE  13          1HG1      ILE  13  -7.541 -10.186   4.496
  106   1HG2  ILE  13          1HG2      ILE  13  -4.610  -9.935   2.470
  107   2HG2  ILE  13          2HG2      ILE  13  -5.257  -9.557   4.067
  108   3HG2  ILE  13          3HG2      ILE  13  -5.221  -8.317   2.813
  109   1HD1  ILE  13          1HD1      ILE  13  -6.833  -7.755   4.273
  110   2HD1  ILE  13          2HD1      ILE  13  -8.378  -8.081   5.061
  111   3HD1  ILE  13          3HD1      ILE  13  -8.341  -7.520   3.389
  112    H    THR  14           H        THR  14  -4.686  -8.680   0.790
  113    HA   THR  14           HA       THR  14  -4.724  -9.902  -1.848
  114    HB   THR  14           HB       THR  14  -2.419  -9.046  -2.038
  115    HG1  THR  14           1HG      THR  14  -1.535  -7.865  -0.356
  116   1HG2  THR  14          1HG2      THR  14  -2.880  -6.601  -1.731
  117   2HG2  THR  14          2HG2      THR  14  -4.449  -7.057  -1.066
  118   3HG2  THR  14          3HG2      THR  14  -4.043  -7.472  -2.731
  119    H    SER  15           H        SER  15  -2.892 -11.412  -2.413
  120    HA   SER  15           HA       SER  15  -2.955 -13.629  -0.636
  121   1HB   SER  15          2HB       SER  15  -2.889 -14.136  -2.947
  122   2HB   SER  15          1HB       SER  15  -1.488 -13.097  -3.215
  123    HG   SER  15           HG       SER  15  -0.220 -14.664  -2.604
  124    H    SER  16           H        SER  16  -1.567 -14.309   0.855
  125    HA   SER  16           HA       SER  16   0.328 -14.570   2.097
  126   1HB   SER  16          2HB       SER  16   1.808 -12.642   0.324
  127   2HB   SER  16          1HB       SER  16   2.447 -13.989   1.265
  128    HG   SER  16           HG       SER  16   1.773 -15.382  -0.231
  129    H    LEU  17           H        LEU  17  -1.288 -11.691   1.633
  130    HA   LEU  17           HA       LEU  17   0.311 -10.153   3.513
  131   1HB   LEU  17          2HB       LEU  17  -1.082  -9.381   1.370
  132   2HB   LEU  17          1HB       LEU  17  -2.352  -9.226   2.560
  133    HG   LEU  17           HG       LEU  17  -0.263  -7.392   1.918
  134   1HD1  LEU  17          1HD1      LEU  17  -2.368  -6.524   2.195
  135   2HD1  LEU  17          2HD1      LEU  17  -1.582  -6.064   3.705
  136   3HD1  LEU  17          3HD1      LEU  17  -2.677  -7.447   3.664
  137   1HD2  LEU  17          1HD2      LEU  17   0.305  -6.848   4.365
  138   2HD2  LEU  17          2HD2      LEU  17   1.196  -8.144   3.570
  139   3HD2  LEU  17          3HD2      LEU  17  -0.112  -8.530   4.688
  140    H    SER  18           H        SER  18  -3.078 -11.246   3.279
  141    HA   SER  18           HA       SER  18  -4.020 -10.494   5.731
  142   1HB   SER  18          2HB       SER  18  -5.147 -11.815   3.753
  143   2HB   SER  18          1HB       SER  18  -4.734 -13.224   4.731
  144    HG   SER  18           HG       SER  18  -6.138 -10.990   5.758
  145    H    ALA  19           H        ALA  19  -2.565 -13.678   5.033
  146    HA   ALA  19           HA       ALA  19  -2.563 -14.696   7.608
  147   1HB   ALA  19          1HB       ALA  19  -1.758 -15.635   5.224
  148   2HB   ALA  19          2HB       ALA  19  -1.336 -16.396   6.758
  149   3HB   ALA  19          3HB       ALA  19  -0.189 -15.318   5.965
  150    H    ILE  20           H        ILE  20  -0.234 -12.579   6.038
  151    HA   ILE  20           HA       ILE  20   1.738 -12.630   8.051
  152    HB   ILE  20           HB       ILE  20   1.096 -10.681   5.853
  153   1HG1  ILE  20          2HG1      ILE  20   3.459 -12.495   6.356
  154   2HG1  ILE  20          1HG1      ILE  20   2.106 -12.862   5.290
  155   1HG2  ILE  20          1HG2      ILE  20   2.930 -10.304   8.145
  156   2HG2  ILE  20          2HG2      ILE  20   2.066  -9.113   7.173
  157   3HG2  ILE  20          3HG2      ILE  20   3.536  -9.861   6.549
  158   1HD1  ILE  20          1HD1      ILE  20   4.440 -11.170   4.853
  159   2HD1  ILE  20          2HD1      ILE  20   2.916 -10.450   4.344
  160   3HD1  ILE  20          3HD1      ILE  20   3.411 -12.013   3.696
  161    H    LEU  21           H        LEU  21  -0.479  -9.913   7.307
  162    HA   LEU  21           HA       LEU  21  -0.035  -8.398   9.545
  163   1HB   LEU  21          2HB       LEU  21  -2.731  -8.830   8.273
  164   2HB   LEU  21          1HB       LEU  21  -2.219  -7.430   9.201
  165    HG   LEU  21           HG       LEU  21  -0.465  -7.955   6.939
  166   1HD1  LEU  21          1HD1      LEU  21  -1.975  -8.433   5.390
  167   2HD1  LEU  21          2HD1      LEU  21  -2.606  -6.802   5.615
  168   3HD1  LEU  21          3HD1      LEU  21  -3.313  -8.152   6.503
  169   1HD2  LEU  21          1HD2      LEU  21  -2.102  -5.577   7.802
  170   2HD2  LEU  21          2HD2      LEU  21  -0.850  -5.566   6.559
  171   3HD2  LEU  21          3HD2      LEU  21  -0.424  -5.906   8.236
  172    H    GLU  22           H        GLU  22  -1.875 -11.346   9.284
  173    HA   GLU  22           HA       GLU  22  -3.248 -11.140  11.759
  174   1HB   GLU  22          2HB       GLU  22  -3.553 -12.734   9.650
  175   2HB   GLU  22          1HB       GLU  22  -2.585 -13.808  10.651
  176   1HG   GLU  22          2HG       GLU  22  -4.308 -13.244  12.493
  177   2HG   GLU  22          1HG       GLU  22  -5.316 -12.713  11.148
  178    H    GLU  23           H        GLU  23  -0.070 -12.221  10.826
  179    HA   GLU  23           HA       GLU  23   0.451 -13.521  13.353
  180   1HB   GLU  23          2HB       GLU  23   1.541 -14.519  11.513
  181   2HB   GLU  23          1HB       GLU  23   2.081 -12.969  10.884
  182   1HG   GLU  23          2HG       GLU  23   3.951 -13.019  12.075
  183   2HG   GLU  23          1HG       GLU  23   3.105 -13.502  13.543
  184    H    GLU  24           H        GLU  24   1.164 -10.469  11.764
  185    HA   GLU  24           HA       GLU  24   2.906  -9.566  13.874
  186   1HB   GLU  24          2HB       GLU  24   1.783  -8.263  11.409
  187   2HB   GLU  24          1HB       GLU  24   2.701  -7.355  12.603
  188   1HG   GLU  24          2HG       GLU  24   3.828  -9.847  11.399
  189   2HG   GLU  24          1HG       GLU  24   3.908  -8.312  10.534
  190    H    GLY  25           H        GLY  25  -0.419  -9.016  12.846
  191   1HA   GLY  25          2HA       GLY  25  -2.160  -8.560  14.399
  192   2HA   GLY  25          1HA       GLY  25  -0.965  -7.857  15.477
  193    H    TYR  26           H        TYR  26  -1.134  -7.143  12.063
  194    HA   TYR  26           HA       TYR  26  -1.398  -4.329  12.631
  195   1HB   TYR  26          2HB       TYR  26  -0.956  -5.966  10.159
  196   2HB   TYR  26          1HB       TYR  26  -1.425  -4.279  10.016
  197    HD1  TYR  26           1HD      TYR  26   0.398  -3.038   9.373
  198    HD2  TYR  26           2HD      TYR  26   0.918  -6.051  12.329
  199    HE1  TYR  26           1HE      TYR  26   2.739  -2.347   9.652
  200    HE2  TYR  26           2HE      TYR  26   3.263  -5.369  12.618
  201    HH   TYR  26           HH       TYR  26   4.496  -2.491  11.490
  202    H    HIS  27           H        HIS  27  -2.846  -3.274  10.666
  203    HA   HIS  27           HA       HIS  27  -5.512  -4.492  10.792
  204   1HB   HIS  27          2HB       HIS  27  -4.769  -2.265  12.304
  205   2HB   HIS  27          1HB       HIS  27  -5.633  -1.587  10.927
  206    HD1  HIS  27           1HD      HIS  27  -6.569  -4.897  12.444
  207    HD2  HIS  27           2HD      HIS  27  -7.922  -0.969  12.363
  208    HE1  HIS  27           1HE      HIS  27  -8.854  -4.952  13.491
  209    HE2  HIS  27           2HE      HIS  27  -9.613  -2.549  13.518
  210    HA   PRO  28           HA       PRO  28  -4.581  -3.224   6.502
  211   1HB   PRO  28          2HB       PRO  28  -5.614  -5.396   5.299
  212   2HB   PRO  28          1HB       PRO  28  -4.000  -5.397   6.018
  213   1HG   PRO  28          2HG       PRO  28  -6.553  -6.513   7.086
  214   2HG   PRO  28          1HG       PRO  28  -4.913  -7.171   7.184
  215   1HD   PRO  28          2HD       PRO  28  -6.182  -5.804   9.219
  216   2HD   PRO  28          1HD       PRO  28  -4.425  -5.968   9.062
  217    H    ASP  29           H        ASP  29  -5.872  -1.899   5.444
  218    HA   ASP  29           HA       ASP  29  -8.756  -2.149   5.857
  219   1HB   ASP  29          2HB       ASP  29  -7.756   0.038   6.428
  220   2HB   ASP  29          1HB       ASP  29  -7.253   0.217   4.752
  221    H    THR  30           H        THR  30  -6.659  -3.190   3.750
  222    HA   THR  30           HA       THR  30  -6.641  -3.070   1.340
  223    HB   THR  30           HB       THR  30  -7.260  -5.253   0.839
  224    HG1  THR  30           1HG      THR  30  -9.401  -5.323   1.261
  225   1HG2  THR  30          1HG2      THR  30  -6.241  -6.470   2.434
  226   2HG2  THR  30          2HG2      THR  30  -7.206  -5.776   3.736
  227   3HG2  THR  30          3HG2      THR  30  -5.845  -4.875   3.073
  228    H    ALA  31           H        ALA  31  -7.505  -2.154  -0.325
  229    HA   ALA  31           HA       ALA  31 -10.414  -1.700  -0.380
  230   1HB   ALA  31          1HB       ALA  31  -8.817   0.289  -0.350
  231   2HB   ALA  31          2HB       ALA  31 -10.051   0.274  -1.610
  232   3HB   ALA  31          3HB       ALA  31  -8.389  -0.174  -1.997
  233    H    LYS  32           H        LYS  32 -10.526  -0.987  -3.135
  234    HA   LYS  32           HA       LYS  32 -10.031  -3.618  -4.366
  235   1HB   LYS  32          2HB       LYS  32 -12.080  -1.687  -5.403
  236   2HB   LYS  32          1HB       LYS  32 -12.011  -3.434  -5.590
  237   1HG   LYS  32          2HG       LYS  32 -12.671  -3.762  -3.306
  238   2HG   LYS  32          1HG       LYS  32 -12.577  -2.028  -2.990
  239   1HD   LYS  32          2HD       LYS  32 -14.500  -1.572  -4.183
  240   2HD   LYS  32          1HD       LYS  32 -14.364  -3.034  -5.162
  241   1HE   LYS  32          2HE       LYS  32 -16.204  -3.257  -3.612
  242   2HE   LYS  32          1HE       LYS  32 -14.919  -4.382  -3.176
  243   1HZ   LYS  32          1HZ       LYS  32 -15.895  -2.035  -1.750
  244   2HZ   LYS  32          2HZ       LYS  32 -14.231  -2.331  -1.673
  245   3HZ   LYS  32          3HZ       LYS  32 -15.327  -3.509  -1.147
  246    H    THR  33           H        THR  33  -9.758  -0.156  -4.742
  247    HA   THR  33           HA       THR  33  -7.685  -0.464  -6.689
  248    HB   THR  33           HB       THR  33  -9.847   1.245  -7.773
  249    HG1  THR  33           1HG      THR  33 -10.893  -0.578  -8.681
  250   1HG2  THR  33          1HG2      THR  33  -7.558  -0.237  -8.762
  251   2HG2  THR  33          2HG2      THR  33  -8.396   1.154  -9.449
  252   3HG2  THR  33          3HG2      THR  33  -9.008  -0.476  -9.738
  253    H    LEU  34           H        LEU  34  -7.373   1.969  -7.691
  254    HA   LEU  34           HA       LEU  34  -6.499   3.503  -5.500
  255   1HB   LEU  34          2HB       LEU  34  -6.970   4.482  -8.314
  256   2HB   LEU  34          1HB       LEU  34  -5.897   5.187  -7.119
  257    HG   LEU  34           HG       LEU  34  -5.454   2.373  -8.042
  258   1HD1  LEU  34          1HD1      LEU  34  -4.142   4.677  -9.418
  259   2HD1  LEU  34          2HD1      LEU  34  -5.698   4.067  -9.982
  260   3HD1  LEU  34          3HD1      LEU  34  -4.295   3.000  -9.939
  261   1HD2  LEU  34          1HD2      LEU  34  -4.263   3.789  -6.113
  262   2HD2  LEU  34          2HD2      LEU  34  -3.277   4.292  -7.485
  263   3HD2  LEU  34          3HD2      LEU  34  -3.415   2.583  -7.080
  264    H    ARG  35           H        ARG  35  -9.314   3.832  -7.635
  265    HA   ARG  35           HA       ARG  35 -10.307   6.239  -6.630
  266   1HB   ARG  35          2HB       ARG  35 -11.162   5.100  -8.662
  267   2HB   ARG  35          1HB       ARG  35 -11.904   3.876  -7.640
  268   1HG   ARG  35          2HG       ARG  35 -12.779   6.386  -6.694
  269   2HG   ARG  35          1HG       ARG  35 -12.935   6.402  -8.451
  270   1HD   ARG  35          2HD       ARG  35 -14.113   4.197  -8.272
  271   2HD   ARG  35          1HD       ARG  35 -14.107   4.407  -6.521
  272    HE   ARG  35           HE       ARG  35 -15.834   5.690  -8.404
  273   1HH1  ARG  35          1HH1      ARG  35 -14.290   6.047  -5.295
  274   2HH1  ARG  35          2HH1      ARG  35 -15.479   7.152  -4.692
  275   1HH2  ARG  35          1HH2      ARG  35 -17.397   7.145  -7.615
  276   2HH2  ARG  35          2HH2      ARG  35 -17.242   7.778  -6.009
  277    H    GLU  36           H        GLU  36 -11.165   2.909  -5.701
  278    HA   GLU  36           HA       GLU  36 -12.821   3.643  -3.536
  279   1HB   GLU  36          2HB       GLU  36 -11.869   1.218  -4.737
  280   2HB   GLU  36          1HB       GLU  36 -11.668   1.107  -2.995
  281   1HG   GLU  36          2HG       GLU  36 -13.778   0.266  -3.266
  282   2HG   GLU  36          1HG       GLU  36 -14.123   1.962  -2.930
  283    H    ALA  37           H        ALA  37  -9.379   3.234  -3.884
  284    HA   ALA  37           HA       ALA  37  -8.769   3.085  -1.104
  285   1HB   ALA  37          1HB       ALA  37  -6.442   3.655  -1.882
  286   2HB   ALA  37          2HB       ALA  37  -7.093   3.742  -3.519
  287   3HB   ALA  37          3HB       ALA  37  -7.157   2.224  -2.623
  288    H    GLU  38           H        GLU  38  -9.347   5.677  -3.356
  289    HA   GLU  38           HA       GLU  38  -8.179   7.747  -1.775
  290   1HB   GLU  38          2HB       GLU  38 -10.206   7.810  -4.011
  291   2HB   GLU  38          1HB       GLU  38  -9.553   9.254  -3.252
  292   1HG   GLU  38          2HG       GLU  38  -7.462   8.958  -4.165
  293   2HG   GLU  38          1HG       GLU  38  -7.692   7.225  -4.392
  294    H    LYS  39           H        LYS  39 -11.432   6.451  -2.203
  295    HA   LYS  39           HA       LYS  39 -12.735   8.273  -0.471
  296   1HB   LYS  39          2HB       LYS  39 -14.079   7.052  -2.015
  297   2HB   LYS  39          1HB       LYS  39 -13.444   5.511  -1.458
  298   1HG   LYS  39          2HG       LYS  39 -14.936   7.245   0.452
  299   2HG   LYS  39          1HG       LYS  39 -15.824   6.304  -0.747
  300   1HD   LYS  39          2HD       LYS  39 -13.900   4.575   0.375
  301   2HD   LYS  39          1HD       LYS  39 -14.644   5.443   1.719
  302   1HE   LYS  39          2HE       LYS  39 -16.047   3.622   1.475
  303   2HE   LYS  39          1HE       LYS  39 -16.874   4.858   0.528
  304   1HZ   LYS  39          1HZ       LYS  39 -15.387   2.497  -0.396
  305   2HZ   LYS  39          2HZ       LYS  39 -15.482   3.856  -1.399
  306   3HZ   LYS  39          3HZ       LYS  39 -16.896   3.079  -0.895
  307    H    LYS  40           H        LYS  40 -11.028   5.256   0.013
  308    HA   LYS  40           HA       LYS  40 -11.868   4.901   2.729
  309   1HB   LYS  40          2HB       LYS  40  -9.562   3.674   1.208
  310   2HB   LYS  40          1HB       LYS  40 -10.118   3.158   2.794
  311   1HG   LYS  40          2HG       LYS  40 -12.105   3.221   0.595
  312   2HG   LYS  40          1HG       LYS  40 -10.881   1.950   0.569
  313   1HD   LYS  40          2HD       LYS  40 -11.658   0.975   2.501
  314   2HD   LYS  40          1HD       LYS  40 -12.349   2.481   3.109
  315   1HE   LYS  40          2HE       LYS  40 -14.264   1.383   2.527
  316   2HE   LYS  40          1HE       LYS  40 -13.917   2.208   1.008
  317   1HZ   LYS  40          1HZ       LYS  40 -14.359   0.028   0.390
  318   2HZ   LYS  40          2HZ       LYS  40 -13.507  -0.635   1.693
  319   3HZ   LYS  40          3HZ       LYS  40 -12.669   0.082   0.410
  320    H    ILE  41           H        ILE  41  -9.127   6.400   1.110
  321    HA   ILE  41           HA       ILE  41  -7.633   6.813   3.526
  322    HB   ILE  41           HB       ILE  41  -7.324   8.068   0.793
  323   1HG1  ILE  41          2HG1      ILE  41  -5.407   6.105   1.968
  324   2HG1  ILE  41          1HG1      ILE  41  -6.931   5.497   1.331
  325   1HG2  ILE  41          1HG2      ILE  41  -5.614   8.251   3.261
  326   2HG2  ILE  41          2HG2      ILE  41  -6.323   9.567   2.325
  327   3HG2  ILE  41          3HG2      ILE  41  -5.007   8.609   1.644
  328   1HD1  ILE  41          1HD1      ILE  41  -6.364   6.730  -0.805
  329   2HD1  ILE  41          2HD1      ILE  41  -5.382   5.316  -0.418
  330   3HD1  ILE  41          3HD1      ILE  41  -4.747   6.936  -0.133
  331    H    LYS  42           H        LYS  42 -10.108   8.526   1.799
  332    HA   LYS  42           HA       LYS  42  -9.636  11.059   3.062
  333   1HB   LYS  42          2HB       LYS  42 -11.823   9.952   1.337
  334   2HB   LYS  42          1HB       LYS  42 -11.998  11.512   2.129
  335   1HG   LYS  42          2HG       LYS  42  -9.844  12.192   1.022
  336   2HG   LYS  42          1HG       LYS  42  -9.957  10.706   0.078
  337   1HD   LYS  42          2HD       LYS  42 -11.671  11.481  -1.189
  338   2HD   LYS  42          1HD       LYS  42 -12.376  12.402   0.141
  339   1HE   LYS  42          2HE       LYS  42 -11.501  14.255  -0.713
  340   2HE   LYS  42          1HE       LYS  42  -9.889  13.593  -0.450
  341   1HZ   LYS  42          1HZ       LYS  42 -10.581  12.352  -2.702
  342   2HZ   LYS  42          2HZ       LYS  42  -9.755  13.828  -2.669
  343   3HZ   LYS  42          3HZ       LYS  42 -11.431  13.800  -2.899
  344    H    GLU  43           H        GLU  43 -10.852   8.186   4.208
  345    HA   GLU  43           HA       GLU  43 -12.751   9.467   6.026
  346   1HB   GLU  43          2HB       GLU  43 -12.294   6.633   5.187
  347   2HB   GLU  43          1HB       GLU  43 -13.168   6.996   6.669
  348   1HG   GLU  43          2HG       GLU  43 -14.449   8.614   4.934
  349   2HG   GLU  43          1HG       GLU  43 -13.988   7.290   3.867
  350    H    LEU  44           H        LEU  44 -10.020   7.182   6.118
  351    HA   LEU  44           HA       LEU  44  -9.516   8.067   8.883
  352   1HB   LEU  44          2HB       LEU  44  -8.701   5.912   9.432
  353   2HB   LEU  44          1HB       LEU  44 -10.232   5.680   8.612
  354    HG   LEU  44           HG       LEU  44  -8.581   5.423   6.513
  355   1HD1  LEU  44          1HD1      LEU  44  -6.895   3.770   8.090
  356   2HD1  LEU  44          2HD1      LEU  44  -6.839   5.401   8.755
  357   3HD1  LEU  44          3HD1      LEU  44  -6.452   5.129   7.057
  358   1HD2  LEU  44          1HD2      LEU  44  -8.570   2.873   7.510
  359   2HD2  LEU  44          2HD2      LEU  44  -9.902   3.621   6.629
  360   3HD2  LEU  44          3HD2      LEU  44  -9.904   3.619   8.392
  361    H    PHE  45           H        PHE  45  -7.088   7.346   9.443
  362    HA   PHE  45           HA       PHE  45  -5.423   8.670   7.411
  363   1HB   PHE  45          2HB       PHE  45  -5.704   9.583   9.835
  364   2HB   PHE  45          1HB       PHE  45  -4.596   8.286  10.272
  365    HD1  PHE  45           1HD      PHE  45  -4.733  11.634   9.599
  366    HD2  PHE  45           2HD      PHE  45  -2.510   8.175   8.498
  367    HE1  PHE  45           1HE      PHE  45  -2.828  13.061   8.975
  368    HE2  PHE  45           2HE      PHE  45  -0.602   9.596   7.872
  369    HZ   PHE  45           HZ       PHE  45  -0.758  12.042   8.111
  370    H    PHE  46           H        PHE  46  -4.330   7.262   6.203
  371    HA   PHE  46           HA       PHE  46  -3.455   4.736   7.384
  372   1HB   PHE  46          2HB       PHE  46  -3.649   5.678   4.524
  373   2HB   PHE  46          1HB       PHE  46  -2.928   4.140   4.987
  374    HD1  PHE  46           1HD      PHE  46  -5.865   5.695   3.937
  375    HD2  PHE  46           2HD      PHE  46  -4.450   2.674   6.578
  376    HE1  PHE  46           1HE      PHE  46  -8.094   4.651   3.938
  377    HE2  PHE  46           2HE      PHE  46  -6.677   1.628   6.583
  378    HZ   PHE  46           HZ       PHE  46  -8.502   2.625   5.262
  379    HA   PRO  47           HA       PRO  47   0.628   6.639   7.674
  380   1HB   PRO  47          2HB       PRO  47   1.776   4.636   9.078
  381   2HB   PRO  47          1HB       PRO  47   0.686   5.807   9.832
  382   1HG   PRO  47          2HG       PRO  47   0.115   3.026   8.882
  383   2HG   PRO  47          1HG       PRO  47  -0.388   3.818  10.387
  384   1HD   PRO  47          2HD       PRO  47  -2.024   3.563   8.237
  385   2HD   PRO  47          1HD       PRO  47  -2.126   4.927   9.367
  386    H    VAL  48           H        VAL  48  -0.302   3.596   6.328
  387    HA   VAL  48           HA       VAL  48   1.953   3.672   4.502
  388    HB   VAL  48           HB       VAL  48   1.270   1.094   5.881
  389   1HG1  VAL  48          1HG1      VAL  48   2.706   1.557   3.641
  390   2HG1  VAL  48          2HG1      VAL  48   2.975   0.193   4.727
  391   3HG1  VAL  48          3HG1      VAL  48   3.972   1.641   4.866
  392   1HG2  VAL  48          1HG2      VAL  48   1.926   2.503   7.658
  393   2HG2  VAL  48          2HG2      VAL  48   3.245   3.193   6.714
  394   3HG2  VAL  48          3HG2      VAL  48   3.329   1.514   7.251
  395    H    ILE  49           H        ILE  49   1.376   3.057   2.499
  396    HA   ILE  49           HA       ILE  49  -1.221   1.725   2.130
  397    HB   ILE  49           HB       ILE  49   0.114   3.528   0.110
  398   1HG1  ILE  49          2HG1      ILE  49  -0.381   4.853   2.104
  399   2HG1  ILE  49          1HG1      ILE  49  -1.486   5.275   0.799
  400   1HG2  ILE  49          1HG2      ILE  49  -2.388   1.980   0.246
  401   2HG2  ILE  49          2HG2      ILE  49  -1.410   2.441  -1.147
  402   3HG2  ILE  49          3HG2      ILE  49  -2.523   3.604  -0.428
  403   1HD1  ILE  49          1HD1      ILE  49  -2.063   3.603   3.226
  404   2HD1  ILE  49          2HD1      ILE  49  -3.159   3.739   1.851
  405   3HD1  ILE  49          3HD1      ILE  49  -2.749   5.170   2.797
  406    H    VAL  50           H        VAL  50  -1.337   0.270   0.244
  407    HA   VAL  50           HA       VAL  50   1.200  -0.539  -0.906
  408    HB   VAL  50           HB       VAL  50  -0.434  -2.524   0.673
  409   1HG1  VAL  50          1HG1      VAL  50   2.277  -3.253  -0.111
  410   2HG1  VAL  50          2HG1      VAL  50   1.211  -2.981  -1.488
  411   3HG1  VAL  50          3HG1      VAL  50   0.773  -4.163  -0.255
  412   1HG2  VAL  50          1HG2      VAL  50   1.541  -2.598   2.157
  413   2HG2  VAL  50          2HG2      VAL  50   0.722  -1.038   2.173
  414   3HG2  VAL  50          3HG2      VAL  50   2.223  -1.236   1.269
  415    H    LEU  51           H        LEU  51   0.575  -0.275  -2.936
  416    HA   LEU  51           HA       LEU  51  -1.982  -1.108  -3.927
  417   1HB   LEU  51          2HB       LEU  51  -0.551   0.794  -4.833
  418   2HB   LEU  51          1HB       LEU  51   0.456  -0.437  -5.570
  419    HG   LEU  51           HG       LEU  51  -1.339  -1.166  -6.986
  420   1HD1  LEU  51          1HD1      LEU  51  -3.235  -1.041  -5.577
  421   2HD1  LEU  51          2HD1      LEU  51  -3.535   0.073  -6.910
  422   3HD1  LEU  51          3HD1      LEU  51  -3.032   0.694  -5.339
  423   1HD2  LEU  51          1HD2      LEU  51  -1.187   1.844  -6.914
  424   2HD2  LEU  51          2HD2      LEU  51  -1.769   0.879  -8.269
  425   3HD2  LEU  51          3HD2      LEU  51  -0.084   0.762  -7.764
  426    H    ASP  52           H        ASP  52  -2.050  -2.606  -5.897
  427    HA   ASP  52           HA       ASP  52  -0.218  -4.876  -5.494
  428   1HB   ASP  52          2HB       ASP  52  -2.558  -5.175  -4.516
  429   2HB   ASP  52          1HB       ASP  52  -3.133  -5.213  -6.180
  430    H    VAL  53           H        VAL  53  -2.552  -3.397  -7.731
  431    HA   VAL  53           HA       VAL  53  -2.518  -3.154  -9.997
  432    HB   VAL  53           HB       VAL  53   0.318  -4.198  -9.918
  433   1HG1  VAL  53          1HG1      VAL  53  -0.074  -4.143 -12.141
  434   2HG1  VAL  53          2HG1      VAL  53   0.251  -2.422 -11.929
  435   3HG1  VAL  53          3HG1      VAL  53  -1.413  -3.005 -11.988
  436   1HG2  VAL  53          1HG2      VAL  53   0.072  -2.311  -8.387
  437   2HG2  VAL  53          2HG2      VAL  53  -0.664  -1.356  -9.674
  438   3HG2  VAL  53          3HG2      VAL  53   1.020  -1.860  -9.803
  439    H    TRP  54           H        TRP  54  -3.501  -5.538  -8.811
  440    HA   TRP  54           HA       TRP  54  -2.599  -7.873 -10.107
  441   1HB   TRP  54          2HB       TRP  54  -3.954  -8.070  -8.129
  442   2HB   TRP  54          1HB       TRP  54  -5.271  -7.173  -8.875
  443    HD1  TRP  54           HD       TRP  54  -7.184  -8.854  -9.151
  444    HE1  TRP  54           1HE      TRP  54  -7.427 -11.224 -10.124
  445    HE3  TRP  54           3HE      TRP  54  -2.265  -9.831 -10.146
  446    HZ2  TRP  54           2HZ      TRP  54  -5.755 -13.241 -11.173
  447    HZ3  TRP  54           3HZ      TRP  54  -1.672 -12.005 -11.134
  448    HH2  TRP  54           HH       TRP  54  -3.382 -13.674 -11.636
  449    H    MET  55           H        MET  55  -5.869  -6.627 -10.668
  450    HA   MET  55           HA       MET  55  -5.378  -6.348 -13.509
  451   1HB   MET  55          2HB       MET  55  -6.051  -8.829 -12.735
  452   2HB   MET  55          1HB       MET  55  -7.661  -8.137 -12.880
  453   1HG   MET  55          2HG       MET  55  -6.591  -7.312 -15.202
  454   2HG   MET  55          1HG       MET  55  -5.688  -8.806 -14.958
  455   1HE   MET  55          1HE       MET  55  -7.463 -11.382 -14.470
  456   2HE   MET  55          2HE       MET  55  -6.233 -10.787 -15.586
  457   3HE   MET  55          3HE       MET  55  -7.761 -11.412 -16.209
  458    HA   PRO  56           HA       PRO  56  -8.967  -3.840 -11.882
  459   1HB   PRO  56          2HB       PRO  56  -7.697  -1.692 -10.743
  460   2HB   PRO  56          1HB       PRO  56  -8.181  -3.136  -9.855
  461   1HG   PRO  56          2HG       PRO  56  -5.522  -2.208 -10.456
  462   2HG   PRO  56          1HG       PRO  56  -6.005  -3.608  -9.487
  463   1HD   PRO  56          2HD       PRO  56  -5.121  -3.484 -12.299
  464   2HD   PRO  56          1HD       PRO  56  -5.120  -4.852 -11.173
  465    H    ASP  57           H        ASP  57  -8.955  -1.102 -12.037
  466    HA   ASP  57           HA       ASP  57  -7.977  -0.560 -14.763
  467   1HB   ASP  57          2HB       ASP  57 -10.532   0.468 -13.509
  468   2HB   ASP  57          1HB       ASP  57  -9.965   0.812 -15.140
  469    H    GLY  58           H        GLY  58  -6.696  -0.010 -12.181
  470   1HA   GLY  58          2HA       GLY  58  -6.885   2.911 -11.998
  471   2HA   GLY  58          1HA       GLY  58  -6.098   1.854 -10.836
  472    H    ASP  59           H        ASP  59  -3.959   1.338 -11.083
  473    HA   ASP  59           HA       ASP  59  -1.797   1.652 -11.723
  474   1HB   ASP  59          2HB       ASP  59  -2.982   0.422 -13.769
  475   2HB   ASP  59          1HB       ASP  59  -2.585   1.931 -14.586
  476    H    GLY  60           H        GLY  60  -2.716   3.910 -10.758
  477   1HA   GLY  60          2HA       GLY  60  -2.237   6.034 -12.724
  478   2HA   GLY  60          1HA       GLY  60  -2.979   6.244 -11.146
  479    H    VAL  61           H        VAL  61  -0.137   6.483 -12.949
  480    HA   VAL  61           HA       VAL  61   1.835   6.162 -10.969
  481    HB   VAL  61           HB       VAL  61   1.827   7.887 -13.452
  482   1HG1  VAL  61          1HG1      VAL  61   4.396   7.378 -13.107
  483   2HG1  VAL  61          2HG1      VAL  61   3.899   7.318 -11.416
  484   3HG1  VAL  61          3HG1      VAL  61   3.611   8.774 -12.370
  485   1HG2  VAL  61          1HG2      VAL  61   3.280   5.298 -13.204
  486   2HG2  VAL  61          2HG2      VAL  61   2.628   6.092 -14.637
  487   3HG2  VAL  61          3HG2      VAL  61   1.543   5.280 -13.508
  488    H    ASN  62           H        ASN  62  -0.249   8.834 -11.831
  489    HA   ASN  62           HA       ASN  62   1.158  10.748 -10.211
  490   1HB   ASN  62          2HB       ASN  62  -0.935  10.809 -12.175
  491   2HB   ASN  62          1HB       ASN  62  -1.462  11.682 -10.740
  492   1HD2  ASN  62          1HD2      ASN  62   1.739  11.312 -12.208
  493   2HD2  ASN  62          2HD2      ASN  62   2.016  13.000 -12.443
  494    H    PHE  63           H        PHE  63  -0.792   8.190  -9.422
  495    HA   PHE  63           HA       PHE  63  -2.547   9.228  -7.502
  496   1HB   PHE  63          2HB       PHE  63  -2.690   6.925  -8.365
  497   2HB   PHE  63          1HB       PHE  63  -1.190   6.522  -7.535
  498    HD1  PHE  63           1HD      PHE  63  -4.211   8.406  -6.426
  499    HD2  PHE  63           2HD      PHE  63  -1.680   5.032  -5.844
  500    HE1  PHE  63           1HE      PHE  63  -5.499   7.790  -4.423
  501    HE2  PHE  63           2HE      PHE  63  -2.966   4.411  -3.842
  502    HZ   PHE  63           HZ       PHE  63  -4.878   5.789  -3.129
  503    H    ILE  64           H        ILE  64   0.855   8.483  -7.360
  504    HA   ILE  64           HA       ILE  64   1.368   8.252  -4.681
  505    HB   ILE  64           HB       ILE  64   3.307  10.092  -5.793
  506   1HG1  ILE  64          2HG1      ILE  64   2.407   9.172  -7.949
  507   2HG1  ILE  64          1HG1      ILE  64   4.109   8.850  -7.670
  508   1HG2  ILE  64          1HG2      ILE  64   4.625   7.783  -5.542
  509   2HG2  ILE  64          2HG2      ILE  64   3.213   7.420  -4.550
  510   3HG2  ILE  64          3HG2      ILE  64   4.218   8.819  -4.173
  511   1HD1  ILE  64          1HD1      ILE  64   1.856   6.892  -7.271
  512   2HD1  ILE  64          2HD1      ILE  64   3.563   6.572  -6.970
  513   3HD1  ILE  64          3HD1      ILE  64   3.006   6.909  -8.607
  514    H    ASP  65           H        ASP  65   0.698  11.211  -6.476
  515    HA   ASP  65           HA       ASP  65   1.292  13.036  -4.420
  516   1HB   ASP  65          2HB       ASP  65   0.555  13.277  -7.030
  517   2HB   ASP  65          1HB       ASP  65  -0.934  13.761  -6.223
  518    H    PHE  66           H        PHE  66  -1.849  11.664  -5.426
  519    HA   PHE  66           HA       PHE  66  -3.456  12.842  -3.513
  520   1HB   PHE  66          2HB       PHE  66  -4.378  11.497  -5.327
  521   2HB   PHE  66          1HB       PHE  66  -3.658  10.042  -4.646
  522    HD1  PHE  66           1HD      PHE  66  -4.448   9.268  -2.369
  523    HD2  PHE  66           2HD      PHE  66  -6.497  12.214  -4.657
  524    HE1  PHE  66           1HE      PHE  66  -6.481   8.880  -1.039
  525    HE2  PHE  66           2HE      PHE  66  -8.534  11.832  -3.331
  526    HZ   PHE  66           HZ       PHE  66  -8.528  10.163  -1.520
  527    H    ILE  67           H        ILE  67  -1.192  10.217  -3.205
  528    HA   ILE  67           HA       ILE  67  -2.045   9.210  -0.708
  529    HB   ILE  67           HB       ILE  67   0.838   9.206  -1.546
  530   1HG1  ILE  67          2HG1      ILE  67  -0.178   8.584  -3.589
  531   2HG1  ILE  67          1HG1      ILE  67   0.276   7.073  -2.818
  532   1HG2  ILE  67          1HG2      ILE  67   0.504   6.798  -0.638
  533   2HG2  ILE  67          2HG2      ILE  67  -0.950   7.475   0.096
  534   3HG2  ILE  67          3HG2      ILE  67   0.632   8.150   0.487
  535   1HD1  ILE  67          1HD1      ILE  67  -2.132   7.570  -3.926
  536   2HD1  ILE  67          2HD1      ILE  67  -2.455   7.979  -2.243
  537   3HD1  ILE  67          3HD1      ILE  67  -1.845   6.379  -2.659
  538    H    LYS  68           H        LYS  68   0.563  11.481  -1.559
  539    HA   LYS  68           HA       LYS  68   1.097  12.161   1.171
  540   1HB   LYS  68          2HB       LYS  68   1.919  13.580  -1.370
  541   2HB   LYS  68          1HB       LYS  68   2.592  13.864   0.229
  542   1HG   LYS  68          2HG       LYS  68   2.979  11.194  -0.026
  543   2HG   LYS  68          1HG       LYS  68   3.140  11.727  -1.701
  544   1HD   LYS  68          2HD       LYS  68   5.074  12.817  -1.301
  545   2HD   LYS  68          1HD       LYS  68   4.539  13.391   0.280
  546   1HE   LYS  68          2HE       LYS  68   6.005  11.913   1.102
  547   2HE   LYS  68          1HE       LYS  68   4.785  10.705   0.704
  548   1HZ   LYS  68          1HZ       LYS  68   7.261  10.539  -0.158
  549   2HZ   LYS  68          2HZ       LYS  68   6.634  11.482  -1.416
  550   3HZ   LYS  68          3HZ       LYS  68   5.956   9.970  -1.071
  551    H    GLU  69           H        GLU  69  -1.184  13.186  -1.167
  552    HA   GLU  69           HA       GLU  69  -1.600  15.847  -0.320
  553   1HB   GLU  69          2HB       GLU  69  -2.406  14.871  -2.473
  554   2HB   GLU  69          1HB       GLU  69  -3.615  13.977  -1.563
  555   1HG   GLU  69          2HG       GLU  69  -4.304  16.312  -0.675
  556   2HG   GLU  69          1HG       GLU  69  -3.428  16.907  -2.085
  557    H    ASN  70           H        ASN  70  -3.133  12.785   0.581
  558    HA   ASN  70           HA       ASN  70  -4.411  14.173   2.843
  559   1HB   ASN  70          2HB       ASN  70  -5.319  11.522   1.743
  560   2HB   ASN  70          1HB       ASN  70  -6.214  12.655   2.751
  561   1HD2  ASN  70          1HD2      ASN  70  -4.695  12.355  -0.427
  562   2HD2  ASN  70          2HD2      ASN  70  -5.838  13.340  -1.264
  563    H    SER  71           H        SER  71  -1.727  12.559   2.342
  564    HA   SER  71           HA       SER  71  -1.622  11.529   5.020
  565   1HB   SER  71          2HB       SER  71  -2.014   9.719   2.733
  566   2HB   SER  71          1HB       SER  71  -0.659   9.284   3.775
  567    HG   SER  71           HG       SER  71  -2.002   8.835   5.359
  568    HA   PRO  72           HA       PRO  72   2.344  13.121   3.121
  569   1HB   PRO  72          2HB       PRO  72   2.383  14.963   5.385
  570   2HB   PRO  72          1HB       PRO  72   2.457  15.322   3.659
  571   1HG   PRO  72          2HG       PRO  72   0.299  15.913   5.181
  572   2HG   PRO  72          1HG       PRO  72   0.175  15.494   3.463
  573   1HD   PRO  72          2HD       PRO  72  -0.347  13.794   5.871
  574   2HD   PRO  72          1HD       PRO  72  -1.252  13.898   4.347
  575    H    ASP  73           H        ASP  73   1.291  12.078   6.201
  576    HA   ASP  73           HA       ASP  73   4.043  11.467   7.026
  577   1HB   ASP  73          2HB       ASP  73   2.425  12.817   8.522
  578   2HB   ASP  73          1HB       ASP  73   1.657  11.263   8.831
  579    H    SER  74           H        SER  74   2.663   9.937   5.045
  580    HA   SER  74           HA       SER  74   2.280   7.388   6.472
  581   1HB   SER  74          2HB       SER  74   0.238   8.136   5.352
  582   2HB   SER  74          1HB       SER  74   1.109   8.294   3.829
  583    HG   SER  74           HG       SER  74  -0.071   6.315   4.016
  584    H    VAL  75           H        VAL  75   2.351   5.809   4.076
  585    HA   VAL  75           HA       VAL  75   4.939   6.296   2.859
  586    HB   VAL  75           HB       VAL  75   4.488   3.699   4.334
  587   1HG1  VAL  75          1HG1      VAL  75   6.878   4.806   2.843
  588   2HG1  VAL  75          2HG1      VAL  75   5.813   3.517   2.281
  589   3HG1  VAL  75          3HG1      VAL  75   6.825   3.268   3.705
  590   1HG2  VAL  75          1HG2      VAL  75   4.882   5.294   6.019
  591   2HG2  VAL  75          2HG2      VAL  75   6.080   6.150   5.049
  592   3HG2  VAL  75          3HG2      VAL  75   6.455   4.559   5.710
  593    H    VAL  76           H        VAL  76   5.060   5.535   0.849
  594    HA   VAL  76           HA       VAL  76   2.826   3.847  -0.074
  595    HB   VAL  76           HB       VAL  76   4.443   5.444  -2.007
  596   1HG1  VAL  76          1HG1      VAL  76   2.916   4.468  -3.305
  597   2HG1  VAL  76          2HG1      VAL  76   1.772   5.632  -2.636
  598   3HG1  VAL  76          3HG1      VAL  76   1.907   4.021  -1.930
  599   1HG2  VAL  76          1HG2      VAL  76   2.600   6.563   0.041
  600   2HG2  VAL  76          2HG2      VAL  76   2.529   7.222  -1.593
  601   3HG2  VAL  76          3HG2      VAL  76   4.042   7.267  -0.689
  602    H    ILE  77           H        ILE  77   3.479   1.800  -0.201
  603    HA   ILE  77           HA       ILE  77   6.196   1.166  -1.032
  604    HB   ILE  77           HB       ILE  77   3.970  -0.741  -0.303
  605   1HG1  ILE  77          2HG1      ILE  77   4.471   0.799   1.554
  606   2HG1  ILE  77          1HG1      ILE  77   4.996  -0.842   1.920
  607   1HG2  ILE  77          1HG2      ILE  77   6.187  -1.383  -1.612
  608   2HG2  ILE  77          2HG2      ILE  77   5.487  -2.436  -0.383
  609   3HG2  ILE  77          3HG2      ILE  77   6.846  -1.388   0.024
  610   1HD1  ILE  77          1HD1      ILE  77   7.212   0.353   0.755
  611   2HD1  ILE  77          2HD1      ILE  77   6.957   0.027   2.469
  612   3HD1  ILE  77          3HD1      ILE  77   6.524   1.598   1.796
  613    H    VAL  78           H        VAL  78   2.868   0.450  -2.099
  614    HA   VAL  78           HA       VAL  78   2.032  -0.246  -4.110
  615    HB   VAL  78           HB       VAL  78   4.371   1.344  -5.186
  616   1HG1  VAL  78          1HG1      VAL  78   1.747   0.731  -6.536
  617   2HG1  VAL  78          2HG1      VAL  78   3.223  -0.194  -6.807
  618   3HG1  VAL  78          3HG1      VAL  78   3.163   1.516  -7.234
  619   1HG2  VAL  78          1HG2      VAL  78   1.617   2.440  -5.062
  620   2HG2  VAL  78          2HG2      VAL  78   3.173   3.260  -4.927
  621   3HG2  VAL  78          3HG2      VAL  78   2.533   2.353  -3.557
  622    H    ILE  79           H        ILE  79   2.582  -2.458  -3.639
  623    HA   ILE  79           HA       ILE  79   4.919  -3.478  -5.106
  624    HB   ILE  79           HB       ILE  79   3.291  -5.218  -3.304
  625   1HG1  ILE  79          2HG1      ILE  79   5.449  -3.347  -2.316
  626   2HG1  ILE  79          1HG1      ILE  79   3.725  -3.118  -2.039
  627   1HG2  ILE  79          1HG2      ILE  79   5.707  -6.024  -2.839
  628   2HG2  ILE  79          2HG2      ILE  79   6.111  -5.104  -4.289
  629   3HG2  ILE  79          3HG2      ILE  79   4.947  -6.427  -4.378
  630   1HD1  ILE  79          1HD1      ILE  79   4.048  -4.230  -0.144
  631   2HD1  ILE  79          2HD1      ILE  79   5.625  -4.824  -0.664
  632   3HD1  ILE  79          3HD1      ILE  79   4.158  -5.677  -1.146
  633    H    THR  80           H        THR  80   4.664  -5.384  -6.426
  634    HA   THR  80           HA       THR  80   1.962  -6.152  -7.166
  635    HB   THR  80           HB       THR  80   2.114  -5.570  -9.459
  636    HG1  THR  80           1HG      THR  80   3.972  -5.550 -10.394
  637   1HG2  THR  80          1HG2      THR  80   1.562  -3.638  -8.093
  638   2HG2  THR  80          2HG2      THR  80   2.497  -3.170  -9.513
  639   3HG2  THR  80          3HG2      THR  80   3.275  -3.252  -7.932
  640    H    GLY  81           H        GLY  81   1.913  -8.282  -7.384
  641   1HA   GLY  81          2HA       GLY  81   4.424  -9.733  -7.712
  642   2HA   GLY  81          1HA       GLY  81   2.876 -10.423  -7.246
  643    H    HIS  82           H        HIS  82   4.969  -9.574  -9.867
  644    HA   HIS  82           HA       HIS  82   3.653 -11.393 -11.626
  645   1HB   HIS  82          2HB       HIS  82   2.255  -9.229 -11.719
  646   2HB   HIS  82          1HB       HIS  82   3.625  -8.539 -12.583
  647    HD1  HIS  82           1HD      HIS  82   1.011 -11.240 -12.912
  648    HD2  HIS  82           2HD      HIS  82   3.805  -9.231 -15.242
  649    HE1  HIS  82           1HE      HIS  82   0.530 -11.928 -15.282
  650    HE2  HIS  82           2HE      HIS  82   2.187 -10.645 -16.681
  651    H    GLY  83           H        GLY  83   5.869  -8.635 -11.389
  652   1HA   GLY  83          2HA       GLY  83   8.259  -9.297 -11.767
  653   2HA   GLY  83          1HA       GLY  83   7.680 -10.056 -13.242
  654    H    SER  84           H        SER  84   7.216  -6.877 -11.691
  655    HA   SER  84           HA       SER  84   8.184  -5.628 -14.171
  656   1HB   SER  84          2HB       SER  84   6.423  -3.827 -13.756
  657   2HB   SER  84          1HB       SER  84   5.828  -5.380 -14.343
  658    HG   SER  84           HG       SER  84   4.536  -4.828 -12.647
  659    H    VAL  85           H        VAL  85   9.772  -4.228 -13.825
  660    HA   VAL  85           HA       VAL  85  10.128  -3.168 -11.101
  661    HB   VAL  85           HB       VAL  85  12.245  -3.396 -13.241
  662   1HG1  VAL  85          1HG1      VAL  85  12.376  -1.743 -11.226
  663   2HG1  VAL  85          2HG1      VAL  85  13.779  -2.718 -11.662
  664   3HG1  VAL  85          3HG1      VAL  85  12.757  -3.198 -10.307
  665   1HG2  VAL  85          1HG2      VAL  85  11.276  -5.601 -12.469
  666   2HG2  VAL  85          2HG2      VAL  85  11.917  -5.220 -10.871
  667   3HG2  VAL  85          3HG2      VAL  85  13.013  -5.398 -12.242
  668    H    ASP  86           H        ASP  86   9.891  -2.342 -14.486
  669    HA   ASP  86           HA       ASP  86  10.802   0.303 -14.391
  670   1HB   ASP  86          2HB       ASP  86   8.587  -0.743 -16.166
  671   2HB   ASP  86          1HB       ASP  86   9.648   0.626 -16.482
  672    H    THR  87           H        THR  87   7.818  -1.121 -13.312
  673    HA   THR  87           HA       THR  87   6.371   1.357 -13.188
  674    HB   THR  87           HB       THR  87   5.424  -1.068 -13.301
  675    HG1  THR  87           1HG      THR  87   3.546  -0.298 -12.506
  676   1HG2  THR  87          1HG2      THR  87   6.657  -1.539 -10.994
  677   2HG2  THR  87          2HG2      THR  87   5.132  -2.309 -11.434
  678   3HG2  THR  87          3HG2      THR  87   5.135  -0.907 -10.365
  679    H    ALA  88           H        ALA  88   8.413  -0.517 -11.073
  680    HA   ALA  88           HA       ALA  88   7.849   0.731  -8.628
  681   1HB   ALA  88          1HB       ALA  88   9.953  -0.148  -7.871
  682   2HB   ALA  88          2HB       ALA  88  10.524  -0.331  -9.529
  683   3HB   ALA  88          3HB       ALA  88   9.208  -1.342  -8.934
  684    H    VAL  89           H        VAL  89  10.537   1.329 -10.867
  685    HA   VAL  89           HA       VAL  89  11.494   3.653  -9.650
  686    HB   VAL  89           HB       VAL  89  12.698   4.085 -11.703
  687   1HG1  VAL  89          1HG1      VAL  89  13.006   1.896 -10.180
  688   2HG1  VAL  89          2HG1      VAL  89  14.063   2.292 -11.534
  689   3HG1  VAL  89          3HG1      VAL  89  12.749   1.136 -11.749
  690   1HG2  VAL  89          1HG2      VAL  89  11.877   3.641 -13.721
  691   2HG2  VAL  89          2HG2      VAL  89  10.431   2.988 -12.952
  692   3HG2  VAL  89          3HG2      VAL  89  11.777   1.920 -13.347
  693    H    LYS  90           H        LYS  90   8.720   3.127 -11.620
  694    HA   LYS  90           HA       LYS  90   8.442   5.881 -12.446
  695   1HB   LYS  90          2HB       LYS  90   7.677   4.111 -13.919
  696   2HB   LYS  90          1HB       LYS  90   6.595   3.501 -12.675
  697   1HG   LYS  90          2HG       LYS  90   5.280   5.546 -12.802
  698   2HG   LYS  90          1HG       LYS  90   6.379   6.182 -14.028
  699   1HD   LYS  90          2HD       LYS  90   4.376   5.259 -15.061
  700   2HD   LYS  90          1HD       LYS  90   5.797   4.313 -15.506
  701   1HE   LYS  90          2HE       LYS  90   5.101   2.480 -14.371
  702   2HE   LYS  90          1HE       LYS  90   4.334   3.429 -13.098
  703   1HZ   LYS  90          1HZ       LYS  90   2.790   3.973 -15.237
  704   2HZ   LYS  90          2HZ       LYS  90   2.447   2.790 -14.079
  705   3HZ   LYS  90          3HZ       LYS  90   3.208   2.359 -15.527
  706    H    ALA  91           H        ALA  91   7.788   4.183  -9.608
  707    HA   ALA  91           HA       ALA  91   5.711   6.133  -8.850
  708   1HB   ALA  91          1HB       ALA  91   5.217   4.301  -7.051
  709   2HB   ALA  91          2HB       ALA  91   6.018   3.240  -8.210
  710   3HB   ALA  91          3HB       ALA  91   4.582   4.144  -8.688
  711    H    ILE  92           H        ILE  92   8.673   4.507  -7.859
  712    HA   ILE  92           HA       ILE  92   8.732   5.664  -5.252
  713    HB   ILE  92           HB       ILE  92  10.886   4.731  -4.980
  714   1HG1  ILE  92          2HG1      ILE  92  10.987   4.397  -7.989
  715   2HG1  ILE  92          1HG1      ILE  92  11.915   5.564  -7.053
  716   1HG2  ILE  92          1HG2      ILE  92  10.538   2.398  -6.085
  717   2HG2  ILE  92          2HG2      ILE  92   8.983   3.069  -6.571
  718   3HG2  ILE  92          3HG2      ILE  92   9.405   2.973  -4.863
  719   1HD1  ILE  92          1HD1      ILE  92  13.268   3.911  -6.121
  720   2HD1  ILE  92          2HD1      ILE  92  13.090   3.435  -7.809
  721   3HD1  ILE  92          3HD1      ILE  92  12.150   2.620  -6.559
  722    H    LYS  93           H        LYS  93  10.131   6.539  -8.368
  723    HA   LYS  93           HA       LYS  93  11.830   8.581  -7.480
  724   1HB   LYS  93          2HB       LYS  93  10.798   7.633 -10.008
  725   2HB   LYS  93          1HB       LYS  93  10.843   9.390  -9.983
  726   1HG   LYS  93          2HG       LYS  93  13.088   9.467 -10.014
  727   2HG   LYS  93          1HG       LYS  93  13.257   8.057  -8.966
  728   1HD   LYS  93          2HD       LYS  93  13.040   6.561 -10.748
  729   2HD   LYS  93          1HD       LYS  93  12.318   7.779 -11.802
  730   1HE   LYS  93          2HE       LYS  93  14.880   8.715 -11.026
  731   2HE   LYS  93          1HE       LYS  93  15.056   7.036 -11.537
  732   1HZ   LYS  93          1HZ       LYS  93  15.239   8.080 -13.531
  733   2HZ   LYS  93          2HZ       LYS  93  14.250   9.379 -13.092
  734   3HZ   LYS  93          3HZ       LYS  93  13.557   7.891 -13.502
  735    H    LYS  94           H        LYS  94   8.392   8.451  -7.826
  736    HA   LYS  94           HA       LYS  94   7.991  11.296  -7.836
  737   1HB   LYS  94          2HB       LYS  94   6.060   9.026  -7.348
  738   2HB   LYS  94          1HB       LYS  94   5.604  10.714  -7.531
  739   1HG   LYS  94          2HG       LYS  94   7.222   9.526  -9.701
  740   2HG   LYS  94          1HG       LYS  94   5.554   8.972  -9.542
  741   1HD   LYS  94          2HD       LYS  94   5.488  10.803 -11.034
  742   2HD   LYS  94          1HD       LYS  94   4.892  11.417  -9.491
  743   1HE   LYS  94          2HE       LYS  94   6.661  12.792  -9.207
  744   2HE   LYS  94          1HE       LYS  94   7.798  11.642  -9.909
  745   1HZ   LYS  94          1HZ       LYS  94   7.805  13.106 -11.592
  746   2HZ   LYS  94          2HZ       LYS  94   6.311  13.782 -11.176
  747   3HZ   LYS  94          3HZ       LYS  94   6.371  12.338 -12.055
  748    H    GLY  95           H        GLY  95   7.255   8.729  -5.457
  749   1HA   GLY  95          2HA       GLY  95   8.317  10.084  -3.255
  750   2HA   GLY  95          1HA       GLY  95   6.620  10.518  -3.369
  751    H    ALA  96           H        ALA  96   7.921   7.361  -4.252
  752    HA   ALA  96           HA       ALA  96   6.168   6.154  -2.266
  753   1HB   ALA  96          1HB       ALA  96   6.127   4.297  -3.557
  754   2HB   ALA  96          2HB       ALA  96   7.836   4.415  -3.974
  755   3HB   ALA  96          3HB       ALA  96   6.654   5.426  -4.804
  756    H    TYR  97           H        TYR  97   7.547   3.769  -1.786
  757    HA   TYR  97           HA       TYR  97   9.731   4.759  -0.088
  758   1HB   TYR  97          2HB       TYR  97   7.681   3.726   0.982
  759   2HB   TYR  97          1HB       TYR  97   8.195   2.193   0.295
  760    HD1  TYR  97           1HD      TYR  97  10.014   0.958   1.247
  761    HD2  TYR  97           2HD      TYR  97   9.044   4.830   2.717
  762    HE1  TYR  97           1HE      TYR  97  11.468   0.576   3.192
  763    HE2  TYR  97           2HE      TYR  97  10.494   4.459   4.668
  764    HH   TYR  97           HH       TYR  97  12.802   2.300   4.861
  765    H    GLU  98           H        GLU  98   9.869   3.915  -2.918
  766    HA   GLU  98           HA       GLU  98  11.552   3.041  -4.188
  767   1HB   GLU  98          2HB       GLU  98  13.498   2.358  -3.264
  768   2HB   GLU  98          1HB       GLU  98  12.782   3.031  -1.811
  769   1HG   GLU  98          2HG       GLU  98  11.859   0.522  -1.629
  770   2HG   GLU  98          1HG       GLU  98  13.339   0.225  -2.538
  771    H    PHE  99           H        PHE  99   8.914   1.718  -3.364
  772    HA   PHE  99           HA       PHE  99   7.747  -0.160  -3.914
  773   1HB   PHE  99          2HB       PHE  99   9.688   0.269  -5.978
  774   2HB   PHE  99          1HB       PHE  99   9.471  -1.461  -5.750
  775    HD1  PHE  99           1HD      PHE  99   8.038  -2.372  -7.273
  776    HD2  PHE  99           2HD      PHE  99   7.202   1.509  -5.740
  777    HE1  PHE  99           1HE      PHE  99   5.984  -2.288  -8.624
  778    HE2  PHE  99           2HE      PHE  99   5.144   1.599  -7.088
  779    HZ   PHE  99           HZ       PHE  99   4.533  -0.300  -8.531
  780    H    LEU 100           H        LEU 100   7.802  -2.579  -3.949
  781    HA   LEU 100           HA       LEU 100   9.917  -3.599  -2.184
  782   1HB   LEU 100          2HB       LEU 100   7.381  -3.314  -1.422
  783   2HB   LEU 100          1HB       LEU 100   7.224  -4.864  -2.225
  784    HG   LEU 100           HG       LEU 100   7.627  -5.507  -0.054
  785   1HD1  LEU 100          1HD1      LEU 100   9.262  -6.544  -1.555
  786   2HD1  LEU 100          2HD1      LEU 100   9.894  -6.358   0.082
  787   3HD1  LEU 100          3HD1      LEU 100  10.403  -5.250  -1.192
  788   1HD2  LEU 100          1HD2      LEU 100   9.218  -3.003   0.087
  789   2HD2  LEU 100          2HD2      LEU 100   9.610  -4.308   1.206
  790   3HD2  LEU 100          3HD2      LEU 100   7.985  -3.622   1.185
  791    H    GLU 101           H        GLU 101  11.113  -5.161  -3.060
  792    HA   GLU 101           HA       GLU 101  10.489  -6.291  -5.596
  793   1HB   GLU 101          2HB       GLU 101  12.734  -6.289  -3.751
  794   2HB   GLU 101          1HB       GLU 101  12.495  -7.871  -4.478
  795   1HG   GLU 101          2HG       GLU 101  13.985  -6.784  -5.899
  796   2HG   GLU 101          1HG       GLU 101  12.425  -6.656  -6.711
  797    H    LYS 102           H        LYS 102  11.149  -8.921  -5.508
  798    HA   LYS 102           HA       LYS 102  10.304 -11.002  -5.158
  799   1HB   LYS 102          2HB       LYS 102  10.396  -9.766  -2.557
  800   2HB   LYS 102          1HB       LYS 102   9.010 -10.843  -2.657
  801   1HG   LYS 102          2HG       LYS 102  11.794 -11.679  -3.417
  802   2HG   LYS 102          1HG       LYS 102  11.131 -11.865  -1.792
  803   1HD   LYS 102          2HD       LYS 102  10.346 -13.840  -2.478
  804   2HD   LYS 102          1HD       LYS 102   9.170 -12.930  -3.428
  805   1HE   LYS 102          2HE       LYS 102  10.082 -14.238  -5.067
  806   2HE   LYS 102          1HE       LYS 102  11.144 -12.834  -5.165
  807   1HZ   LYS 102          1HZ       LYS 102  12.354 -14.955  -5.155
  808   2HZ   LYS 102          2HZ       LYS 102  11.741 -15.296  -3.615
  809   3HZ   LYS 102          3HZ       LYS 102  12.774 -13.976  -3.842
  810    HA   PRO 103           HA       PRO 103   6.093  -9.522  -6.354
  811   1HB   PRO 103          2HB       PRO 103   5.985 -10.854  -8.703
  812   2HB   PRO 103          1HB       PRO 103   6.772  -9.279  -8.540
  813   1HG   PRO 103          2HG       PRO 103   7.996 -12.013  -8.576
  814   2HG   PRO 103          1HG       PRO 103   8.532 -10.537  -9.402
  815   1HD   PRO 103          2HD       PRO 103   9.652 -11.413  -7.090
  816   2HD   PRO 103          1HD       PRO 103   9.536  -9.693  -7.509
  817    H    PHE 104           H        PHE 104   7.474 -12.435  -5.462
  818    HA   PHE 104           HA       PHE 104   5.301 -14.190  -6.065
  819   1HB   PHE 104          2HB       PHE 104   7.798 -14.757  -5.573
  820   2HB   PHE 104          1HB       PHE 104   7.296 -14.719  -3.887
  821    HD1  PHE 104           1HD      PHE 104   7.820 -16.805  -6.589
  822    HD2  PHE 104           2HD      PHE 104   5.009 -16.083  -3.476
  823    HE1  PHE 104           1HE      PHE 104   7.015 -19.122  -6.784
  824    HE2  PHE 104           2HE      PHE 104   4.199 -18.399  -3.664
  825    HZ   PHE 104           HZ       PHE 104   5.203 -19.921  -5.320
  826    H    SER 105           H        SER 105   6.509 -12.844  -2.984
  827    HA   SER 105           HA       SER 105   3.752 -12.689  -2.031
  828   1HB   SER 105          2HB       SER 105   5.902 -13.962  -0.331
  829   2HB   SER 105          1HB       SER 105   4.172 -13.875   0.001
  830    HG   SER 105           HG       SER 105   5.542 -15.720  -1.400
  831    H    VAL 106           H        VAL 106   3.662 -11.531   0.130
  832    HA   VAL 106           HA       VAL 106   5.390  -9.189  -0.040
  833    HB   VAL 106           HB       VAL 106   3.834  -8.148   1.538
  834   1HG1  VAL 106          1HG1      VAL 106   2.091  -9.442  -0.507
  835   2HG1  VAL 106          2HG1      VAL 106   3.436  -8.425  -1.025
  836   3HG1  VAL 106          3HG1      VAL 106   2.167  -7.755   0.002
  837   1HG2  VAL 106          1HG2      VAL 106   1.711 -10.052   1.503
  838   2HG2  VAL 106          2HG2      VAL 106   2.539  -9.336   2.884
  839   3HG2  VAL 106          3HG2      VAL 106   3.159 -10.817   2.158
  840    H    GLU 107           H        GLU 107   5.708 -12.072   1.438
  841    HA   GLU 107           HA       GLU 107   6.130 -11.818   4.086
  842   1HB   GLU 107          2HB       GLU 107   6.638 -13.804   2.561
  843   2HB   GLU 107          1HB       GLU 107   8.231 -13.088   2.353
  844   1HG   GLU 107          2HG       GLU 107   8.160 -13.065   4.993
  845   2HG   GLU 107          1HG       GLU 107   7.026 -14.387   4.722
  846    H    ARG 108           H        ARG 108   8.373 -10.696   1.570
  847    HA   ARG 108           HA       ARG 108  10.319  -9.701   3.401
  848   1HB   ARG 108          2HB       ARG 108  10.596 -10.277   0.892
  849   2HB   ARG 108          1HB       ARG 108   9.945  -8.671   0.598
  850   1HG   ARG 108          2HG       ARG 108  11.928  -7.758   0.948
  851   2HG   ARG 108          1HG       ARG 108  12.025  -8.496   2.548
  852   1HD   ARG 108          2HD       ARG 108  12.686  -9.980   0.015
  853   2HD   ARG 108          1HD       ARG 108  13.886  -9.071   0.933
  854    HE   ARG 108           HE       ARG 108  12.740 -11.619   1.615
  855   1HH1  ARG 108          1HH1      ARG 108  14.305  -8.760   2.862
  856   2HH1  ARG 108          2HH1      ARG 108  14.914  -9.556   4.274
  857   1HH2  ARG 108          1HH2      ARG 108  13.541 -12.670   3.470
  858   2HH2  ARG 108          2HH2      ARG 108  14.480 -11.777   4.619
  859    H    PHE 109           H        PHE 109   7.517  -8.384   1.777
  860    HA   PHE 109           HA       PHE 109   7.848  -5.663   2.271
  861   1HB   PHE 109          2HB       PHE 109   6.066  -6.049   0.869
  862   2HB   PHE 109          1HB       PHE 109   5.553  -7.476   1.741
  863    HD1  PHE 109           1HD      PHE 109   5.417  -3.809   1.662
  864    HD2  PHE 109           2HD      PHE 109   3.918  -7.357   3.472
  865    HE1  PHE 109           1HE      PHE 109   3.614  -2.506   2.708
  866    HE2  PHE 109           2HE      PHE 109   2.111  -6.059   4.521
  867    HZ   PHE 109           HZ       PHE 109   1.955  -3.632   4.139
  868    H    LEU 110           H        LEU 110   7.092  -8.262   4.408
  869    HA   LEU 110           HA       LEU 110   5.792  -6.900   6.481
  870   1HB   LEU 110          2HB       LEU 110   6.453  -9.462   6.001
  871   2HB   LEU 110          1HB       LEU 110   7.629  -9.060   7.236
  872    HG   LEU 110           HG       LEU 110   4.670  -8.619   7.583
  873   1HD1  LEU 110          1HD1      LEU 110   4.719 -10.665   8.958
  874   2HD1  LEU 110          2HD1      LEU 110   6.363 -10.973   8.398
  875   3HD1  LEU 110          3HD1      LEU 110   5.025 -10.976   7.250
  876   1HD2  LEU 110          1HD2      LEU 110   7.059  -8.064   9.158
  877   2HD2  LEU 110          2HD2      LEU 110   5.850  -8.997  10.039
  878   3HD2  LEU 110          3HD2      LEU 110   5.419  -7.441   9.329
  879    H    LEU 111           H        LEU 111   9.233  -7.645   6.034
  880    HA   LEU 111           HA       LEU 111  10.193  -6.522   8.390
  881   1HB   LEU 111          2HB       LEU 111  11.554  -6.662   5.700
  882   2HB   LEU 111          1HB       LEU 111  12.359  -6.357   7.227
  883    HG   LEU 111           HG       LEU 111  11.177  -8.690   7.833
  884   1HD1  LEU 111          1HD1      LEU 111  11.230  -8.520   4.885
  885   2HD1  LEU 111          2HD1      LEU 111  10.174  -9.443   5.954
  886   3HD1  LEU 111          3HD1      LEU 111  11.801 -10.027   5.603
  887   1HD2  LEU 111          1HD2      LEU 111  13.699  -7.822   7.581
  888   2HD2  LEU 111          2HD2      LEU 111  13.654  -8.982   6.254
  889   3HD2  LEU 111          3HD2      LEU 111  13.284  -9.506   7.897
  890    H    THR 112           H        THR 112  10.157  -5.012   5.156
  891    HA   THR 112           HA       THR 112  11.058  -2.502   5.901
  892    HB   THR 112           HB       THR 112   9.103  -3.234   3.714
  893    HG1  THR 112           1HG      THR 112  11.918  -2.901   3.685
  894   1HG2  THR 112          1HG2      THR 112  10.464  -1.144   2.720
  895   2HG2  THR 112          2HG2      THR 112  10.349  -0.667   4.414
  896   3HG2  THR 112          3HG2      THR 112   8.885  -1.014   3.494
  897    H    ILE 113           H        ILE 113   7.741  -3.732   5.816
  898    HA   ILE 113           HA       ILE 113   6.226  -1.538   6.244
  899    HB   ILE 113           HB       ILE 113   5.998  -4.339   7.191
  900   1HG1  ILE 113          2HG1      ILE 113   5.226  -3.623   4.969
  901   2HG1  ILE 113          1HG1      ILE 113   3.894  -4.219   5.954
  902   1HG2  ILE 113          1HG2      ILE 113   5.279  -3.318   9.203
  903   2HG2  ILE 113          2HG2      ILE 113   3.820  -3.775   8.326
  904   3HG2  ILE 113          3HG2      ILE 113   4.353  -2.094   8.333
  905   1HD1  ILE 113          1HD1      ILE 113   4.091  -1.432   6.378
  906   2HD1  ILE 113          2HD1      ILE 113   2.802  -2.338   5.585
  907   3HD1  ILE 113          3HD1      ILE 113   4.158  -1.723   4.640
  908    H    LYS 114           H        LYS 114   7.796  -3.339   8.909
  909    HA   LYS 114           HA       LYS 114   6.989  -1.776  11.018
  910   1HB   LYS 114          2HB       LYS 114   8.488  -3.895  10.961
  911   2HB   LYS 114          1HB       LYS 114   9.817  -2.751  10.861
  912   1HG   LYS 114          2HG       LYS 114   7.778  -2.439  13.011
  913   2HG   LYS 114          1HG       LYS 114   9.031  -3.672  13.168
  914   1HD   LYS 114          2HD       LYS 114  10.421  -2.103  13.911
  915   2HD   LYS 114          1HD       LYS 114  10.335  -1.324  12.329
  916   1HE   LYS 114          2HE       LYS 114   9.715   0.370  13.796
  917   2HE   LYS 114          1HE       LYS 114   8.170  -0.251  13.216
  918   1HZ   LYS 114          1HZ       LYS 114   7.660  -1.126  15.225
  919   2HZ   LYS 114          2HZ       LYS 114   8.670   0.117  15.770
  920   3HZ   LYS 114          3HZ       LYS 114   9.266  -1.460  15.635
  921    H    HIS 115           H        HIS 115  10.084  -1.447   9.321
  922    HA   HIS 115           HA       HIS 115  10.821   1.006  10.385
  923   1HB   HIS 115          2HB       HIS 115  11.562  -0.538   7.973
  924   2HB   HIS 115          1HB       HIS 115  12.006   1.164   7.997
  925    HD1  HIS 115           1HD      HIS 115  14.521   0.496   8.124
  926    HD2  HIS 115           2HD      HIS 115  12.234  -0.759  11.358
  927    HE1  HIS 115           1HE      HIS 115  16.175  -0.189   9.890
  928    HE2  HIS 115           2HE      HIS 115  14.768  -0.854  11.872
  929    H    ALA 116           H        ALA 116   8.478   0.285   7.923
  930    HA   ALA 116           HA       ALA 116   8.414   2.831   6.674
  931   1HB   ALA 116          1HB       ALA 116   6.054   0.986   6.880
  932   2HB   ALA 116          2HB       ALA 116   7.428   0.631   5.833
  933   3HB   ALA 116          3HB       ALA 116   6.480   2.095   5.576
  934    H    PHE 117           H        PHE 117   6.746   1.451   9.451
  935    HA   PHE 117           HA       PHE 117   4.982   3.666   9.820
  936   1HB   PHE 117          2HB       PHE 117   5.675   1.198  11.355
  937   2HB   PHE 117          1HB       PHE 117   4.800   2.489  12.170
  938    HD1  PHE 117           1HD      PHE 117   2.516   2.855  11.774
  939    HD2  PHE 117           2HD      PHE 117   4.674   0.112   9.343
  940    HE1  PHE 117           1HE      PHE 117   0.401   2.046  10.823
  941    HE2  PHE 117           2HE      PHE 117   2.562  -0.703   8.385
  942    HZ   PHE 117           HZ       PHE 117   0.420   0.269   9.124
  943    H    GLU 118           H        GLU 118   8.264   3.099  10.643
  944    HA   GLU 118           HA       GLU 118   8.170   5.230  12.671
  945   1HB   GLU 118          2HB       GLU 118  10.242   3.088  12.198
  946   2HB   GLU 118          1HB       GLU 118  10.389   4.372  13.391
  947   1HG   GLU 118          2HG       GLU 118   8.071   3.439  14.200
  948   2HG   GLU 118          1HG       GLU 118   8.627   1.979  13.382
  949    H    GLU 119           H        GLU 119   9.536   4.310   9.604
  950    HA   GLU 119           HA       GLU 119  11.529   6.361   9.555
  951   1HB   GLU 119          2HB       GLU 119  10.384   4.572   7.427
  952   2HB   GLU 119          1HB       GLU 119  11.614   5.780   7.088
  953   1HG   GLU 119          2HG       GLU 119  12.380   4.156   9.334
  954   2HG   GLU 119          1HG       GLU 119  11.999   3.154   7.934
  955    H    TYR 120           H        TYR 120   8.224   6.544   9.359
  956    HA   TYR 120           HA       TYR 120   8.400   9.091   7.911
  957   1HB   TYR 120          2HB       TYR 120   7.025   6.782   7.036
  958   2HB   TYR 120          1HB       TYR 120   5.798   7.928   7.561
  959    HD1  TYR 120           1HD      TYR 120   5.762  10.226   6.532
  960    HD2  TYR 120           2HD      TYR 120   8.194   7.086   5.007
  961    HE1  TYR 120           1HE      TYR 120   5.994  11.444   4.408
  962    HE2  TYR 120           2HE      TYR 120   8.432   8.295   2.879
  963    HH   TYR 120           HH       TYR 120   7.880  11.415   2.465
  964    H    SER 121           H        SER 121   8.520   8.724  10.707
  965    HA   SER 121           HA       SER 121   5.969   9.111  11.913
  966   1HB   SER 121          2HB       SER 121   7.394   9.888  13.891
  967   2HB   SER 121          1HB       SER 121   7.664   8.240  13.323
  968    HG   SER 121           HG       SER 121   9.231  10.521  12.686
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  -2.790   2.175  14.942
    2   2H    MET   1          2HT       MET   1  -1.451   2.376  15.997
    3   3H    MET   1          3HT       MET   1  -3.049   2.598  16.582
    4    HA   MET   1           HA       MET   1  -1.900   0.472  17.153
    5   1HB   MET   1          2HB       MET   1  -4.607   1.067  16.235
    6   2HB   MET   1          1HB       MET   1  -4.221  -0.644  16.115
    7   1HG   MET   1          2HG       MET   1  -3.936  -0.879  18.391
    8   2HG   MET   1          1HG       MET   1  -3.630   0.840  18.634
    9   1HE   MET   1          1HE       MET   1  -5.946  -0.422  20.774
   10   2HE   MET   1          2HE       MET   1  -5.496  -1.691  19.634
   11   3HE   MET   1          3HE       MET   1  -7.187  -1.221  19.809
   12    H    LYS   2           H        LYS   2  -0.761   1.206  14.537
   13    HA   LYS   2           HA       LYS   2   0.231   0.192  12.762
   14   1HB   LYS   2          2HB       LYS   2  -0.096  -1.887  14.754
   15   2HB   LYS   2          1HB       LYS   2  -0.078  -2.532  13.118
   16   1HG   LYS   2          2HG       LYS   2   2.149  -2.587  13.664
   17   2HG   LYS   2          1HG       LYS   2   2.027  -1.032  12.839
   18   1HD   LYS   2          2HD       LYS   2   2.316   0.166  14.762
   19   2HD   LYS   2          1HD       LYS   2   1.585  -1.080  15.776
   20   1HE   LYS   2          2HE       LYS   2   3.541  -2.334  15.862
   21   2HE   LYS   2          1HE       LYS   2   4.210  -1.566  14.421
   22   1HZ   LYS   2          1HZ       LYS   2   5.138  -0.915  16.704
   23   2HZ   LYS   2          2HZ       LYS   2   3.728   0.006  16.869
   24   3HZ   LYS   2          3HZ       LYS   2   4.799   0.319  15.599
   25    H    ARG   3           H        ARG   3  -1.034   0.722  11.054
   26    HA   ARG   3           HA       ARG   3  -2.857  -1.338  10.088
   27   1HB   ARG   3          2HB       ARG   3  -3.741   1.541  10.074
   28   2HB   ARG   3          1HB       ARG   3  -4.699   0.106   9.737
   29   1HG   ARG   3          2HG       ARG   3  -5.434   0.598  11.834
   30   2HG   ARG   3          1HG       ARG   3  -4.097  -0.483  12.226
   31   1HD   ARG   3          2HD       ARG   3  -2.960   1.139  13.256
   32   2HD   ARG   3          1HD       ARG   3  -3.245   2.281  11.943
   33    HE   ARG   3           HE       ARG   3  -4.711   2.065  14.401
   34   1HH1  ARG   3          1HH1      ARG   3  -4.872   3.092  11.069
   35   2HH1  ARG   3          2HH1      ARG   3  -6.141   4.236  11.352
   36   1HH2  ARG   3          1HH2      ARG   3  -6.380   3.569  14.775
   37   2HH2  ARG   3          2HH2      ARG   3  -6.997   4.507  13.456
   38    H    VAL   4           H        VAL   4  -2.486  -1.723   7.994
   39    HA   VAL   4           HA       VAL   4  -1.264   0.429   6.387
   40    HB   VAL   4           HB       VAL   4  -0.729  -2.524   6.039
   41   1HG1  VAL   4          1HG1      VAL   4   1.291  -1.381   4.788
   42   2HG1  VAL   4          2HG1      VAL   4   0.146  -0.048   4.643
   43   3HG1  VAL   4          3HG1      VAL   4  -0.260  -1.633   3.985
   44   1HG2  VAL   4          1HG2      VAL   4   1.113  -0.459   7.241
   45   2HG2  VAL   4          2HG2      VAL   4   1.411  -2.189   7.068
   46   3HG2  VAL   4          3HG2      VAL   4   0.171  -1.616   8.183
   47    H    LEU   5           H        LEU   5  -1.805   0.471   4.152
   48    HA   LEU   5           HA       LEU   5  -4.415  -0.748   3.591
   49   1HB   LEU   5          2HB       LEU   5  -4.311   1.697   3.482
   50   2HB   LEU   5          1HB       LEU   5  -3.031   1.599   2.289
   51    HG   LEU   5           HG       LEU   5  -4.655   0.416   0.772
   52   1HD1  LEU   5          1HD1      LEU   5  -6.825   0.085   1.310
   53   2HD1  LEU   5          2HD1      LEU   5  -6.907   1.522   2.329
   54   3HD1  LEU   5          3HD1      LEU   5  -6.168   0.045   2.946
   55   1HD2  LEU   5          1HD2      LEU   5  -4.935   3.247   1.668
   56   2HD2  LEU   5          2HD2      LEU   5  -6.047   2.606   0.458
   57   3HD2  LEU   5          3HD2      LEU   5  -4.311   2.602   0.150
   58    H    VAL   6           H        VAL   6  -4.699  -2.133   1.916
   59    HA   VAL   6           HA       VAL   6  -2.354  -2.650   0.201
   60    HB   VAL   6           HB       VAL   6  -4.395  -4.721   0.982
   61   1HG1  VAL   6          1HG1      VAL   6  -3.277  -5.265  -1.050
   62   2HG1  VAL   6          2HG1      VAL   6  -2.572  -6.259   0.225
   63   3HG1  VAL   6          3HG1      VAL   6  -1.707  -4.842  -0.368
   64   1HG2  VAL   6          1HG2      VAL   6  -2.941  -5.530   2.659
   65   2HG2  VAL   6          2HG2      VAL   6  -3.072  -3.792   2.929
   66   3HG2  VAL   6          3HG2      VAL   6  -1.637  -4.457   2.150
   67    H    VAL   7           H        VAL   7  -3.090  -1.308  -1.466
   68    HA   VAL   7           HA       VAL   7  -5.705  -1.688  -2.609
   69    HB   VAL   7           HB       VAL   7  -3.379  -0.196  -3.835
   70   1HG1  VAL   7          1HG1      VAL   7  -5.452  -0.806  -5.200
   71   2HG1  VAL   7          2HG1      VAL   7  -4.948   0.885  -5.188
   72   3HG1  VAL   7          3HG1      VAL   7  -6.304   0.362  -4.189
   73   1HG2  VAL   7          1HG2      VAL   7  -5.265   0.565  -1.656
   74   2HG2  VAL   7          2HG2      VAL   7  -4.752   1.795  -2.811
   75   3HG2  VAL   7          3HG2      VAL   7  -3.552   0.936  -1.845
   76    H    ASP   8           H        ASP   8  -6.200  -3.367  -3.842
   77    HA   ASP   8           HA       ASP   8  -4.451  -4.161  -6.002
   78   1HB   ASP   8          2HB       ASP   8  -3.536  -5.515  -4.204
   79   2HB   ASP   8          1HB       ASP   8  -5.143  -6.082  -3.765
   80    H    ASP   9           H        ASP   9  -5.520  -5.805  -7.405
   81    HA   ASP   9           HA       ASP   9  -8.326  -5.168  -7.643
   82   1HB   ASP   9          2HB       ASP   9  -6.892  -5.180  -9.635
   83   2HB   ASP   9          1HB       ASP   9  -6.548  -6.887  -9.387
   84    H    GLU  10           H        GLU  10  -8.050  -6.535  -5.348
   85    HA   GLU  10           HA       GLU  10  -9.073  -9.227  -5.970
   86   1HB   GLU  10          2HB       GLU  10  -6.876  -9.047  -4.680
   87   2HB   GLU  10          1HB       GLU  10  -7.829  -8.407  -3.350
   88   1HG   GLU  10          2HG       GLU  10  -8.793 -10.412  -2.886
   89   2HG   GLU  10          1HG       GLU  10  -8.699 -10.970  -4.556
   90    H    GLU  11           H        GLU  11 -10.578 -10.073  -4.221
   91    HA   GLU  11           HA       GLU  11 -12.658  -8.115  -3.825
   92   1HB   GLU  11          2HB       GLU  11 -12.430 -11.043  -3.750
   93   2HB   GLU  11          1HB       GLU  11 -13.540 -10.381  -2.559
   94   1HG   GLU  11          2HG       GLU  11 -14.943 -10.712  -4.330
   95   2HG   GLU  11          1HG       GLU  11 -14.465  -9.035  -4.594
   96    H    SER  12           H        SER  12 -11.702 -10.581  -1.466
   97    HA   SER  12           HA       SER  12 -11.718  -8.484   0.597
   98   1HB   SER  12          2HB       SER  12 -12.003 -11.464   1.026
   99   2HB   SER  12          1HB       SER  12 -12.319 -10.179   2.190
  100    HG   SER  12           HG       SER  12 -14.253 -10.031   1.410
  101    H    ILE  13           H        ILE  13  -9.761  -7.842   1.200
  102    HA   ILE  13           HA       ILE  13  -7.550  -7.764   1.625
  103    HB   ILE  13           HB       ILE  13  -8.002 -10.532   2.623
  104   1HG1  ILE  13          2HG1      ILE  13  -9.724  -8.916   3.436
  105   2HG1  ILE  13          1HG1      ILE  13  -8.749  -9.627   4.717
  106   1HG2  ILE  13          1HG2      ILE  13  -5.715 -10.141   2.757
  107   2HG2  ILE  13          2HG2      ILE  13  -6.298  -9.717   4.368
  108   3HG2  ILE  13          3HG2      ILE  13  -5.943  -8.448   3.195
  109   1HD1  ILE  13          1HD1      ILE  13  -7.315  -7.513   4.523
  110   2HD1  ILE  13          2HD1      ILE  13  -8.897  -7.384   5.289
  111   3HD1  ILE  13          3HD1      ILE  13  -8.677  -6.845   3.625
  112    H    THR  14           H        THR  14  -5.421  -8.737   1.270
  113    HA   THR  14           HA       THR  14  -5.327 -10.041  -1.329
  114    HB   THR  14           HB       THR  14  -2.897  -9.486  -1.235
  115    HG1  THR  14           1HG      THR  14  -3.553  -8.084   1.135
  116   1HG2  THR  14          1HG2      THR  14  -3.091  -7.205  -1.663
  117   2HG2  THR  14          2HG2      THR  14  -4.448  -7.018  -0.552
  118   3HG2  THR  14          3HG2      THR  14  -4.671  -7.864  -2.084
  119    H    SER  15           H        SER  15  -3.610 -11.751  -1.650
  120    HA   SER  15           HA       SER  15  -4.004 -13.794   0.355
  121   1HB   SER  15          2HB       SER  15  -4.113 -14.161  -2.167
  122   2HB   SER  15          1HB       SER  15  -2.353 -14.051  -2.157
  123    HG   SER  15           HG       SER  15  -2.475 -15.764  -0.505
  124    H    SER  16           H        SER  16  -2.556 -14.593   1.752
  125    HA   SER  16           HA       SER  16  -0.573 -15.035   2.800
  126   1HB   SER  16          2HB       SER  16   0.907 -13.262   0.870
  127   2HB   SER  16          1HB       SER  16   1.513 -14.639   1.790
  128    HG   SER  16           HG       SER  16   0.043 -14.577  -0.577
  129    H    LEU  17           H        LEU  17  -1.900 -11.973   2.313
  130    HA   LEU  17           HA       LEU  17  -0.080 -10.629   4.140
  131   1HB   LEU  17          2HB       LEU  17  -1.902  -9.818   2.095
  132   2HB   LEU  17          1HB       LEU  17  -2.401  -9.063   3.590
  133    HG   LEU  17           HG       LEU  17  -0.380  -8.232   1.790
  134   1HD1  LEU  17          1HD1      LEU  17  -0.725  -6.254   2.791
  135   2HD1  LEU  17          2HD1      LEU  17  -0.562  -6.921   4.415
  136   3HD1  LEU  17          3HD1      LEU  17  -2.081  -7.099   3.537
  137   1HD2  LEU  17          1HD2      LEU  17   1.554  -7.953   3.230
  138   2HD2  LEU  17          2HD2      LEU  17   1.197  -9.665   3.011
  139   3HD2  LEU  17          3HD2      LEU  17   0.755  -8.859   4.515
  140    H    SER  18           H        SER  18  -3.536 -11.444   3.984
  141    HA   SER  18           HA       SER  18  -4.419 -10.520   6.394
  142   1HB   SER  18          2HB       SER  18  -5.482 -12.116   4.450
  143   2HB   SER  18          1HB       SER  18  -5.367 -13.247   5.799
  144    HG   SER  18           HG       SER  18  -7.356 -12.006   5.690
  145    H    ALA  19           H        ALA  19  -3.047 -13.766   5.852
  146    HA   ALA  19           HA       ALA  19  -3.068 -14.661   8.478
  147   1HB   ALA  19          1HB       ALA  19  -2.309 -15.737   6.139
  148   2HB   ALA  19          2HB       ALA  19  -1.894 -16.434   7.704
  149   3HB   ALA  19          3HB       ALA  19  -0.726 -15.427   6.850
  150    H    ILE  20           H        ILE  20  -0.705 -12.683   6.786
  151    HA   ILE  20           HA       ILE  20   1.251 -12.667   8.840
  152    HB   ILE  20           HB       ILE  20   0.766 -10.833   6.496
  153   1HG1  ILE  20          2HG1      ILE  20   2.892 -12.914   7.034
  154   2HG1  ILE  20          1HG1      ILE  20   1.485 -13.140   5.999
  155   1HG2  ILE  20          1HG2      ILE  20   2.753 -10.635   8.698
  156   2HG2  ILE  20          2HG2      ILE  20   1.920  -9.361   7.806
  157   3HG2  ILE  20          3HG2      ILE  20   3.265 -10.226   7.060
  158   1HD1  ILE  20          1HD1      ILE  20   3.668 -12.618   4.852
  159   2HD1  ILE  20          2HD1      ILE  20   3.515 -10.989   5.509
  160   3HD1  ILE  20          3HD1      ILE  20   2.288 -11.613   4.406
  161    H    LEU  21           H        LEU  21  -0.680  -9.892   7.706
  162    HA   LEU  21           HA       LEU  21  -0.258  -8.174   9.776
  163   1HB   LEU  21          2HB       LEU  21  -2.884  -8.575   8.357
  164   2HB   LEU  21          1HB       LEU  21  -2.377  -7.126   9.206
  165    HG   LEU  21           HG       LEU  21  -0.458  -7.916   7.173
  166   1HD1  LEU  21          1HD1      LEU  21  -1.820  -8.477   5.521
  167   2HD1  LEU  21          2HD1      LEU  21  -2.434  -6.825   5.555
  168   3HD1  LEU  21          3HD1      LEU  21  -3.250  -8.088   6.475
  169   1HD2  LEU  21          1HD2      LEU  21  -0.560  -5.746   8.349
  170   2HD2  LEU  21          2HD2      LEU  21  -2.085  -5.406   7.531
  171   3HD2  LEU  21          3HD2      LEU  21  -0.601  -5.587   6.594
  172    H    GLU  22           H        GLU  22  -2.406 -10.944   9.747
  173    HA   GLU  22           HA       GLU  22  -3.750 -10.289  12.181
  174   1HB   GLU  22          2HB       GLU  22  -3.679 -12.598  10.338
  175   2HB   GLU  22          1HB       GLU  22  -4.162 -12.924  11.996
  176   1HG   GLU  22          2HG       GLU  22  -6.197 -12.187  11.571
  177   2HG   GLU  22          1HG       GLU  22  -5.549 -10.613  11.109
  178    H    GLU  23           H        GLU  23  -0.804 -11.944  11.356
  179    HA   GLU  23           HA       GLU  23  -0.502 -13.156  13.957
  180   1HB   GLU  23          2HB       GLU  23   0.439 -14.412  12.199
  181   2HB   GLU  23          1HB       GLU  23   1.203 -13.000  11.483
  182   1HG   GLU  23          2HG       GLU  23   3.039 -13.229  12.714
  183   2HG   GLU  23          1HG       GLU  23   2.122 -13.542  14.187
  184    H    GLU  24           H        GLU  24   0.667 -10.336  12.222
  185    HA   GLU  24           HA       GLU  24   2.527  -9.593  14.291
  186   1HB   GLU  24          2HB       GLU  24   1.689  -8.463  11.675
  187   2HB   GLU  24          1HB       GLU  24   2.425  -7.377  12.846
  188   1HG   GLU  24          2HG       GLU  24   3.732  -9.967  12.123
  189   2HG   GLU  24          1HG       GLU  24   3.919  -8.538  11.107
  190    H    GLY  25           H        GLY  25  -0.748  -8.805  13.372
  191   1HA   GLY  25          2HA       GLY  25  -2.331  -8.024  14.971
  192   2HA   GLY  25          1HA       GLY  25  -1.011  -7.275  15.852
  193    H    TYR  26           H        TYR  26  -1.334  -7.000  12.396
  194    HA   TYR  26           HA       TYR  26  -1.497  -4.116  12.635
  195   1HB   TYR  26          2HB       TYR  26  -1.056  -6.026  10.358
  196   2HB   TYR  26          1HB       TYR  26  -1.434  -4.337  10.046
  197    HD1  TYR  26           1HD      TYR  26   0.115  -2.562  10.858
  198    HD2  TYR  26           2HD      TYR  26   1.113  -6.691  11.050
  199    HE1  TYR  26           1HE      TYR  26   2.484  -1.968  11.134
  200    HE2  TYR  26           2HE      TYR  26   3.486  -6.111  11.328
  201    HH   TYR  26           HH       TYR  26   4.536  -2.950  12.028
  202    H    HIS  27           H        HIS  27  -2.878  -3.253  10.555
  203    HA   HIS  27           HA       HIS  27  -5.550  -4.443  10.657
  204   1HB   HIS  27          2HB       HIS  27  -5.009  -2.296  12.216
  205   2HB   HIS  27          1HB       HIS  27  -5.464  -1.482  10.724
  206    HD1  HIS  27           1HD      HIS  27  -7.021  -4.611  12.205
  207    HD2  HIS  27           2HD      HIS  27  -7.998  -0.675  11.300
  208    HE1  HIS  27           1HE      HIS  27  -9.489  -4.413  12.645
  209    HE2  HIS  27           2HE      HIS  27 -10.073  -2.047  12.005
  210    HA   PRO  28           HA       PRO  28  -4.419  -3.388   6.362
  211   1HB   PRO  28          2HB       PRO  28  -5.433  -5.595   5.214
  212   2HB   PRO  28          1HB       PRO  28  -3.857  -5.587   6.013
  213   1HG   PRO  28          2HG       PRO  28  -6.483  -6.595   7.013
  214   2HG   PRO  28          1HG       PRO  28  -4.868  -7.294   7.207
  215   1HD   PRO  28          2HD       PRO  28  -6.168  -5.813   9.133
  216   2HD   PRO  28          1HD       PRO  28  -4.408  -6.007   9.039
  217    H    ASP  29           H        ASP  29  -5.633  -2.156   5.100
  218    HA   ASP  29           HA       ASP  29  -8.528  -2.314   5.408
  219   1HB   ASP  29          2HB       ASP  29  -6.737  -0.114   5.336
  220   2HB   ASP  29          1HB       ASP  29  -7.866   0.029   3.995
  221    H    THR  30           H        THR  30  -6.246  -3.273   3.372
  222    HA   THR  30           HA       THR  30  -6.101  -3.329   1.016
  223    HB   THR  30           HB       THR  30  -7.138  -5.420   0.418
  224    HG1  THR  30           1HG      THR  30  -9.188  -5.048   1.358
  225   1HG2  THR  30          1HG2      THR  30  -5.510  -6.320   1.620
  226   2HG2  THR  30          2HG2      THR  30  -6.692  -6.516   2.913
  227   3HG2  THR  30          3HG2      THR  30  -5.657  -5.090   2.875
  228    H    ALA  31           H        ALA  31  -6.735  -2.300  -0.696
  229    HA   ALA  31           HA       ALA  31  -9.598  -1.694  -1.044
  230   1HB   ALA  31          1HB       ALA  31  -8.692   0.400  -0.971
  231   2HB   ALA  31          2HB       ALA  31  -8.502   0.070  -2.694
  232   3HB   ALA  31          3HB       ALA  31  -7.133  -0.132  -1.600
  233    H    LYS  32           H        LYS  32 -10.422  -1.744  -3.243
  234    HA   LYS  32           HA       LYS  32  -9.370  -3.996  -4.699
  235   1HB   LYS  32          2HB       LYS  32 -11.621  -2.234  -5.632
  236   2HB   LYS  32          1HB       LYS  32 -11.353  -3.939  -5.970
  237   1HG   LYS  32          2HG       LYS  32 -11.841  -4.476  -3.635
  238   2HG   LYS  32          1HG       LYS  32 -12.123  -2.766  -3.308
  239   1HD   LYS  32          2HD       LYS  32 -13.647  -4.267  -5.421
  240   2HD   LYS  32          1HD       LYS  32 -14.173  -4.221  -3.736
  241   1HE   LYS  32          2HE       LYS  32 -15.286  -2.375  -4.355
  242   2HE   LYS  32          1HE       LYS  32 -13.714  -1.586  -4.233
  243   1HZ   LYS  32          1HZ       LYS  32 -14.807  -1.092  -6.334
  244   2HZ   LYS  32          2HZ       LYS  32 -14.873  -2.740  -6.713
  245   3HZ   LYS  32          3HZ       LYS  32 -13.377  -1.960  -6.592
  246    H    THR  33           H        THR  33  -9.324  -0.536  -4.985
  247    HA   THR  33           HA       THR  33  -7.274  -0.616  -6.952
  248    HB   THR  33           HB       THR  33  -8.820   0.875  -8.533
  249    HG1  THR  33           1HG      THR  33 -10.891   0.408  -8.420
  250   1HG2  THR  33          1HG2      THR  33  -7.654  -1.452  -8.914
  251   2HG2  THR  33          2HG2      THR  33  -8.862  -0.827 -10.037
  252   3HG2  THR  33          3HG2      THR  33  -9.318  -2.032  -8.832
  253    H    LEU  34           H        LEU  34  -7.030   1.778  -7.882
  254    HA   LEU  34           HA       LEU  34  -6.409   3.406  -5.706
  255   1HB   LEU  34          2HB       LEU  34  -6.920   4.290  -8.548
  256   2HB   LEU  34          1HB       LEU  34  -6.009   5.171  -7.334
  257    HG   LEU  34           HG       LEU  34  -5.160   2.429  -8.219
  258   1HD1  LEU  34          1HD1      LEU  34  -3.812   4.753  -9.423
  259   2HD1  LEU  34          2HD1      LEU  34  -5.426   4.395 -10.038
  260   3HD1  LEU  34          3HD1      LEU  34  -4.164   3.163 -10.100
  261   1HD2  LEU  34          1HD2      LEU  34  -4.294   3.985  -6.184
  262   2HD2  LEU  34          2HD2      LEU  34  -3.224   4.518  -7.481
  263   3HD2  LEU  34          3HD2      LEU  34  -3.286   2.813  -7.034
  264    H    ARG  35           H        ARG  35  -9.322   3.177  -7.636
  265    HA   ARG  35           HA       ARG  35 -10.557   5.566  -6.791
  266   1HB   ARG  35          2HB       ARG  35 -11.513   2.985  -7.954
  267   2HB   ARG  35          1HB       ARG  35 -12.700   4.080  -7.262
  268   1HG   ARG  35          2HG       ARG  35 -12.738   5.152  -9.197
  269   2HG   ARG  35          1HG       ARG  35 -11.086   5.682  -8.878
  270   1HD   ARG  35          2HD       ARG  35 -10.299   4.410 -10.523
  271   2HD   ARG  35          1HD       ARG  35 -11.094   2.981  -9.864
  272    HE   ARG  35           HE       ARG  35 -12.865   4.732 -11.298
  273   1HH1  ARG  35          1HH1      ARG  35 -10.612   2.083 -11.583
  274   2HH1  ARG  35          2HH1      ARG  35 -11.301   1.493 -13.057
  275   1HH2  ARG  35          1HH2      ARG  35 -13.771   3.958 -13.238
  276   2HH2  ARG  35          2HH2      ARG  35 -13.092   2.559 -13.999
  277    H    GLU  36           H        GLU  36 -11.007   2.220  -5.650
  278    HA   GLU  36           HA       GLU  36 -12.599   2.920  -3.422
  279   1HB   GLU  36          2HB       GLU  36 -12.219   0.607  -4.588
  280   2HB   GLU  36          1HB       GLU  36 -10.879   0.461  -3.458
  281   1HG   GLU  36          2HG       GLU  36 -13.743   0.953  -2.675
  282   2HG   GLU  36          1HG       GLU  36 -12.945  -0.619  -2.670
  283    H    ALA  37           H        ALA  37  -9.161   2.765  -3.965
  284    HA   ALA  37           HA       ALA  37  -8.400   2.791  -1.212
  285   1HB   ALA  37          1HB       ALA  37  -6.605   3.841  -3.351
  286   2HB   ALA  37          2HB       ALA  37  -7.034   2.130  -3.353
  287   3HB   ALA  37          3HB       ALA  37  -6.225   2.833  -1.953
  288    H    GLU  38           H        GLU  38  -9.239   5.220  -3.570
  289    HA   GLU  38           HA       GLU  38  -8.125   7.433  -2.155
  290   1HB   GLU  38          2HB       GLU  38 -10.123   7.160  -4.375
  291   2HB   GLU  38          1HB       GLU  38  -9.829   8.718  -3.616
  292   1HG   GLU  38          2HG       GLU  38  -7.598   8.774  -4.343
  293   2HG   GLU  38          1HG       GLU  38  -7.609   7.061  -4.761
  294    H    LYS  39           H        LYS  39 -11.284   5.885  -2.305
  295    HA   LYS  39           HA       LYS  39 -12.638   7.733  -0.644
  296   1HB   LYS  39          2HB       LYS  39 -13.912   6.252  -2.053
  297   2HB   LYS  39          1HB       LYS  39 -13.190   4.835  -1.304
  298   1HG   LYS  39          2HG       LYS  39 -14.750   6.745   0.372
  299   2HG   LYS  39          1HG       LYS  39 -15.595   5.586  -0.657
  300   1HD   LYS  39          2HD       LYS  39 -13.894   3.898   0.462
  301   2HD   LYS  39          1HD       LYS  39 -13.887   5.120   1.735
  302   1HE   LYS  39          2HE       LYS  39 -15.811   4.329   2.509
  303   2HE   LYS  39          1HE       LYS  39 -16.583   4.680   0.963
  304   1HZ   LYS  39          1HZ       LYS  39 -14.971   2.266   1.064
  305   2HZ   LYS  39          2HZ       LYS  39 -16.466   2.542   0.320
  306   3HZ   LYS  39          3HZ       LYS  39 -16.391   2.237   1.981
  307    H    LYS  40           H        LYS  40 -10.686   4.887  -0.023
  308    HA   LYS  40           HA       LYS  40 -11.352   4.747   2.768
  309   1HB   LYS  40          2HB       LYS  40  -9.129   3.445   1.191
  310   2HB   LYS  40          1HB       LYS  40  -9.513   3.086   2.869
  311   1HG   LYS  40          2HG       LYS  40 -11.910   2.814   1.420
  312   2HG   LYS  40          1HG       LYS  40 -10.651   2.004   0.485
  313   1HD   LYS  40          2HD       LYS  40 -10.057   0.629   2.355
  314   2HD   LYS  40          1HD       LYS  40 -11.114   1.546   3.429
  315   1HE   LYS  40          2HE       LYS  40 -12.938   0.818   1.656
  316   2HE   LYS  40          1HE       LYS  40 -11.791  -0.489   1.370
  317   1HZ   LYS  40          1HZ       LYS  40 -13.465  -1.055   3.045
  318   2HZ   LYS  40          2HZ       LYS  40 -12.932   0.220   4.019
  319   3HZ   LYS  40          3HZ       LYS  40 -11.902  -1.081   3.690
  320    H    ILE  41           H        ILE  41  -8.775   6.149   0.825
  321    HA   ILE  41           HA       ILE  41  -7.175   6.881   3.104
  322    HB   ILE  41           HB       ILE  41  -6.989   7.796   0.228
  323   1HG1  ILE  41          2HG1      ILE  41  -5.043   5.935   1.523
  324   2HG1  ILE  41          1HG1      ILE  41  -6.597   5.290   1.005
  325   1HG2  ILE  41          1HG2      ILE  41  -5.412   8.440   2.654
  326   2HG2  ILE  41          2HG2      ILE  41  -5.768   9.426   1.235
  327   3HG2  ILE  41          3HG2      ILE  41  -4.524   8.178   1.152
  328   1HD1  ILE  41          1HD1      ILE  41  -6.029   6.423  -1.251
  329   2HD1  ILE  41          2HD1      ILE  41  -5.249   4.901  -0.819
  330   3HD1  ILE  41          3HD1      ILE  41  -4.377   6.423  -0.632
  331    H    LYS  42           H        LYS  42  -9.764   8.287   1.289
  332    HA   LYS  42           HA       LYS  42  -9.299  10.954   2.350
  333   1HB   LYS  42          2HB       LYS  42 -11.230   9.785   0.389
  334   2HB   LYS  42          1HB       LYS  42 -11.540  11.362   1.102
  335   1HG   LYS  42          2HG       LYS  42  -9.739  12.341   0.053
  336   2HG   LYS  42          1HG       LYS  42  -8.897  10.807  -0.163
  337   1HD   LYS  42          2HD       LYS  42  -9.745  10.618  -2.210
  338   2HD   LYS  42          1HD       LYS  42 -11.379  10.662  -1.548
  339   1HE   LYS  42          2HE       LYS  42 -10.933  13.245  -1.454
  340   2HE   LYS  42          1HE       LYS  42  -9.724  12.870  -2.682
  341   1HZ   LYS  42          1HZ       LYS  42 -12.480  11.877  -2.975
  342   2HZ   LYS  42          2HZ       LYS  42 -11.323  12.181  -4.170
  343   3HZ   LYS  42          3HZ       LYS  42 -12.108  13.469  -3.403
  344    H    GLU  43           H        GLU  43  -9.941   8.723   4.159
  345    HA   GLU  43           HA       GLU  43 -12.140  10.015   5.556
  346   1HB   GLU  43          2HB       GLU  43 -12.119   7.069   4.892
  347   2HB   GLU  43          1HB       GLU  43 -13.230   7.832   6.020
  348   1HG   GLU  43          2HG       GLU  43 -14.173   9.168   4.241
  349   2HG   GLU  43          1HG       GLU  43 -13.011   8.502   3.095
  350    H    LEU  44           H        LEU  44  -9.753   7.386   5.613
  351    HA   LEU  44           HA       LEU  44  -9.350   7.920   8.480
  352   1HB   LEU  44          2HB       LEU  44  -9.995   5.717   8.453
  353   2HB   LEU  44          1HB       LEU  44  -9.327   5.425   6.860
  354    HG   LEU  44           HG       LEU  44  -7.442   5.896   9.125
  355   1HD1  LEU  44          1HD1      LEU  44  -8.809   3.265   8.591
  356   2HD1  LEU  44          2HD1      LEU  44  -9.076   4.290  10.000
  357   3HD1  LEU  44          3HD1      LEU  44  -7.496   3.554   9.733
  358   1HD2  LEU  44          1HD2      LEU  44  -6.315   4.000   7.730
  359   2HD2  LEU  44          2HD2      LEU  44  -6.300   5.662   7.140
  360   3HD2  LEU  44          3HD2      LEU  44  -7.458   4.506   6.485
  361    H    PHE  45           H        PHE  45  -7.161   7.816   9.277
  362    HA   PHE  45           HA       PHE  45  -5.292   8.992   7.403
  363   1HB   PHE  45          2HB       PHE  45  -5.710   9.755   9.827
  364   2HB   PHE  45          1HB       PHE  45  -4.719   8.377  10.293
  365    HD1  PHE  45           1HD      PHE  45  -4.486  10.998   7.643
  366    HD2  PHE  45           2HD      PHE  45  -2.607   9.008  10.901
  367    HE1  PHE  45           1HE      PHE  45  -2.458  12.347   7.292
  368    HE2  PHE  45           2HE      PHE  45  -0.576  10.354  10.557
  369    HZ   PHE  45           HZ       PHE  45  -0.500  12.026   8.751
  370    H    PHE  46           H        PHE  46  -4.690   7.294   6.050
  371    HA   PHE  46           HA       PHE  46  -3.695   4.817   7.083
  372   1HB   PHE  46          2HB       PHE  46  -3.900   6.067   4.372
  373   2HB   PHE  46          1HB       PHE  46  -2.878   4.651   4.597
  374    HD1  PHE  46           1HD      PHE  46  -5.801   5.431   3.260
  375    HD2  PHE  46           2HD      PHE  46  -4.333   2.990   6.418
  376    HE1  PHE  46           1HE      PHE  46  -7.774   3.979   3.047
  377    HE2  PHE  46           2HE      PHE  46  -6.305   1.532   6.215
  378    HZ   PHE  46           HZ       PHE  46  -8.030   2.026   4.525
  379    HA   PRO  47           HA       PRO  47   0.396   6.602   7.755
  380   1HB   PRO  47          2HB       PRO  47   1.405   4.569   9.192
  381   2HB   PRO  47          1HB       PRO  47   0.235   5.701   9.882
  382   1HG   PRO  47          2HG       PRO  47  -0.203   2.944   8.805
  383   2HG   PRO  47          1HG       PRO  47  -0.873   3.694  10.265
  384   1HD   PRO  47          2HD       PRO  47  -2.240   3.474   7.902
  385   2HD   PRO  47          1HD       PRO  47  -2.546   4.743   9.103
  386    H    VAL  48           H        VAL  48  -0.420   3.522   6.345
  387    HA   VAL  48           HA       VAL  48   1.923   3.678   4.628
  388    HB   VAL  48           HB       VAL  48   1.262   1.042   5.893
  389   1HG1  VAL  48          1HG1      VAL  48   3.313   2.127   4.106
  390   2HG1  VAL  48          2HG1      VAL  48   2.733   0.474   4.298
  391   3HG1  VAL  48          3HG1      VAL  48   3.941   1.119   5.410
  392   1HG2  VAL  48          1HG2      VAL  48   1.687   2.489   7.752
  393   2HG2  VAL  48          2HG2      VAL  48   3.112   3.160   6.960
  394   3HG2  VAL  48          3HG2      VAL  48   3.108   1.477   7.493
  395    H    ILE  49           H        ILE  49   1.494   3.100   2.603
  396    HA   ILE  49           HA       ILE  49  -1.048   1.739   2.026
  397    HB   ILE  49           HB       ILE  49   0.410   3.602   0.155
  398   1HG1  ILE  49          2HG1      ILE  49  -0.287   4.836   2.168
  399   2HG1  ILE  49          1HG1      ILE  49  -1.224   5.321   0.758
  400   1HG2  ILE  49          1HG2      ILE  49  -2.063   2.007   0.049
  401   2HG2  ILE  49          2HG2      ILE  49  -0.985   2.524  -1.248
  402   3HG2  ILE  49          3HG2      ILE  49  -2.177   3.646  -0.591
  403   1HD1  ILE  49          1HD1      ILE  49  -2.085   3.627   3.076
  404   2HD1  ILE  49          2HD1      ILE  49  -2.990   3.691   1.564
  405   3HD1  ILE  49          3HD1      ILE  49  -2.759   5.157   2.516
  406    H    VAL  50           H        VAL  50  -1.058   0.203   0.324
  407    HA   VAL  50           HA       VAL  50   1.531  -0.584  -0.779
  408    HB   VAL  50           HB       VAL  50  -0.259  -2.451   0.783
  409   1HG1  VAL  50          1HG1      VAL  50   1.914  -3.002  -1.195
  410   2HG1  VAL  50          2HG1      VAL  50   0.359  -3.807  -0.984
  411   3HG1  VAL  50          3HG1      VAL  50   1.664  -4.095   0.166
  412   1HG2  VAL  50          1HG2      VAL  50   2.647  -2.283   1.268
  413   2HG2  VAL  50          2HG2      VAL  50   1.314  -2.482   2.404
  414   3HG2  VAL  50          3HG2      VAL  50   1.689  -0.887   1.757
  415    H    LEU  51           H        LEU  51   0.992  -0.182  -2.847
  416    HA   LEU  51           HA       LEU  51  -1.547  -1.077  -3.924
  417   1HB   LEU  51          2HB       LEU  51  -0.609   1.083  -4.621
  418   2HB   LEU  51          1HB       LEU  51   0.792   0.263  -5.281
  419    HG   LEU  51           HG       LEU  51  -1.027  -1.007  -6.712
  420   1HD1  LEU  51          1HD1      LEU  51  -2.793   0.721  -7.345
  421   2HD1  LEU  51          2HD1      LEU  51  -2.407   1.497  -5.809
  422   3HD1  LEU  51          3HD1      LEU  51  -3.019  -0.157  -5.832
  423   1HD2  LEU  51          1HD2      LEU  51   0.663   0.190  -7.807
  424   2HD2  LEU  51          2HD2      LEU  51   0.104   1.735  -7.168
  425   3HD2  LEU  51          3HD2      LEU  51  -0.840   0.896  -8.398
  426    H    ASP  52           H        ASP  52  -1.784  -2.571  -5.587
  427    HA   ASP  52           HA       ASP  52   0.512  -4.257  -6.252
  428   1HB   ASP  52          2HB       ASP  52  -1.150  -5.077  -4.285
  429   2HB   ASP  52          1HB       ASP  52  -2.008  -5.713  -5.686
  430    H    VAL  53           H        VAL  53   0.598  -3.992  -8.388
  431    HA   VAL  53           HA       VAL  53  -1.723  -3.517  -9.988
  432    HB   VAL  53           HB       VAL  53  -0.209  -3.462 -11.884
  433   1HG1  VAL  53          1HG1      VAL  53   0.408  -1.420 -11.278
  434   2HG1  VAL  53          2HG1      VAL  53   1.617  -2.065 -10.168
  435   3HG1  VAL  53          3HG1      VAL  53  -0.041  -1.814  -9.620
  436   1HG2  VAL  53          1HG2      VAL  53   1.374  -5.084 -11.777
  437   2HG2  VAL  53          2HG2      VAL  53   1.571  -4.932 -10.032
  438   3HG2  VAL  53          3HG2      VAL  53   2.332  -3.763 -11.110
  439    H    TRP  54           H        TRP  54  -2.596  -5.700  -8.988
  440    HA   TRP  54           HA       TRP  54  -1.695  -8.124 -10.179
  441   1HB   TRP  54          2HB       TRP  54  -2.907  -8.202  -8.088
  442   2HB   TRP  54          1HB       TRP  54  -4.301  -7.411  -8.814
  443    HD1  TRP  54           HD       TRP  54  -6.171  -9.148  -8.966
  444    HE1  TRP  54           1HE      TRP  54  -6.358 -11.600  -9.723
  445    HE3  TRP  54           3HE      TRP  54  -1.237 -10.079  -9.930
  446    HZ2  TRP  54           2HZ      TRP  54  -4.641 -13.658 -10.610
  447    HZ3  TRP  54           3HZ      TRP  54  -0.594 -12.315 -10.730
  448    HH2  TRP  54           HH       TRP  54  -2.262 -14.067 -11.062
  449    H    MET  55           H        MET  55  -4.985  -6.859 -10.555
  450    HA   MET  55           HA       MET  55  -4.731  -6.739 -13.430
  451   1HB   MET  55          2HB       MET  55  -5.250  -9.180 -12.664
  452   2HB   MET  55          1HB       MET  55  -6.872  -8.560 -12.386
  453   1HG   MET  55          2HG       MET  55  -7.195  -8.072 -14.651
  454   2HG   MET  55          1HG       MET  55  -5.476  -8.208 -15.013
  455   1HE   MET  55          1HE       MET  55  -5.191  -9.865 -16.784
  456   2HE   MET  55          2HE       MET  55  -6.912  -9.689 -17.123
  457   3HE   MET  55          3HE       MET  55  -6.193 -11.296 -17.025
  458    HA   PRO  56           HA       PRO  56  -8.134  -4.117 -11.604
  459   1HB   PRO  56          2HB       PRO  56  -6.685  -1.881 -10.859
  460   2HB   PRO  56          1HB       PRO  56  -7.138  -3.196  -9.776
  461   1HG   PRO  56          2HG       PRO  56  -4.519  -2.468 -10.653
  462   2HG   PRO  56          1HG       PRO  56  -4.976  -3.810  -9.597
  463   1HD   PRO  56          2HD       PRO  56  -4.376  -3.806 -12.498
  464   2HD   PRO  56          1HD       PRO  56  -4.233  -5.118 -11.313
  465    H    ASP  57           H        ASP  57  -8.085  -1.369 -11.995
  466    HA   ASP  57           HA       ASP  57  -7.244  -0.935 -14.757
  467   1HB   ASP  57          2HB       ASP  57  -9.572  -1.797 -14.840
  468   2HB   ASP  57          1HB       ASP  57 -10.079  -0.447 -13.829
  469    H    GLY  58           H        GLY  58  -6.170   0.117 -12.369
  470   1HA   GLY  58          2HA       GLY  58  -7.183   2.870 -12.263
  471   2HA   GLY  58          1HA       GLY  58  -6.087   2.133 -11.105
  472    H    ASP  59           H        ASP  59  -3.870   1.789 -11.749
  473    HA   ASP  59           HA       ASP  59  -1.884   2.528 -12.577
  474   1HB   ASP  59          2HB       ASP  59  -3.650   2.593 -15.003
  475   2HB   ASP  59          1HB       ASP  59  -1.995   3.189 -15.102
  476    H    GLY  60           H        GLY  60  -2.417   4.348 -11.012
  477   1HA   GLY  60          2HA       GLY  60  -2.654   6.901 -12.479
  478   2HA   GLY  60          1HA       GLY  60  -3.154   6.672 -10.810
  479    H    VAL  61           H        VAL  61  -0.486   7.225 -12.961
  480    HA   VAL  61           HA       VAL  61   1.665   6.888 -11.222
  481    HB   VAL  61           HB       VAL  61   1.323   8.819 -13.521
  482   1HG1  VAL  61          1HG1      VAL  61   3.802   7.995 -12.029
  483   2HG1  VAL  61          2HG1      VAL  61   3.108   9.613 -12.136
  484   3HG1  VAL  61          3HG1      VAL  61   3.800   8.853 -13.570
  485   1HG2  VAL  61          1HG2      VAL  61   2.921   6.292 -13.580
  486   2HG2  VAL  61          2HG2      VAL  61   2.201   7.193 -14.915
  487   3HG2  VAL  61          3HG2      VAL  61   1.176   6.249 -13.834
  488    H    ASN  62           H        ASN  62  -0.587   9.542 -11.634
  489    HA   ASN  62           HA       ASN  62   0.890  11.339  -9.935
  490   1HB   ASN  62          2HB       ASN  62  -1.247  11.558 -11.797
  491   2HB   ASN  62          1HB       ASN  62  -1.824  12.180 -10.254
  492   1HD2  ASN  62          1HD2      ASN  62   0.312  12.647 -12.910
  493   2HD2  ASN  62          2HD2      ASN  62   0.885  14.212 -12.455
  494    H    PHE  63           H        PHE  63  -0.870   8.647  -9.230
  495    HA   PHE  63           HA       PHE  63  -2.580   9.442  -7.161
  496   1HB   PHE  63          2HB       PHE  63  -2.519   7.166  -8.210
  497   2HB   PHE  63          1HB       PHE  63  -1.042   6.841  -7.306
  498    HD1  PHE  63           1HD      PHE  63  -4.153   8.573  -6.229
  499    HD2  PHE  63           2HD      PHE  63  -1.610   5.189  -5.778
  500    HE1  PHE  63           1HE      PHE  63  -5.501   7.820  -4.316
  501    HE2  PHE  63           2HE      PHE  63  -2.956   4.430  -3.865
  502    HZ   PHE  63           HZ       PHE  63  -4.903   5.746  -3.130
  503    H    ILE  64           H        ILE  64   0.865   8.714  -7.177
  504    HA   ILE  64           HA       ILE  64   1.467   8.502  -4.521
  505    HB   ILE  64           HB       ILE  64   3.031   9.984  -6.639
  506   1HG1  ILE  64          2HG1      ILE  64   4.344   7.642  -6.085
  507   2HG1  ILE  64          1HG1      ILE  64   2.662   7.159  -5.903
  508   1HG2  ILE  64          1HG2      ILE  64   4.988   9.626  -5.162
  509   2HG2  ILE  64          2HG2      ILE  64   3.893   9.063  -3.898
  510   3HG2  ILE  64          3HG2      ILE  64   3.793  10.726  -4.474
  511   1HD1  ILE  64          1HD1      ILE  64   3.693   8.592  -8.331
  512   2HD1  ILE  64          2HD1      ILE  64   2.161   7.739  -8.134
  513   3HD1  ILE  64          3HD1      ILE  64   3.671   6.835  -8.177
  514    H    ASP  65           H        ASP  65   0.904  11.495  -6.337
  515    HA   ASP  65           HA       ASP  65   1.509  13.259  -4.216
  516   1HB   ASP  65          2HB       ASP  65   0.822  13.538  -6.889
  517   2HB   ASP  65          1HB       ASP  65  -0.556  14.237  -6.044
  518    H    PHE  66           H        PHE  66  -1.507  11.759  -5.301
  519    HA   PHE  66           HA       PHE  66  -3.259  13.050  -3.544
  520   1HB   PHE  66          2HB       PHE  66  -4.187  11.747  -5.320
  521   2HB   PHE  66          1HB       PHE  66  -3.329  10.301  -4.800
  522    HD1  PHE  66           1HD      PHE  66  -4.016   9.178  -2.669
  523    HD2  PHE  66           2HD      PHE  66  -6.314  12.276  -4.470
  524    HE1  PHE  66           1HE      PHE  66  -5.975   8.485  -1.353
  525    HE2  PHE  66           2HE      PHE  66  -8.277  11.588  -3.156
  526    HZ   PHE  66           HZ       PHE  66  -8.109   9.691  -1.595
  527    H    ILE  67           H        ILE  67  -1.067  10.364  -3.111
  528    HA   ILE  67           HA       ILE  67  -2.031   9.450  -0.616
  529    HB   ILE  67           HB       ILE  67   0.872   9.304  -1.366
  530   1HG1  ILE  67          2HG1      ILE  67  -0.112   8.680  -3.428
  531   2HG1  ILE  67          1HG1      ILE  67   0.259   7.169  -2.612
  532   1HG2  ILE  67          1HG2      ILE  67   0.707   8.204   0.595
  533   2HG2  ILE  67          2HG2      ILE  67   0.215   6.876  -0.457
  534   3HG2  ILE  67          3HG2      ILE  67  -1.005   7.841   0.375
  535   1HD1  ILE  67          1HD1      ILE  67  -2.161   7.917  -3.736
  536   2HD1  ILE  67          2HD1      ILE  67  -2.417   8.052  -1.996
  537   3HD1  ILE  67          3HD1      ILE  67  -1.857   6.531  -2.690
  538    H    LYS  68           H        LYS  68   0.703  11.582  -1.441
  539    HA   LYS  68           HA       LYS  68   1.206  12.294   1.283
  540   1HB   LYS  68          2HB       LYS  68   2.106  13.663  -1.261
  541   2HB   LYS  68          1HB       LYS  68   2.767  13.938   0.345
  542   1HG   LYS  68          2HG       LYS  68   3.270  11.396   0.300
  543   2HG   LYS  68          1HG       LYS  68   3.074  11.567  -1.446
  544   1HD   LYS  68          2HD       LYS  68   4.755  13.650  -0.308
  545   2HD   LYS  68          1HD       LYS  68   5.386  12.031   0.002
  546   1HE   LYS  68          2HE       LYS  68   6.342  12.553  -2.039
  547   2HE   LYS  68          1HE       LYS  68   4.915  11.633  -2.512
  548   1HZ   LYS  68          1HZ       LYS  68   3.910  13.453  -3.373
  549   2HZ   LYS  68          2HZ       LYS  68   5.510  13.952  -3.590
  550   3HZ   LYS  68          3HZ       LYS  68   4.616  14.526  -2.273
  551    H    GLU  69           H        GLU  69  -1.061  13.312  -1.049
  552    HA   GLU  69           HA       GLU  69  -1.400  16.009  -0.239
  553   1HB   GLU  69          2HB       GLU  69  -2.183  15.011  -2.408
  554   2HB   GLU  69          1HB       GLU  69  -3.461  14.210  -1.507
  555   1HG   GLU  69          2HG       GLU  69  -4.201  16.481  -0.737
  556   2HG   GLU  69          1HG       GLU  69  -3.056  17.161  -1.892
  557    H    ASN  70           H        ASN  70  -3.020  12.984   0.631
  558    HA   ASN  70           HA       ASN  70  -4.304  14.405   2.871
  559   1HB   ASN  70          2HB       ASN  70  -5.289  11.789   1.756
  560   2HB   ASN  70          1HB       ASN  70  -6.162  12.968   2.732
  561   1HD2  ASN  70          1HD2      ASN  70  -4.581  12.576  -0.407
  562   2HD2  ASN  70          2HD2      ASN  70  -5.667  13.594  -1.280
  563    H    SER  71           H        SER  71  -1.649  12.785   2.459
  564    HA   SER  71           HA       SER  71  -1.632  11.703   5.109
  565   1HB   SER  71          2HB       SER  71  -1.987   9.915   2.786
  566   2HB   SER  71          1HB       SER  71  -0.715   9.436   3.911
  567    HG   SER  71           HG       SER  71  -2.183   9.233   5.507
  568    HA   PRO  72           HA       PRO  72   2.417  13.176   3.296
  569   1HB   PRO  72          2HB       PRO  72   2.478  15.036   5.539
  570   2HB   PRO  72          1HB       PRO  72   2.570  15.378   3.811
  571   1HG   PRO  72          2HG       PRO  72   0.419  16.031   5.327
  572   2HG   PRO  72          1HG       PRO  72   0.299  15.629   3.605
  573   1HD   PRO  72          2HD       PRO  72  -0.303  13.933   5.996
  574   2HD   PRO  72          1HD       PRO  72  -1.182  14.066   4.458
  575    H    ASP  73           H        ASP  73   1.263  12.163   6.347
  576    HA   ASP  73           HA       ASP  73   3.978  11.512   7.257
  577   1HB   ASP  73          2HB       ASP  73   2.245  12.856   8.682
  578   2HB   ASP  73          1HB       ASP  73   1.574  11.261   9.012
  579    H    SER  74           H        SER  74   2.538  10.024   5.227
  580    HA   SER  74           HA       SER  74   2.101   7.466   6.618
  581   1HB   SER  74          2HB       SER  74   0.147   8.280   5.363
  582   2HB   SER  74          1HB       SER  74   1.119   8.358   3.895
  583    HG   SER  74           HG       SER  74  -0.254   6.325   4.712
  584    H    VAL  75           H        VAL  75   2.291   5.899   4.215
  585    HA   VAL  75           HA       VAL  75   4.970   6.358   3.191
  586    HB   VAL  75           HB       VAL  75   4.350   3.767   4.615
  587   1HG1  VAL  75          1HG1      VAL  75   6.820   4.783   3.197
  588   2HG1  VAL  75          2HG1      VAL  75   5.767   3.471   2.667
  589   3HG1  VAL  75          3HG1      VAL  75   6.734   3.290   4.132
  590   1HG2  VAL  75          1HG2      VAL  75   4.738   5.292   6.340
  591   2HG2  VAL  75          2HG2      VAL  75   5.937   6.187   5.408
  592   3HG2  VAL  75          3HG2      VAL  75   6.329   4.591   6.047
  593    H    VAL  76           H        VAL  76   5.251   5.619   1.197
  594    HA   VAL  76           HA       VAL  76   3.081   3.988   0.045
  595    HB   VAL  76           HB       VAL  76   4.883   5.855  -1.487
  596   1HG1  VAL  76          1HG1      VAL  76   3.992   4.413  -3.043
  597   2HG1  VAL  76          2HG1      VAL  76   2.782   5.696  -3.028
  598   3HG1  VAL  76          3HG1      VAL  76   2.491   4.199  -2.143
  599   1HG2  VAL  76          1HG2      VAL  76   2.460   6.398   0.102
  600   2HG2  VAL  76          2HG2      VAL  76   2.501   7.106  -1.512
  601   3HG2  VAL  76          3HG2      VAL  76   3.782   7.471  -0.355
  602    H    ILE  77           H        ILE  77   3.643   1.968  -0.368
  603    HA   ILE  77           HA       ILE  77   6.449   1.360  -0.981
  604    HB   ILE  77           HB       ILE  77   4.223  -0.557  -0.277
  605   1HG1  ILE  77          2HG1      ILE  77   4.787   0.976   1.582
  606   2HG1  ILE  77          1HG1      ILE  77   5.249  -0.687   1.933
  607   1HG2  ILE  77          1HG2      ILE  77   5.644  -2.053  -1.139
  608   2HG2  ILE  77          2HG2      ILE  77   6.614  -1.770   0.305
  609   3HG2  ILE  77          3HG2      ILE  77   6.975  -0.899  -1.184
  610   1HD1  ILE  77          1HD1      ILE  77   7.471   0.553   0.718
  611   2HD1  ILE  77          2HD1      ILE  77   7.295   0.009   2.387
  612   3HD1  ILE  77          3HD1      ILE  77   6.853   1.658   1.947
  613    H    VAL  78           H        VAL  78   3.153   0.669  -2.134
  614    HA   VAL  78           HA       VAL  78   2.363  -0.061  -4.155
  615    HB   VAL  78           HB       VAL  78   4.664   1.620  -5.178
  616   1HG1  VAL  78          1HG1      VAL  78   2.078   0.894  -6.550
  617   2HG1  VAL  78          2HG1      VAL  78   3.627   0.115  -6.865
  618   3HG1  VAL  78          3HG1      VAL  78   3.412   1.829  -7.221
  619   1HG2  VAL  78          1HG2      VAL  78   1.839   2.565  -4.951
  620   2HG2  VAL  78          2HG2      VAL  78   3.337   3.496  -4.996
  621   3HG2  VAL  78          3HG2      VAL  78   2.895   2.606  -3.539
  622    H    ILE  79           H        ILE  79   2.870  -2.265  -3.863
  623    HA   ILE  79           HA       ILE  79   5.369  -3.247  -5.015
  624    HB   ILE  79           HB       ILE  79   3.208  -4.967  -3.823
  625   1HG1  ILE  79          2HG1      ILE  79   5.459  -3.598  -2.338
  626   2HG1  ILE  79          1HG1      ILE  79   3.752  -3.195  -2.196
  627   1HG2  ILE  79          1HG2      ILE  79   5.555  -6.099  -3.155
  628   2HG2  ILE  79          2HG2      ILE  79   6.016  -5.295  -4.656
  629   3HG2  ILE  79          3HG2      ILE  79   4.688  -6.455  -4.649
  630   1HD1  ILE  79          1HD1      ILE  79   3.760  -4.582  -0.457
  631   2HD1  ILE  79          2HD1      ILE  79   5.287  -5.321  -0.937
  632   3HD1  ILE  79          3HD1      ILE  79   3.774  -5.877  -1.653
  633    H    THR  80           H        THR  80   5.270  -5.128  -6.499
  634    HA   THR  80           HA       THR  80   2.840  -5.514  -8.009
  635    HB   THR  80           HB       THR  80   3.740  -4.786 -10.147
  636    HG1  THR  80           1HG      THR  80   6.003  -3.965  -8.650
  637   1HG2  THR  80          1HG2      THR  80   2.576  -3.093  -8.763
  638   2HG2  THR  80          2HG2      THR  80   3.758  -2.416  -9.883
  639   3HG2  THR  80          3HG2      THR  80   4.149  -2.560  -8.169
  640    H    GLY  81           H        GLY  81   3.009  -7.232  -9.576
  641   1HA   GLY  81          2HA       GLY  81   5.446  -8.866  -9.363
  642   2HA   GLY  81          1HA       GLY  81   3.893  -9.586  -8.967
  643    H    HIS  82           H        HIS  82   4.708 -11.070 -10.726
  644    HA   HIS  82           HA       HIS  82   4.423 -11.933 -12.809
  645   1HB   HIS  82          2HB       HIS  82   2.265 -10.080 -12.474
  646   2HB   HIS  82          1HB       HIS  82   2.823 -10.001 -14.142
  647    HD1  HIS  82           1HD      HIS  82   0.540 -11.108 -14.838
  648    HD2  HIS  82           2HD      HIS  82   3.009 -13.492 -12.498
  649    HE1  HIS  82           1HE      HIS  82  -0.380 -13.438 -15.048
  650    HE2  HIS  82           2HE      HIS  82   1.194 -14.879 -13.709
  651    H    GLY  83           H        GLY  83   4.113  -8.508 -13.705
  652   1HA   GLY  83          2HA       GLY  83   6.832  -8.403 -14.683
  653   2HA   GLY  83          1HA       GLY  83   5.616  -8.464 -15.949
  654    H    SER  84           H        SER  84   7.356  -6.477 -13.859
  655    HA   SER  84           HA       SER  84   6.281  -4.106 -14.975
  656   1HB   SER  84          2HB       SER  84   5.225  -5.013 -12.352
  657   2HB   SER  84          1HB       SER  84   5.648  -3.306 -12.486
  658    HG   SER  84           HG       SER  84   3.426  -4.003 -13.111
  659    H    VAL  85           H        VAL  85   8.007  -2.853 -15.135
  660    HA   VAL  85           HA       VAL  85   9.875  -2.705 -12.870
  661    HB   VAL  85           HB       VAL  85  10.771  -2.771 -15.751
  662   1HG1  VAL  85          1HG1      VAL  85  12.882  -2.444 -15.014
  663   2HG1  VAL  85          2HG1      VAL  85  12.616  -3.343 -13.520
  664   3HG1  VAL  85          3HG1      VAL  85  12.054  -1.677 -13.659
  665   1HG2  VAL  85          1HG2      VAL  85  10.199  -4.966 -15.531
  666   2HG2  VAL  85          2HG2      VAL  85  10.369  -4.949 -13.776
  667   3HG2  VAL  85          3HG2      VAL  85  11.802  -5.021 -14.800
  668    H    ASP  86           H        ASP  86   9.037  -1.240 -16.009
  669    HA   ASP  86           HA       ASP  86  10.150   1.295 -15.378
  670   1HB   ASP  86          2HB       ASP  86   8.044   0.622 -17.446
  671   2HB   ASP  86          1HB       ASP  86   9.030   2.080 -17.401
  672    H    THR  87           H        THR  87   7.313  -0.226 -14.327
  673    HA   THR  87           HA       THR  87   5.731   2.164 -14.037
  674    HB   THR  87           HB       THR  87   4.885  -0.280 -14.269
  675    HG1  THR  87           1HG      THR  87   3.601   1.607 -13.752
  676   1HG2  THR  87          1HG2      THR  87   6.125  -1.264 -12.408
  677   2HG2  THR  87          2HG2      THR  87   4.381  -1.419 -12.192
  678   3HG2  THR  87          3HG2      THR  87   5.277  -0.200 -11.286
  679    H    ALA  88           H        ALA  88   7.894   0.229 -12.087
  680    HA   ALA  88           HA       ALA  88   7.378   1.321  -9.566
  681   1HB   ALA  88          1HB       ALA  88  10.102   0.490 -10.532
  682   2HB   ALA  88          2HB       ALA  88   8.837  -0.674 -10.134
  683   3HB   ALA  88          3HB       ALA  88   9.456   0.417  -8.894
  684    H    VAL  89           H        VAL  89   9.954   2.164 -11.854
  685    HA   VAL  89           HA       VAL  89  10.879   4.431 -10.517
  686    HB   VAL  89           HB       VAL  89  11.945   5.072 -12.611
  687   1HG1  VAL  89          1HG1      VAL  89  12.682   3.033 -11.229
  688   2HG1  VAL  89          2HG1      VAL  89  13.345   3.223 -12.853
  689   3HG1  VAL  89          3HG1      VAL  89  12.037   2.076 -12.563
  690   1HG2  VAL  89          1HG2      VAL  89  11.482   3.507 -14.621
  691   2HG2  VAL  89          2HG2      VAL  89  10.358   4.826 -14.289
  692   3HG2  VAL  89          3HG2      VAL  89   9.954   3.180 -13.803
  693    H    LYS  90           H        LYS  90   8.088   3.951 -12.522
  694    HA   LYS  90           HA       LYS  90   7.637   6.804 -12.876
  695   1HB   LYS  90          2HB       LYS  90   7.138   5.093 -14.666
  696   2HB   LYS  90          1HB       LYS  90   5.814   4.535 -13.656
  697   1HG   LYS  90          2HG       LYS  90   4.831   6.802 -13.758
  698   2HG   LYS  90          1HG       LYS  90   6.121   7.274 -14.866
  699   1HD   LYS  90          2HD       LYS  90   4.419   4.887 -15.463
  700   2HD   LYS  90          1HD       LYS  90   3.828   6.511 -15.818
  701   1HE   LYS  90          2HE       LYS  90   4.873   6.218 -17.784
  702   2HE   LYS  90          1HE       LYS  90   6.325   6.624 -16.869
  703   1HZ   LYS  90          1HZ       LYS  90   6.646   4.616 -18.158
  704   2HZ   LYS  90          2HZ       LYS  90   5.322   3.879 -17.404
  705   3HZ   LYS  90          3HZ       LYS  90   6.704   4.258 -16.506
  706    H    ALA  91           H        ALA  91   7.709   5.943 -10.198
  707    HA   ALA  91           HA       ALA  91   5.278   7.031  -9.239
  708   1HB   ALA  91          1HB       ALA  91   4.551   5.001  -7.954
  709   2HB   ALA  91          2HB       ALA  91   5.660   4.057  -8.948
  710   3HB   ALA  91          3HB       ALA  91   4.307   4.907  -9.698
  711    H    ILE  92           H        ILE  92   8.128   5.069  -8.519
  712    HA   ILE  92           HA       ILE  92   8.223   5.828  -5.768
  713    HB   ILE  92           HB       ILE  92  10.167   4.561  -5.568
  714   1HG1  ILE  92          2HG1      ILE  92  10.587   4.991  -8.536
  715   2HG1  ILE  92          1HG1      ILE  92  11.587   5.593  -7.217
  716   1HG2  ILE  92          1HG2      ILE  92   9.438   2.862  -7.768
  717   2HG2  ILE  92          2HG2      ILE  92   7.992   3.521  -7.004
  718   3HG2  ILE  92          3HG2      ILE  92   9.169   2.632  -6.041
  719   1HD1  ILE  92          1HD1      ILE  92  12.880   3.823  -7.570
  720   2HD1  ILE  92          2HD1      ILE  92  11.674   3.054  -8.601
  721   3HD1  ILE  92          3HD1      ILE  92  11.595   2.855  -6.851
  722    H    LYS  93           H        LYS  93   9.903   6.870  -8.700
  723    HA   LYS  93           HA       LYS  93  11.708   8.640  -7.484
  724   1HB   LYS  93          2HB       LYS  93  11.098   7.843 -10.087
  725   2HB   LYS  93          1HB       LYS  93  10.792   9.574 -10.078
  726   1HG   LYS  93          2HG       LYS  93  12.983   9.651 -10.590
  727   2HG   LYS  93          1HG       LYS  93  13.159   9.551  -8.837
  728   1HD   LYS  93          2HD       LYS  93  13.016   7.050 -10.469
  729   2HD   LYS  93          1HD       LYS  93  14.529   7.952 -10.374
  730   1HE   LYS  93          2HE       LYS  93  13.002   7.168  -7.912
  731   2HE   LYS  93          1HE       LYS  93  14.145   6.067  -8.680
  732   1HZ   LYS  93          1HZ       LYS  93  15.923   7.412  -8.163
  733   2HZ   LYS  93          2HZ       LYS  93  14.944   7.621  -6.799
  734   3HZ   LYS  93          3HZ       LYS  93  14.981   8.808  -8.004
  735    H    LYS  94           H        LYS  94   8.318   8.867  -8.017
  736    HA   LYS  94           HA       LYS  94   8.123  11.714  -7.985
  737   1HB   LYS  94          2HB       LYS  94   6.142   9.485  -7.660
  738   2HB   LYS  94          1HB       LYS  94   5.675  11.164  -7.428
  739   1HG   LYS  94          2HG       LYS  94   7.107  10.474  -9.928
  740   2HG   LYS  94          1HG       LYS  94   5.434   9.936  -9.760
  741   1HD   LYS  94          2HD       LYS  94   5.136  12.459  -8.948
  742   2HD   LYS  94          1HD       LYS  94   6.540  12.678  -9.994
  743   1HE   LYS  94          2HE       LYS  94   5.376  12.214 -11.886
  744   2HE   LYS  94          1HE       LYS  94   4.310  11.066 -11.077
  745   1HZ   LYS  94          1HZ       LYS  94   4.065  13.974 -11.325
  746   2HZ   LYS  94          2HZ       LYS  94   3.450  13.241  -9.930
  747   3HZ   LYS  94          3HZ       LYS  94   2.876  12.779 -11.452
  748    H    GLY  95           H        GLY  95   8.276   9.231  -5.547
  749   1HA   GLY  95          2HA       GLY  95   9.046  10.721  -3.441
  750   2HA   GLY  95          1HA       GLY  95   7.312  10.983  -3.448
  751    H    ALA  96           H        ALA  96   7.128   8.076  -4.547
  752    HA   ALA  96           HA       ALA  96   6.348   6.835  -2.219
  753   1HB   ALA  96          1HB       ALA  96   5.799   5.122  -3.544
  754   2HB   ALA  96          2HB       ALA  96   7.447   4.943  -4.150
  755   3HB   ALA  96          3HB       ALA  96   6.366   6.138  -4.869
  756    H    TYR  97           H        TYR  97   7.385   4.607  -1.529
  757    HA   TYR  97           HA       TYR  97  10.069   5.271  -0.583
  758   1HB   TYR  97          2HB       TYR  97   8.362   4.714   1.084
  759   2HB   TYR  97          1HB       TYR  97   8.126   3.145   0.328
  760    HD1  TYR  97           1HD      TYR  97  10.843   5.215   1.851
  761    HD2  TYR  97           2HD      TYR  97   9.250   1.324   1.196
  762    HE1  TYR  97           1HE      TYR  97  12.588   4.262   3.296
  763    HE2  TYR  97           2HE      TYR  97  10.991   0.360   2.639
  764    HH   TYR  97           HH       TYR  97  13.731   1.833   3.450
  765    H    GLU  98           H        GLU  98   9.474   4.233  -3.284
  766    HA   GLU  98           HA       GLU  98  10.622   2.953  -4.782
  767   1HB   GLU  98          2HB       GLU  98  12.684   2.258  -4.233
  768   2HB   GLU  98          1HB       GLU  98  12.362   2.998  -2.675
  769   1HG   GLU  98          2HG       GLU  98  11.401   0.679  -2.042
  770   2HG   GLU  98          1HG       GLU  98  12.310   0.112  -3.441
  771    H    PHE  99           H        PHE  99  10.308   0.982  -5.777
  772    HA   PHE  99           HA       PHE  99   8.037  -0.476  -4.952
  773   1HB   PHE  99          2HB       PHE  99   9.871  -0.449  -7.219
  774   2HB   PHE  99          1HB       PHE  99   9.325  -2.072  -6.820
  775    HD1  PHE  99           1HD      PHE  99   7.915  -2.535  -8.633
  776    HD2  PHE  99           2HD      PHE  99   7.410   1.071  -6.430
  777    HE1  PHE  99           1HE      PHE  99   5.805  -2.106  -9.826
  778    HE2  PHE  99           2HE      PHE  99   5.300   1.505  -7.619
  779    HZ   PHE  99           HZ       PHE  99   4.493  -0.085  -9.317
  780    H    LEU 100           H        LEU 100   7.811  -2.428  -3.954
  781    HA   LEU 100           HA       LEU 100   9.903  -3.327  -2.272
  782   1HB   LEU 100          2HB       LEU 100   7.368  -3.453  -1.913
  783   2HB   LEU 100          1HB       LEU 100   7.409  -4.868  -2.949
  784    HG   LEU 100           HG       LEU 100   7.402  -5.457  -0.565
  785   1HD1  LEU 100          1HD1      LEU 100   8.741  -7.235  -0.890
  786   2HD1  LEU 100          2HD1      LEU 100  10.119  -6.248  -1.374
  787   3HD1  LEU 100          3HD1      LEU 100   8.832  -6.595  -2.531
  788   1HD2  LEU 100          1HD2      LEU 100  10.160  -4.275  -0.396
  789   2HD2  LEU 100          2HD2      LEU 100   9.146  -4.890   0.910
  790   3HD2  LEU 100          3HD2      LEU 100   8.719  -3.384   0.096
  791    H    GLU 101           H        GLU 101  11.276  -5.034  -2.463
  792    HA   GLU 101           HA       GLU 101  12.150  -5.906  -4.916
  793   1HB   GLU 101          2HB       GLU 101  12.321  -7.361  -2.272
  794   2HB   GLU 101          1HB       GLU 101  13.275  -7.751  -3.697
  795   1HG   GLU 101          2HG       GLU 101  14.798  -6.414  -2.758
  796   2HG   GLU 101          1HG       GLU 101  13.816  -5.116  -3.434
  797    H    LYS 102           H        LYS 102  11.363  -7.206  -6.421
  798    HA   LYS 102           HA       LYS 102   8.898  -8.484  -6.256
  799   1HB   LYS 102          2HB       LYS 102  11.215  -8.982  -8.128
  800   2HB   LYS 102          1HB       LYS 102   9.617  -9.683  -8.339
  801   1HG   LYS 102          2HG       LYS 102   9.040  -7.883  -9.486
  802   2HG   LYS 102          1HG       LYS 102   9.201  -6.936  -8.005
  803   1HD   LYS 102          2HD       LYS 102  11.369  -6.260  -8.528
  804   2HD   LYS 102          1HD       LYS 102  11.599  -7.569  -9.689
  805   1HE   LYS 102          2HE       LYS 102  11.321  -5.658 -11.009
  806   2HE   LYS 102          1HE       LYS 102   9.748  -6.452 -11.047
  807   1HZ   LYS 102          1HZ       LYS 102  10.319  -4.351  -9.059
  808   2HZ   LYS 102          2HZ       LYS 102   8.823  -4.870  -9.656
  809   3HZ   LYS 102          3HZ       LYS 102   9.846  -3.939 -10.630
  810    HA   PRO 103           HA       PRO 103  11.329 -12.700  -5.725
  811   1HB   PRO 103          2HB       PRO 103  13.768 -12.364  -4.462
  812   2HB   PRO 103          1HB       PRO 103  13.556 -12.625  -6.195
  813   1HG   PRO 103          2HG       PRO 103  13.982 -10.076  -4.700
  814   2HG   PRO 103          1HG       PRO 103  14.647 -10.586  -6.262
  815   1HD   PRO 103          2HD       PRO 103  12.612  -8.852  -6.107
  816   2HD   PRO 103          1HD       PRO 103  12.699 -10.061  -7.404
  817    H    PHE 104           H        PHE 104  12.196 -13.809  -3.592
  818    HA   PHE 104           HA       PHE 104  11.810 -14.278  -1.401
  819   1HB   PHE 104          2HB       PHE 104  11.977 -11.271  -1.269
  820   2HB   PHE 104          1HB       PHE 104  11.694 -12.249   0.166
  821    HD1  PHE 104           1HD      PHE 104  14.137 -10.719  -1.801
  822    HD2  PHE 104           2HD      PHE 104  13.407 -14.240   0.475
  823    HE1  PHE 104           1HE      PHE 104  16.561 -11.066  -1.567
  824    HE2  PHE 104           2HE      PHE 104  15.831 -14.593   0.713
  825    HZ   PHE 104           HZ       PHE 104  17.411 -13.005  -0.309
  826    H    SER 105           H        SER 105  10.099 -14.598   0.039
  827    HA   SER 105           HA       SER 105   7.501 -14.185  -1.073
  828   1HB   SER 105          2HB       SER 105   7.985 -16.226   0.160
  829   2HB   SER 105          1HB       SER 105   8.355 -15.294   1.612
  830    HG   SER 105           HG       SER 105   6.281 -14.995   1.968
  831    H    VAL 106           H        VAL 106   5.688 -13.391   0.437
  832    HA   VAL 106           HA       VAL 106   5.969 -10.654   0.846
  833    HB   VAL 106           HB       VAL 106   3.792 -11.743   0.580
  834   1HG1  VAL 106          1HG1      VAL 106   4.550 -13.033   3.152
  835   2HG1  VAL 106          2HG1      VAL 106   3.759 -13.717   1.733
  836   3HG1  VAL 106          3HG1      VAL 106   2.848 -12.691   2.841
  837   1HG2  VAL 106          1HG2      VAL 106   3.573 -10.474   3.257
  838   2HG2  VAL 106          2HG2      VAL 106   2.639 -10.191   1.788
  839   3HG2  VAL 106          3HG2      VAL 106   4.265  -9.525   1.943
  840    H    GLU 107           H        GLU 107   6.570 -13.331   3.051
  841    HA   GLU 107           HA       GLU 107   6.559 -12.160   5.504
  842   1HB   GLU 107          2HB       GLU 107   7.258 -14.538   4.810
  843   2HB   GLU 107          1HB       GLU 107   8.879 -13.871   4.666
  844   1HG   GLU 107          2HG       GLU 107   8.094 -12.989   7.131
  845   2HG   GLU 107          1HG       GLU 107   7.343 -14.581   7.035
  846    H    ARG 108           H        ARG 108   8.951 -11.737   2.965
  847    HA   ARG 108           HA       ARG 108  10.840 -10.285   4.510
  848   1HB   ARG 108          2HB       ARG 108  11.106 -11.405   2.176
  849   2HB   ARG 108          1HB       ARG 108  10.461  -9.893   1.554
  850   1HG   ARG 108          2HG       ARG 108  12.615  -9.289   1.477
  851   2HG   ARG 108          1HG       ARG 108  12.396  -8.969   3.198
  852   1HD   ARG 108          2HD       ARG 108  13.090 -11.741   2.441
  853   2HD   ARG 108          1HD       ARG 108  14.350 -10.527   2.225
  854    HE   ARG 108           HE       ARG 108  13.259 -10.200   4.774
  855   1HH1  ARG 108          1HH1      ARG 108  15.132 -12.543   2.992
  856   2HH1  ARG 108          2HH1      ARG 108  15.941 -13.151   4.397
  857   1HH2  ARG 108          1HH2      ARG 108  14.322 -10.997   6.623
  858   2HH2  ARG 108          2HH2      ARG 108  15.481 -12.274   6.459
  859    H    PHE 109           H        PHE 109   8.094  -9.390   2.496
  860    HA   PHE 109           HA       PHE 109   8.390  -6.613   2.514
  861   1HB   PHE 109          2HB       PHE 109   6.780  -7.457   1.022
  862   2HB   PHE 109          1HB       PHE 109   6.021  -8.454   2.255
  863    HD1  PHE 109           1HD      PHE 109   6.590  -4.887   1.356
  864    HD2  PHE 109           2HD      PHE 109   4.076  -7.740   3.267
  865    HE1  PHE 109           1HE      PHE 109   4.899  -3.140   1.730
  866    HE2  PHE 109           2HE      PHE 109   2.381  -5.999   3.644
  867    HZ   PHE 109           HZ       PHE 109   2.792  -3.696   2.877
  868    H    LEU 110           H        LEU 110   7.316  -8.825   4.957
  869    HA   LEU 110           HA       LEU 110   5.872  -7.122   6.634
  870   1HB   LEU 110          2HB       LEU 110   6.520  -9.729   6.669
  871   2HB   LEU 110          1HB       LEU 110   7.589  -9.129   7.919
  872    HG   LEU 110           HG       LEU 110   4.631  -8.578   7.929
  873   1HD1  LEU 110          1HD1      LEU 110   4.494 -10.405   9.605
  874   2HD1  LEU 110          2HD1      LEU 110   6.141 -10.865   9.174
  875   3HD1  LEU 110          3HD1      LEU 110   4.855 -10.960   7.971
  876   1HD2  LEU 110          1HD2      LEU 110   6.828  -7.675   9.487
  877   2HD2  LEU 110          2HD2      LEU 110   5.831  -8.719  10.500
  878   3HD2  LEU 110          3HD2      LEU 110   5.112  -7.325   9.694
  879    H    LEU 111           H        LEU 111   9.323  -7.923   6.622
  880    HA   LEU 111           HA       LEU 111  10.156  -6.521   8.841
  881   1HB   LEU 111          2HB       LEU 111  11.544  -7.026   6.224
  882   2HB   LEU 111          1HB       LEU 111  12.342  -6.259   7.584
  883    HG   LEU 111           HG       LEU 111  11.583  -8.394   8.887
  884   1HD1  LEU 111          1HD1      LEU 111  11.005  -9.064   6.084
  885   2HD1  LEU 111          2HD1      LEU 111  10.349  -9.739   7.576
  886   3HD1  LEU 111          3HD1      LEU 111  11.920 -10.276   6.981
  887   1HD2  LEU 111          1HD2      LEU 111  13.926  -7.555   7.887
  888   2HD2  LEU 111          2HD2      LEU 111  13.737  -9.056   6.981
  889   3HD2  LEU 111          3HD2      LEU 111  13.729  -9.085   8.744
  890    H    THR 112           H        THR 112  10.015  -5.307   5.493
  891    HA   THR 112           HA       THR 112  10.866  -2.708   6.018
  892    HB   THR 112           HB       THR 112   8.922  -3.657   3.904
  893    HG1  THR 112           1HG      THR 112  11.742  -3.360   3.861
  894   1HG2  THR 112          1HG2      THR 112   9.677  -1.757   2.586
  895   2HG2  THR 112          2HG2      THR 112  10.639  -1.186   3.949
  896   3HG2  THR 112          3HG2      THR 112   8.880  -1.235   4.069
  897    H    ILE 113           H        ILE 113   7.574  -4.037   5.974
  898    HA   ILE 113           HA       ILE 113   6.055  -1.802   6.301
  899    HB   ILE 113           HB       ILE 113   5.762  -4.592   7.298
  900   1HG1  ILE 113          2HG1      ILE 113   5.155  -3.988   4.997
  901   2HG1  ILE 113          1HG1      ILE 113   3.744  -4.512   5.910
  902   1HG2  ILE 113          1HG2      ILE 113   4.201  -2.259   8.326
  903   2HG2  ILE 113          2HG2      ILE 113   4.839  -3.652   9.199
  904   3HG2  ILE 113          3HG2      ILE 113   3.432  -3.837   8.151
  905   1HD1  ILE 113          1HD1      ILE 113   4.492  -1.741   5.056
  906   2HD1  ILE 113          2HD1      ILE 113   3.297  -2.044   6.318
  907   3HD1  ILE 113          3HD1      ILE 113   3.031  -2.657   4.686
  908    H    LYS 114           H        LYS 114   7.442  -3.657   9.030
  909    HA   LYS 114           HA       LYS 114   6.623  -2.052  11.101
  910   1HB   LYS 114          2HB       LYS 114   8.019  -4.225  11.140
  911   2HB   LYS 114          1HB       LYS 114   9.411  -3.160  11.022
  912   1HG   LYS 114          2HG       LYS 114   7.370  -2.694  13.146
  913   2HG   LYS 114          1HG       LYS 114   8.574  -3.968  13.345
  914   1HD   LYS 114          2HD       LYS 114   9.262  -1.105  12.702
  915   2HD   LYS 114          1HD       LYS 114   9.195  -1.749  14.343
  916   1HE   LYS 114          2HE       LYS 114  10.826  -3.225  12.354
  917   2HE   LYS 114          1HE       LYS 114  11.446  -1.678  12.926
  918   1HZ   LYS 114          1HZ       LYS 114  11.085  -2.560  15.229
  919   2HZ   LYS 114          2HZ       LYS 114  12.306  -3.331  14.348
  920   3HZ   LYS 114          3HZ       LYS 114  10.799  -4.078  14.539
  921    H    HIS 115           H        HIS 115   9.788  -1.852   9.509
  922    HA   HIS 115           HA       HIS 115  10.667   0.522  10.569
  923   1HB   HIS 115          2HB       HIS 115  11.116  -0.281   7.692
  924   2HB   HIS 115          1HB       HIS 115  12.177   0.682   8.715
  925    HD1  HIS 115           1HD      HIS 115  12.266  -1.139  11.201
  926    HD2  HIS 115           2HD      HIS 115  12.657  -2.492   7.292
  927    HE1  HIS 115           1HE      HIS 115  13.499  -3.323  11.366
  928    HE2  HIS 115           2HE      HIS 115  13.820  -4.067   8.981
  929    H    ALA 116           H        ALA 116   8.209   0.023   8.142
  930    HA   ALA 116           HA       ALA 116   8.187   2.657   7.084
  931   1HB   ALA 116          1HB       ALA 116   5.739   0.940   7.202
  932   2HB   ALA 116          2HB       ALA 116   7.097   0.490   6.172
  933   3HB   ALA 116          3HB       ALA 116   6.278   2.033   5.928
  934    H    PHE 117           H        PHE 117   6.802   1.178   9.919
  935    HA   PHE 117           HA       PHE 117   5.098   3.456  10.488
  936   1HB   PHE 117          2HB       PHE 117   5.570   0.796  11.805
  937   2HB   PHE 117          1HB       PHE 117   4.655   2.064  12.614
  938    HD1  PHE 117           1HD      PHE 117   2.492   2.745  11.801
  939    HD2  PHE 117           2HD      PHE 117   4.675  -0.357   9.876
  940    HE1  PHE 117           1HE      PHE 117   0.451   2.056  10.617
  941    HE2  PHE 117           2HE      PHE 117   2.637  -1.053   8.684
  942    HZ   PHE 117           HZ       PHE 117   0.522   0.158   9.056
  943    H    GLU 118           H        GLU 118   8.215   2.213  11.424
  944    HA   GLU 118           HA       GLU 118   8.366   4.076  13.674
  945   1HB   GLU 118          2HB       GLU 118  10.174   1.835  12.792
  946   2HB   GLU 118          1HB       GLU 118  10.546   2.914  14.129
  947   1HG   GLU 118          2HG       GLU 118   7.895   1.750  14.342
  948   2HG   GLU 118          1HG       GLU 118   9.171   0.535  14.280
  949    H    GLU 119           H        GLU 119  10.007   3.356  10.618
  950    HA   GLU 119           HA       GLU 119  11.754   5.659  10.965
  951   1HB   GLU 119          2HB       GLU 119  11.596   3.700   8.670
  952   2HB   GLU 119          1HB       GLU 119  12.857   4.898   8.932
  953   1HG   GLU 119          2HG       GLU 119  13.075   3.618  11.239
  954   2HG   GLU 119          1HG       GLU 119  12.385   2.305  10.284
  955    H    TYR 120           H        TYR 120   8.826   5.991  10.548
  956    HA   TYR 120           HA       TYR 120   9.000   8.091   8.610
  957   1HB   TYR 120          2HB       TYR 120   8.440   5.695   7.491
  958   2HB   TYR 120          1HB       TYR 120   6.814   6.227   7.907
  959    HD1  TYR 120           1HD      TYR 120   6.848   9.073   7.421
  960    HD2  TYR 120           2HD      TYR 120   8.727   5.960   5.213
  961    HE1  TYR 120           1HE      TYR 120   6.794  10.479   5.405
  962    HE2  TYR 120           2HE      TYR 120   8.679   7.357   3.190
  963    HH   TYR 120           HH       TYR 120   8.398  10.451   3.098
  964    H    SER 121           H        SER 121   8.415   7.981  11.364
  965    HA   SER 121           HA       SER 121   5.528   8.442  11.524
  966   1HB   SER 121          2HB       SER 121   7.064   7.058  13.219
  967   2HB   SER 121          1HB       SER 121   7.260   8.657  13.937
  968    HG   SER 121           HG       SER 121   5.076   7.000  13.907
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1   0.502   2.498  17.344
    2   2H    MET   1          2HT       MET   1  -0.861   1.456  17.261
    3   3H    MET   1          3HT       MET   1  -0.910   2.860  18.248
    4    HA   MET   1           HA       MET   1  -2.145   3.141  16.227
    5   1HB   MET   1          2HB       MET   1   0.378   4.741  16.652
    6   2HB   MET   1          1HB       MET   1  -0.857   5.222  15.497
    7   1HG   MET   1          2HG       MET   1  -1.356   4.800  18.432
    8   2HG   MET   1          1HG       MET   1  -1.007   6.361  17.693
    9   1HE   MET   1          1HE       MET   1  -3.675   7.825  17.810
   10   2HE   MET   1          2HE       MET   1  -2.925   6.901  19.112
   11   3HE   MET   1          3HE       MET   1  -4.626   6.651  18.720
   12    H    LYS   2           H        LYS   2  -1.709   1.091  15.021
   13    HA   LYS   2           HA       LYS   2  -0.132   1.705  12.628
   14   1HB   LYS   2          2HB       LYS   2  -0.069  -0.984  14.005
   15   2HB   LYS   2          1HB       LYS   2   0.820  -0.521  12.559
   16   1HG   LYS   2          2HG       LYS   2   1.225   0.949  15.132
   17   2HG   LYS   2          1HG       LYS   2   2.049  -0.580  14.820
   18   1HD   LYS   2          2HD       LYS   2   3.414   0.323  13.257
   19   2HD   LYS   2          1HD       LYS   2   2.173   1.424  12.657
   20   1HE   LYS   2          2HE       LYS   2   2.912   2.121  15.347
   21   2HE   LYS   2          1HE       LYS   2   4.346   2.029  14.325
   22   1HZ   LYS   2          1HZ       LYS   2   3.385   3.588  12.811
   23   2HZ   LYS   2          2HZ       LYS   2   3.290   4.246  14.367
   24   3HZ   LYS   2          3HZ       LYS   2   1.912   3.586  13.644
   25    H    ARG   3           H        ARG   3  -1.014   1.014  10.730
   26    HA   ARG   3           HA       ARG   3  -2.940  -1.006  10.453
   27   1HB   ARG   3          2HB       ARG   3  -4.911   0.457   9.946
   28   2HB   ARG   3          1HB       ARG   3  -4.452   0.386  11.640
   29   1HG   ARG   3          2HG       ARG   3  -3.320   2.547   9.994
   30   2HG   ARG   3          1HG       ARG   3  -5.021   2.639  10.446
   31   1HD   ARG   3          2HD       ARG   3  -3.795   1.928  12.799
   32   2HD   ARG   3          1HD       ARG   3  -2.623   3.022  12.065
   33    HE   ARG   3           HE       ARG   3  -4.076   4.766  12.401
   34   1HH1  ARG   3          1HH1      ARG   3  -5.761   1.753  12.914
   35   2HH1  ARG   3          2HH1      ARG   3  -7.170   2.510  13.576
   36   1HH2  ARG   3          1HH2      ARG   3  -5.930   5.762  13.271
   37   2HH2  ARG   3          2HH2      ARG   3  -7.266   4.785  13.778
   38    H    VAL   4           H        VAL   4  -1.719  -1.545   8.669
   39    HA   VAL   4           HA       VAL   4  -1.106   0.358   6.613
   40    HB   VAL   4           HB       VAL   4  -0.920  -2.648   6.422
   41   1HG1  VAL   4          1HG1      VAL   4   0.181  -0.358   4.857
   42   2HG1  VAL   4          2HG1      VAL   4  -0.550  -1.859   4.291
   43   3HG1  VAL   4          3HG1      VAL   4   1.086  -1.867   4.950
   44   1HG2  VAL   4          1HG2      VAL   4   1.168  -0.720   7.443
   45   2HG2  VAL   4          2HG2      VAL   4   1.367  -2.459   7.228
   46   3HG2  VAL   4          3HG2      VAL   4   0.242  -1.844   8.439
   47    H    LEU   5           H        LEU   5  -1.741   0.081   4.350
   48    HA   LEU   5           HA       LEU   5  -4.506  -0.907   4.101
   49   1HB   LEU   5          2HB       LEU   5  -4.340   1.540   3.962
   50   2HB   LEU   5          1HB       LEU   5  -3.189   1.390   2.648
   51    HG   LEU   5           HG       LEU   5  -4.943   0.322   1.264
   52   1HD1  LEU   5          1HD1      LEU   5  -6.888  -0.361   2.090
   53   2HD1  LEU   5          2HD1      LEU   5  -7.194   1.203   2.841
   54   3HD1  LEU   5          3HD1      LEU   5  -6.248  -0.015   3.695
   55   1HD2  LEU   5          1HD2      LEU   5  -6.480   2.519   1.398
   56   2HD2  LEU   5          2HD2      LEU   5  -4.884   2.494   0.648
   57   3HD2  LEU   5          3HD2      LEU   5  -5.072   3.081   2.301
   58    H    VAL   6           H        VAL   6  -4.969  -2.300   2.471
   59    HA   VAL   6           HA       VAL   6  -2.767  -2.945   0.616
   60    HB   VAL   6           HB       VAL   6  -4.944  -4.851   1.461
   61   1HG1  VAL   6          1HG1      VAL   6  -4.065  -5.684  -0.501
   62   2HG1  VAL   6          2HG1      VAL   6  -3.041  -6.465   0.704
   63   3HG1  VAL   6          3HG1      VAL   6  -2.452  -5.052  -0.173
   64   1HG2  VAL   6          1HG2      VAL   6  -3.449  -5.827   3.041
   65   2HG2  VAL   6          2HG2      VAL   6  -3.530  -4.098   3.385
   66   3HG2  VAL   6          3HG2      VAL   6  -2.134  -4.766   2.538
   67    H    VAL   7           H        VAL   7  -3.432  -1.568  -1.043
   68    HA   VAL   7           HA       VAL   7  -6.119  -1.859  -2.123
   69    HB   VAL   7           HB       VAL   7  -3.870  -0.196  -3.261
   70   1HG1  VAL   7          1HG1      VAL   7  -6.779  -0.470  -3.771
   71   2HG1  VAL   7          2HG1      VAL   7  -5.454  -0.167  -4.894
   72   3HG1  VAL   7          3HG1      VAL   7  -6.075   1.142  -3.888
   73   1HG2  VAL   7          1HG2      VAL   7  -5.832   0.444  -1.075
   74   2HG2  VAL   7          2HG2      VAL   7  -5.058   1.699  -2.043
   75   3HG2  VAL   7          3HG2      VAL   7  -4.076   0.612  -1.062
   76    H    ASP   8           H        ASP   8  -6.594  -3.334  -3.634
   77    HA   ASP   8           HA       ASP   8  -4.728  -3.932  -5.752
   78   1HB   ASP   8          2HB       ASP   8  -3.841  -5.463  -4.143
   79   2HB   ASP   8          1HB       ASP   8  -5.447  -6.004  -3.671
   80    H    ASP   9           H        ASP   9  -5.726  -4.709  -7.569
   81    HA   ASP   9           HA       ASP   9  -8.634  -4.674  -7.519
   82   1HB   ASP   9          2HB       ASP   9  -7.441  -3.390  -9.249
   83   2HB   ASP   9          1HB       ASP   9  -6.721  -4.876  -9.857
   84    H    GLU  10           H        GLU  10  -7.814  -6.848  -6.164
   85    HA   GLU  10           HA       GLU  10  -9.091  -8.970  -7.478
   86   1HB   GLU  10          2HB       GLU  10  -6.946  -8.950  -8.776
   87   2HB   GLU  10          1HB       GLU  10  -6.097  -9.330  -7.284
   88   1HG   GLU  10          2HG       GLU  10  -6.500 -11.297  -8.711
   89   2HG   GLU  10          1HG       GLU  10  -7.226 -11.437  -7.111
   90    H    GLU  11           H        GLU  11  -8.959 -11.020  -6.219
   91    HA   GLU  11           HA       GLU  11  -8.514 -10.403  -3.378
   92   1HB   GLU  11          2HB       GLU  11 -10.492 -12.113  -4.823
   93   2HB   GLU  11          1HB       GLU  11 -10.033 -12.555  -3.184
   94   1HG   GLU  11          2HG       GLU  11 -10.612  -9.765  -3.263
   95   2HG   GLU  11          1HG       GLU  11 -11.936 -10.652  -4.017
   96    H    SER  12           H        SER  12  -6.282 -11.097  -4.848
   97    HA   SER  12           HA       SER  12  -5.805 -13.932  -4.337
   98   1HB   SER  12          2HB       SER  12  -3.459 -13.035  -5.374
   99   2HB   SER  12          1HB       SER  12  -4.810 -13.607  -6.352
  100    HG   SER  12           HG       SER  12  -5.101 -11.651  -7.056
  101    H    ILE  13           H        ILE  13  -3.383 -11.369  -4.071
  102    HA   ILE  13           HA       ILE  13  -2.088 -12.441  -1.873
  103    HB   ILE  13           HB       ILE  13  -2.222  -9.520  -2.635
  104   1HG1  ILE  13          2HG1      ILE  13  -1.521 -10.869  -4.530
  105   2HG1  ILE  13          1HG1      ILE  13  -0.131 -10.002  -3.884
  106   1HG2  ILE  13          1HG2      ILE  13   0.284 -10.405  -1.533
  107   2HG2  ILE  13          2HG2      ILE  13  -1.037 -10.736  -0.413
  108   3HG2  ILE  13          3HG2      ILE  13  -0.775  -9.096  -1.006
  109   1HD1  ILE  13          1HD1      ILE  13  -0.642 -12.871  -4.068
  110   2HD1  ILE  13          2HD1      ILE  13   0.008 -12.344  -2.517
  111   3HD1  ILE  13          3HD1      ILE  13   0.882 -11.985  -4.006
  112    H    THR  14           H        THR  14  -4.703 -10.066  -1.980
  113    HA   THR  14           HA       THR  14  -4.802  -9.127   0.569
  114    HB   THR  14           HB       THR  14  -7.303  -9.072   0.302
  115    HG1  THR  14           1HG      THR  14  -6.724 -10.333  -2.170
  116   1HG2  THR  14          1HG2      THR  14  -5.586  -7.448  -0.828
  117   2HG2  THR  14          2HG2      THR  14  -7.304  -7.380  -1.222
  118   3HG2  THR  14          3HG2      THR  14  -6.182  -8.204  -2.306
  119    H    SER  15           H        SER  15  -6.137 -12.234  -0.529
  120    HA   SER  15           HA       SER  15  -7.143 -13.000   2.004
  121   1HB   SER  15          2HB       SER  15  -7.495 -13.947  -0.494
  122   2HB   SER  15          1HB       SER  15  -6.334 -15.130   0.106
  123    HG   SER  15           HG       SER  15  -8.916 -15.066   0.557
  124    H    SER  16           H        SER  16  -3.990 -13.188   0.554
  125    HA   SER  16           HA       SER  16  -3.038 -15.062   2.577
  126   1HB   SER  16          2HB       SER  16  -2.226 -15.476   0.350
  127   2HB   SER  16          1HB       SER  16  -1.688 -13.806   0.181
  128    HG   SER  16           HG       SER  16   0.097 -14.989   0.707
  129    H    LEU  17           H        LEU  17  -1.712 -12.015   1.288
  130    HA   LEU  17           HA       LEU  17  -0.006 -11.368   3.315
  131   1HB   LEU  17          2HB       LEU  17   0.045 -10.024   1.394
  132   2HB   LEU  17          1HB       LEU  17  -1.667  -9.668   1.483
  133    HG   LEU  17           HG       LEU  17   0.014  -7.801   2.051
  134   1HD1  LEU  17          1HD1      LEU  17  -1.651  -6.731   3.126
  135   2HD1  LEU  17          2HD1      LEU  17  -1.894  -8.037   4.286
  136   3HD1  LEU  17          3HD1      LEU  17  -2.572  -8.162   2.662
  137   1HD2  LEU  17          1HD2      LEU  17   1.038  -7.758   4.119
  138   2HD2  LEU  17          2HD2      LEU  17   1.209  -9.455   3.669
  139   3HD2  LEU  17          3HD2      LEU  17  -0.049  -8.964   4.799
  140    H    SER  18           H        SER  18  -3.382 -10.201   3.108
  141    HA   SER  18           HA       SER  18  -3.592  -8.775   5.388
  142   1HB   SER  18          2HB       SER  18  -5.455  -9.215   3.778
  143   2HB   SER  18          1HB       SER  18  -5.679 -10.793   4.530
  144    HG   SER  18           HG       SER  18  -5.822  -8.326   5.923
  145    H    ALA  19           H        ALA  19  -3.993 -12.319   5.240
  146    HA   ALA  19           HA       ALA  19  -4.425 -12.777   7.951
  147   1HB   ALA  19          1HB       ALA  19  -4.300 -14.361   5.780
  148   2HB   ALA  19          2HB       ALA  19  -4.272 -14.972   7.434
  149   3HB   ALA  19          3HB       ALA  19  -2.763 -14.767   6.544
  150    H    ILE  20           H        ILE  20  -1.440 -12.377   6.150
  151    HA   ILE  20           HA       ILE  20   0.343 -13.041   8.257
  152    HB   ILE  20           HB       ILE  20   0.750 -11.404   5.753
  153   1HG1  ILE  20          2HG1      ILE  20   2.078 -13.997   6.056
  154   2HG1  ILE  20          1HG1      ILE  20   0.319 -14.080   5.991
  155   1HG2  ILE  20          1HG2      ILE  20   3.228 -12.136   6.343
  156   2HG2  ILE  20          2HG2      ILE  20   2.585 -12.054   7.984
  157   3HG2  ILE  20          3HG2      ILE  20   2.524 -10.633   6.939
  158   1HD1  ILE  20          1HD1      ILE  20   1.755 -12.441   3.970
  159   2HD1  ILE  20          2HD1      ILE  20   0.229 -13.314   3.841
  160   3HD1  ILE  20          3HD1      ILE  20   1.755 -14.197   3.812
  161    H    LEU  21           H        LEU  21  -0.052  -9.859   6.734
  162    HA   LEU  21           HA       LEU  21   1.114  -8.340   8.719
  163   1HB   LEU  21          2HB       LEU  21   0.668  -6.691   7.300
  164   2HB   LEU  21          1HB       LEU  21  -0.052  -7.899   6.278
  165    HG   LEU  21           HG       LEU  21  -1.480  -5.992   6.462
  166   1HD1  LEU  21          1HD1      LEU  21  -2.180  -8.568   6.673
  167   2HD1  LEU  21          2HD1      LEU  21  -3.342  -7.247   6.574
  168   3HD1  LEU  21          3HD1      LEU  21  -2.919  -7.934   8.139
  169   1HD2  LEU  21          1HD2      LEU  21  -2.117  -6.385   9.291
  170   2HD2  LEU  21          2HD2      LEU  21  -1.876  -4.898   8.377
  171   3HD2  LEU  21          3HD2      LEU  21  -0.487  -5.789   8.993
  172    H    GLU  22           H        GLU  22  -1.983  -9.869   8.734
  173    HA   GLU  22           HA       GLU  22  -3.063  -8.250  10.854
  174   1HB   GLU  22          2HB       GLU  22  -3.939 -10.726   9.437
  175   2HB   GLU  22          1HB       GLU  22  -4.681 -10.304  10.971
  176   1HG   GLU  22          2HG       GLU  22  -5.245  -8.077  10.007
  177   2HG   GLU  22          1HG       GLU  22  -4.669  -8.668   8.450
  178    H    GLU  23           H        GLU  23  -1.193 -11.186  10.572
  179    HA   GLU  23           HA       GLU  23  -1.610 -12.034  13.276
  180   1HB   GLU  23          2HB       GLU  23  -1.072 -13.741  11.719
  181   2HB   GLU  23          1HB       GLU  23   0.300 -12.841  11.087
  182   1HG   GLU  23          2HG       GLU  23   1.678 -13.724  12.573
  183   2HG   GLU  23          1HG       GLU  23   0.587 -13.366  13.910
  184    H    GLU  24           H        GLU  24   0.798 -10.182  11.502
  185    HA   GLU  24           HA       GLU  24   2.758 -10.007  13.481
  186   1HB   GLU  24          2HB       GLU  24   1.990  -8.218  11.202
  187   2HB   GLU  24          1HB       GLU  24   3.289  -7.776  12.302
  188   1HG   GLU  24          2HG       GLU  24   3.204 -10.362  10.773
  189   2HG   GLU  24          1HG       GLU  24   4.016  -8.906  10.204
  190    H    GLY  25           H        GLY  25  -0.362  -8.597  13.348
  191   1HA   GLY  25          2HA       GLY  25  -1.377  -7.601  15.245
  192   2HA   GLY  25          1HA       GLY  25   0.217  -7.119  15.801
  193    H    TYR  26           H        TYR  26  -2.123  -6.530  13.203
  194    HA   TYR  26           HA       TYR  26  -1.536  -3.672  13.369
  195   1HB   TYR  26          2HB       TYR  26  -1.263  -5.355  10.887
  196   2HB   TYR  26          1HB       TYR  26  -1.484  -3.616  10.819
  197    HD1  TYR  26           1HD      TYR  26   0.888  -5.938  10.346
  198    HD2  TYR  26           2HD      TYR  26   0.240  -2.506  12.768
  199    HE1  TYR  26           1HE      TYR  26   3.316  -5.619  10.528
  200    HE2  TYR  26           2HE      TYR  26   2.668  -2.172  12.957
  201    HH   TYR  26           HH       TYR  26   4.934  -4.548  11.937
  202    H    HIS  27           H        HIS  27  -2.959  -2.579  11.557
  203    HA   HIS  27           HA       HIS  27  -5.665  -3.740  11.630
  204   1HB   HIS  27          2HB       HIS  27  -4.729  -1.199  12.635
  205   2HB   HIS  27          1HB       HIS  27  -5.854  -0.927  11.311
  206    HD1  HIS  27           1HD      HIS  27  -6.376  -3.898  13.492
  207    HD2  HIS  27           2HD      HIS  27  -7.798  -0.010  13.140
  208    HE1  HIS  27           1HE      HIS  27  -8.418  -3.794  14.955
  209    HE2  HIS  27           2HE      HIS  27  -9.194  -1.402  14.814
  210    HA   PRO  28           HA       PRO  28  -4.416  -2.987   7.314
  211   1HB   PRO  28          2HB       PRO  28  -4.841  -5.521   6.410
  212   2HB   PRO  28          1HB       PRO  28  -3.333  -4.973   7.139
  213   1HG   PRO  28          2HG       PRO  28  -5.340  -6.788   8.207
  214   2HG   PRO  28          1HG       PRO  28  -3.698  -6.498   8.763
  215   1HD   PRO  28          2HD       PRO  28  -6.166  -5.472   9.855
  216   2HD   PRO  28          1HD       PRO  28  -4.519  -5.315  10.489
  217    H    ASP  29           H        ASP  29  -5.670  -2.363   5.709
  218    HA   ASP  29           HA       ASP  29  -8.427  -3.372   5.551
  219   1HB   ASP  29          2HB       ASP  29  -8.359  -1.066   6.498
  220   2HB   ASP  29          1HB       ASP  29  -7.555  -0.522   5.030
  221    H    THR  30           H        THR  30  -8.869  -4.240   3.611
  222    HA   THR  30           HA       THR  30  -6.937  -3.801   1.465
  223    HB   THR  30           HB       THR  30  -7.873  -5.797   0.432
  224    HG1  THR  30           1HG      THR  30  -9.541  -6.925   1.536
  225   1HG2  THR  30          1HG2      THR  30  -6.304  -6.645   1.817
  226   2HG2  THR  30          2HG2      THR  30  -7.727  -7.363   2.569
  227   3HG2  THR  30          3HG2      THR  30  -7.008  -5.906   3.255
  228    H    ALA  31           H        ALA  31  -7.402  -2.886  -0.443
  229    HA   ALA  31           HA       ALA  31 -10.126  -1.828  -0.804
  230   1HB   ALA  31          1HB       ALA  31  -9.002   0.110  -0.946
  231   2HB   ALA  31          2HB       ALA  31  -8.577  -0.431  -2.570
  232   3HB   ALA  31          3HB       ALA  31  -7.459  -0.695  -1.232
  233    H    LYS  32           H        LYS  32 -10.445  -1.352  -3.329
  234    HA   LYS  32           HA       LYS  32  -9.710  -3.827  -4.742
  235   1HB   LYS  32          2HB       LYS  32 -12.224  -2.489  -5.542
  236   2HB   LYS  32          1HB       LYS  32 -11.841  -4.201  -5.443
  237   1HG   LYS  32          2HG       LYS  32 -12.276  -4.275  -3.137
  238   2HG   LYS  32          1HG       LYS  32 -12.249  -2.517  -2.997
  239   1HD   LYS  32          2HD       LYS  32 -14.245  -2.609  -4.655
  240   2HD   LYS  32          1HD       LYS  32 -14.369  -4.293  -4.143
  241   1HE   LYS  32          2HE       LYS  32 -14.191  -3.142  -1.743
  242   2HE   LYS  32          1HE       LYS  32 -14.905  -1.799  -2.635
  243   1HZ   LYS  32          1HZ       LYS  32 -16.615  -3.450  -3.415
  244   2HZ   LYS  32          2HZ       LYS  32 -16.687  -3.041  -1.776
  245   3HZ   LYS  32          3HZ       LYS  32 -16.012  -4.519  -2.251
  246    H    THR  33           H        THR  33  -9.483  -0.488  -4.749
  247    HA   THR  33           HA       THR  33  -8.177  -0.413  -7.248
  248    HB   THR  33           HB       THR  33 -10.107   1.482  -7.873
  249    HG1  THR  33           1HG      THR  33 -11.676   0.757  -6.574
  250   1HG2  THR  33          1HG2      THR  33  -9.347   0.318  -9.681
  251   2HG2  THR  33          2HG2      THR  33 -10.939  -0.410  -9.468
  252   3HG2  THR  33          3HG2      THR  33  -9.501  -1.245  -8.881
  253    H    LEU  34           H        LEU  34  -8.262   2.223  -7.891
  254    HA   LEU  34           HA       LEU  34  -6.926   3.407  -5.630
  255   1HB   LEU  34          2HB       LEU  34  -7.552   4.592  -8.339
  256   2HB   LEU  34          1HB       LEU  34  -6.465   5.278  -7.146
  257    HG   LEU  34           HG       LEU  34  -6.045   2.626  -8.529
  258   1HD1  LEU  34          1HD1      LEU  34  -4.216   4.874  -9.024
  259   2HD1  LEU  34          2HD1      LEU  34  -5.827   5.034  -9.724
  260   3HD1  LEU  34          3HD1      LEU  34  -4.827   3.638 -10.124
  261   1HD2  LEU  34          1HD2      LEU  34  -5.029   3.450  -6.130
  262   2HD2  LEU  34          2HD2      LEU  34  -3.785   3.981  -7.262
  263   3HD2  LEU  34          3HD2      LEU  34  -4.266   2.287  -7.213
  264    H    ARG  35           H        ARG  35  -9.998   3.699  -7.259
  265    HA   ARG  35           HA       ARG  35 -10.807   6.116  -5.980
  266   1HB   ARG  35          2HB       ARG  35 -12.268   3.943  -7.463
  267   2HB   ARG  35          1HB       ARG  35 -13.142   5.242  -6.665
  268   1HG   ARG  35          2HG       ARG  35 -11.045   5.618  -8.791
  269   2HG   ARG  35          1HG       ARG  35 -12.789   5.667  -9.055
  270   1HD   ARG  35          2HD       ARG  35 -12.902   7.783  -8.374
  271   2HD   ARG  35          1HD       ARG  35 -12.024   7.414  -6.890
  272    HE   ARG  35           HE       ARG  35 -10.110   8.220  -7.857
  273   1HH1  ARG  35          1HH1      ARG  35 -12.518   7.731 -10.338
  274   2HH1  ARG  35          2HH1      ARG  35 -11.591   8.521 -11.568
  275   1HH2  ARG  35          1HH2      ARG  35  -8.891   9.260  -9.475
  276   2HH2  ARG  35          2HH2      ARG  35  -9.531   9.389 -11.079
  277    H    GLU  36           H        GLU  36 -11.339   2.670  -5.380
  278    HA   GLU  36           HA       GLU  36 -13.000   2.988  -3.117
  279   1HB   GLU  36          2HB       GLU  36 -12.143   0.851  -4.634
  280   2HB   GLU  36          1HB       GLU  36 -11.309   0.590  -3.109
  281   1HG   GLU  36          2HG       GLU  36 -13.351  -0.594  -3.004
  282   2HG   GLU  36          1HG       GLU  36 -13.515   0.817  -1.959
  283    H    ALA  37           H        ALA  37  -9.522   2.900  -3.576
  284    HA   ALA  37           HA       ALA  37  -8.881   2.681  -0.799
  285   1HB   ALA  37          1HB       ALA  37  -6.643   3.742  -1.855
  286   2HB   ALA  37          2HB       ALA  37  -7.395   3.100  -3.315
  287   3HB   ALA  37          3HB       ALA  37  -7.051   2.029  -1.958
  288    H    GLU  38           H        GLU  38  -8.921   5.393  -3.113
  289    HA   GLU  38           HA       GLU  38  -8.074   7.439  -1.505
  290   1HB   GLU  38          2HB       GLU  38 -10.138   7.360  -3.677
  291   2HB   GLU  38          1HB       GLU  38  -9.784   8.858  -2.827
  292   1HG   GLU  38          2HG       GLU  38  -7.494   8.786  -3.544
  293   2HG   GLU  38          1HG       GLU  38  -7.731   7.198  -4.270
  294    H    LYS  39           H        LYS  39 -11.362   6.112  -1.715
  295    HA   LYS  39           HA       LYS  39 -12.561   7.853   0.129
  296   1HB   LYS  39          2HB       LYS  39 -13.883   6.373  -1.293
  297   2HB   LYS  39          1HB       LYS  39 -13.201   4.962  -0.496
  298   1HG   LYS  39          2HG       LYS  39 -14.620   6.969   1.171
  299   2HG   LYS  39          1HG       LYS  39 -15.574   5.897   0.144
  300   1HD   LYS  39          2HD       LYS  39 -13.892   4.112   1.260
  301   2HD   LYS  39          1HD       LYS  39 -13.990   5.299   2.561
  302   1HE   LYS  39          2HE       LYS  39 -15.841   4.191   3.166
  303   2HE   LYS  39          1HE       LYS  39 -16.605   5.057   1.833
  304   1HZ   LYS  39          1HZ       LYS  39 -15.242   2.578   1.151
  305   2HZ   LYS  39          2HZ       LYS  39 -16.699   3.209   0.568
  306   3HZ   LYS  39          3HZ       LYS  39 -16.657   2.421   2.065
  307    H    LYS  40           H        LYS  40 -11.232   4.585   0.602
  308    HA   LYS  40           HA       LYS  40 -11.491   4.480   3.379
  309   1HB   LYS  40          2HB       LYS  40  -9.297   3.199   1.741
  310   2HB   LYS  40          1HB       LYS  40  -9.878   2.676   3.316
  311   1HG   LYS  40          2HG       LYS  40 -11.930   2.825   1.221
  312   2HG   LYS  40          1HG       LYS  40 -10.670   1.616   0.964
  313   1HD   LYS  40          2HD       LYS  40 -11.130   0.974   3.433
  314   2HD   LYS  40          1HD       LYS  40 -12.647   1.845   3.202
  315   1HE   LYS  40          2HE       LYS  40 -12.887   0.378   1.084
  316   2HE   LYS  40          1HE       LYS  40 -11.665  -0.640   1.847
  317   1HZ   LYS  40          1HZ       LYS  40 -14.205   0.148   3.164
  318   2HZ   LYS  40          2HZ       LYS  40 -13.083  -0.997   3.705
  319   3HZ   LYS  40          3HZ       LYS  40 -13.999  -1.300   2.314
  320    H    ILE  41           H        ILE  41  -9.150   6.094   1.371
  321    HA   ILE  41           HA       ILE  41  -7.396   6.640   3.640
  322    HB   ILE  41           HB       ILE  41  -7.120   7.513   0.766
  323   1HG1  ILE  41          2HG1      ILE  41  -5.543   5.350   2.147
  324   2HG1  ILE  41          1HG1      ILE  41  -7.048   4.997   1.307
  325   1HG2  ILE  41          1HG2      ILE  41  -5.547   8.004   3.208
  326   2HG2  ILE  41          2HG2      ILE  41  -5.688   8.963   1.735
  327   3HG2  ILE  41          3HG2      ILE  41  -4.622   7.558   1.773
  328   1HD1  ILE  41          1HD1      ILE  41  -5.815   6.315  -0.637
  329   2HD1  ILE  41          2HD1      ILE  41  -5.596   4.584  -0.375
  330   3HD1  ILE  41          3HD1      ILE  41  -4.397   5.727   0.230
  331    H    LYS  42           H        LYS  42 -10.131   8.003   2.258
  332    HA   LYS  42           HA       LYS  42  -9.391  10.762   2.773
  333   1HB   LYS  42          2HB       LYS  42 -11.715   9.387   1.534
  334   2HB   LYS  42          1HB       LYS  42 -11.961  10.992   2.207
  335   1HG   LYS  42          2HG       LYS  42  -9.612  10.708   0.468
  336   2HG   LYS  42          1HG       LYS  42 -11.174  10.508  -0.326
  337   1HD   LYS  42          2HD       LYS  42 -11.442  12.735   1.368
  338   2HD   LYS  42          1HD       LYS  42  -9.878  12.914   0.570
  339   1HE   LYS  42          2HE       LYS  42 -11.993  12.058  -1.244
  340   2HE   LYS  42          1HE       LYS  42 -12.329  13.610  -0.480
  341   1HZ   LYS  42          1HZ       LYS  42  -9.963  12.880  -2.110
  342   2HZ   LYS  42          2HZ       LYS  42 -10.052  14.299  -1.194
  343   3HZ   LYS  42          3HZ       LYS  42 -11.141  14.042  -2.462
  344    H    GLU  43           H        GLU  43 -10.013   8.375   4.782
  345    HA   GLU  43           HA       GLU  43 -11.186  10.136   6.773
  346   1HB   GLU  43          2HB       GLU  43 -12.380   7.420   6.192
  347   2HB   GLU  43          1HB       GLU  43 -12.887   8.532   7.456
  348   1HG   GLU  43          2HG       GLU  43 -13.632  10.127   5.798
  349   2HG   GLU  43          1HG       GLU  43 -13.047   9.084   4.501
  350    H    LEU  44           H        LEU  44 -10.024   6.850   6.085
  351    HA   LEU  44           HA       LEU  44  -9.104   6.480   8.795
  352   1HB   LEU  44          2HB       LEU  44  -9.649   4.819   6.548
  353   2HB   LEU  44          1HB       LEU  44  -7.981   4.552   7.016
  354    HG   LEU  44           HG       LEU  44  -9.493   2.956   8.093
  355   1HD1  LEU  44          1HD1      LEU  44  -8.337   2.943  10.030
  356   2HD1  LEU  44          2HD1      LEU  44  -8.690   4.635  10.382
  357   3HD1  LEU  44          3HD1      LEU  44  -7.420   4.220   9.230
  358   1HD2  LEU  44          1HD2      LEU  44 -11.542   3.832   8.480
  359   2HD2  LEU  44          2HD2      LEU  44 -10.910   5.441   8.829
  360   3HD2  LEU  44          3HD2      LEU  44 -10.837   4.180  10.058
  361    H    PHE  45           H        PHE  45  -7.283   7.351   9.514
  362    HA   PHE  45           HA       PHE  45  -5.326   8.486   7.801
  363   1HB   PHE  45          2HB       PHE  45  -5.922   9.159  10.212
  364   2HB   PHE  45          1HB       PHE  45  -4.868   7.837  10.705
  365    HD1  PHE  45           1HD      PHE  45  -5.039  11.194   9.339
  366    HD2  PHE  45           2HD      PHE  45  -2.463   7.923  10.223
  367    HE1  PHE  45           1HE      PHE  45  -3.087  12.677   9.124
  368    HE2  PHE  45           2HE      PHE  45  -0.507   9.400  10.009
  369    HZ   PHE  45           HZ       PHE  45  -0.818  11.780   9.459
  370    H    PHE  46           H        PHE  46  -5.037   6.444   6.532
  371    HA   PHE  46           HA       PHE  46  -3.638   4.245   7.659
  372   1HB   PHE  46          2HB       PHE  46  -4.134   5.174   4.841
  373   2HB   PHE  46          1HB       PHE  46  -3.104   3.787   5.176
  374    HD1  PHE  46           1HD      PHE  46  -6.057   4.357   3.883
  375    HD2  PHE  46           2HD      PHE  46  -4.492   2.440   7.344
  376    HE1  PHE  46           1HE      PHE  46  -8.044   2.911   3.975
  377    HE2  PHE  46           2HE      PHE  46  -6.478   0.988   7.442
  378    HZ   PHE  46           HZ       PHE  46  -8.258   1.227   5.758
  379    HA   PRO  47           HA       PRO  47   0.308   6.412   7.684
  380   1HB   PRO  47          2HB       PRO  47   1.500   4.117   8.927
  381   2HB   PRO  47          1HB       PRO  47   1.101   5.667   9.659
  382   1HG   PRO  47          2HG       PRO  47  -0.153   3.263  10.230
  383   2HG   PRO  47          1HG       PRO  47  -0.812   4.864  10.567
  384   1HD   PRO  47          2HD       PRO  47  -1.461   2.972   8.376
  385   2HD   PRO  47          1HD       PRO  47  -2.501   4.155   9.192
  386    H    VAL  48           H        VAL  48  -0.152   3.032   6.755
  387    HA   VAL  48           HA       VAL  48   1.938   3.379   4.711
  388    HB   VAL  48           HB       VAL  48   1.260   0.759   6.033
  389   1HG1  VAL  48          1HG1      VAL  48   3.114   1.648   3.916
  390   2HG1  VAL  48          2HG1      VAL  48   2.300   0.100   4.137
  391   3HG1  VAL  48          3HG1      VAL  48   3.745   0.478   5.074
  392   1HG2  VAL  48          1HG2      VAL  48   2.353   2.704   7.443
  393   2HG2  VAL  48          2HG2      VAL  48   3.806   2.172   6.601
  394   3HG2  VAL  48          3HG2      VAL  48   2.896   1.034   7.592
  395    H    ILE  49           H        ILE  49   1.289   3.112   2.698
  396    HA   ILE  49           HA       ILE  49  -1.253   1.717   2.184
  397    HB   ILE  49           HB       ILE  49  -0.004   3.739   0.336
  398   1HG1  ILE  49          2HG1      ILE  49  -0.388   4.877   2.456
  399   2HG1  ILE  49          1HG1      ILE  49  -1.583   5.400   1.273
  400   1HG2  ILE  49          1HG2      ILE  49  -2.920   3.227   0.528
  401   2HG2  ILE  49          2HG2      ILE  49  -1.911   1.989  -0.218
  402   3HG2  ILE  49          3HG2      ILE  49  -1.929   3.625  -0.875
  403   1HD1  ILE  49          1HD1      ILE  49  -2.318   4.864   3.690
  404   2HD1  ILE  49          2HD1      ILE  49  -2.223   3.184   3.163
  405   3HD1  ILE  49          3HD1      ILE  49  -3.306   4.307   2.339
  406    H    VAL  50           H        VAL  50  -1.219  -0.027   0.904
  407    HA   VAL  50           HA       VAL  50   1.211  -0.523  -0.693
  408    HB   VAL  50           HB       VAL  50  -0.418  -2.603   0.770
  409   1HG1  VAL  50          1HG1      VAL  50   2.168  -2.923  -0.749
  410   2HG1  VAL  50          2HG1      VAL  50   0.579  -3.354  -1.382
  411   3HG1  VAL  50          3HG1      VAL  50   1.224  -4.194   0.028
  412   1HG2  VAL  50          1HG2      VAL  50   2.402  -2.300   1.451
  413   2HG2  VAL  50          2HG2      VAL  50   0.992  -2.450   2.498
  414   3HG2  VAL  50          3HG2      VAL  50   1.432  -0.878   1.833
  415    H    LEU  51           H        LEU  51   0.645  -0.218  -2.725
  416    HA   LEU  51           HA       LEU  51  -1.998  -1.028  -3.659
  417   1HB   LEU  51          2HB       LEU  51  -1.283   1.175  -4.313
  418   2HB   LEU  51          1HB       LEU  51   0.219   0.546  -4.962
  419    HG   LEU  51           HG       LEU  51  -1.334  -0.797  -6.571
  420   1HD1  LEU  51          1HD1      LEU  51  -3.417   0.365  -7.097
  421   2HD1  LEU  51          2HD1      LEU  51  -3.151   1.459  -5.738
  422   3HD1  LEU  51          3HD1      LEU  51  -3.425  -0.259  -5.446
  423   1HD2  LEU  51          1HD2      LEU  51  -0.569   2.085  -6.678
  424   2HD2  LEU  51          2HD2      LEU  51  -1.525   1.389  -7.987
  425   3HD2  LEU  51          3HD2      LEU  51   0.059   0.718  -7.598
  426    H    ASP  52           H        ASP  52  -2.334  -2.463  -5.342
  427    HA   ASP  52           HA       ASP  52  -0.030  -4.128  -6.106
  428   1HB   ASP  52          2HB       ASP  52  -1.916  -5.029  -4.422
  429   2HB   ASP  52          1HB       ASP  52  -2.709  -5.405  -5.949
  430    H    VAL  53           H        VAL  53   0.270  -3.320  -8.129
  431    HA   VAL  53           HA       VAL  53  -1.810  -2.634  -9.918
  432    HB   VAL  53           HB       VAL  53   1.025  -3.368 -10.650
  433   1HG1  VAL  53          1HG1      VAL  53  -0.261  -3.212 -12.613
  434   2HG1  VAL  53          2HG1      VAL  53   0.566  -1.661 -12.467
  435   3HG1  VAL  53          3HG1      VAL  53  -1.135  -1.798 -12.023
  436   1HG2  VAL  53          1HG2      VAL  53   1.536  -1.694  -9.220
  437   2HG2  VAL  53          2HG2      VAL  53  -0.086  -1.003  -9.279
  438   3HG2  VAL  53          3HG2      VAL  53   1.055  -0.684 -10.584
  439    H    TRP  54           H        TRP  54  -3.084  -4.667  -9.577
  440    HA   TRP  54           HA       TRP  54  -2.102  -7.063 -10.846
  441   1HB   TRP  54          2HB       TRP  54  -3.554  -7.398  -8.982
  442   2HB   TRP  54          1HB       TRP  54  -4.767  -6.305  -9.639
  443    HD1  TRP  54           HD       TRP  54  -6.704  -7.427 -10.900
  444    HE1  TRP  54           1HE      TRP  54  -7.150  -9.769 -11.871
  445    HE3  TRP  54           3HE      TRP  54  -2.104  -9.503 -10.139
  446    HZ2  TRP  54           2HZ      TRP  54  -5.733 -12.181 -12.263
  447    HZ3  TRP  54           3HZ      TRP  54  -1.725 -11.832 -10.839
  448    HH2  TRP  54           HH       TRP  54  -3.504 -13.142 -11.880
  449    H    MET  55           H        MET  55  -5.350  -5.907 -11.489
  450    HA   MET  55           HA       MET  55  -4.667  -5.366 -14.279
  451   1HB   MET  55          2HB       MET  55  -5.317  -7.747 -14.149
  452   2HB   MET  55          1HB       MET  55  -6.858  -7.276 -13.447
  453   1HG   MET  55          2HG       MET  55  -7.724  -7.032 -15.460
  454   2HG   MET  55          1HG       MET  55  -6.512  -5.815 -15.850
  455   1HE   MET  55          1HE       MET  55  -6.217 -10.312 -16.564
  456   2HE   MET  55          2HE       MET  55  -7.702  -9.496 -17.054
  457   3HE   MET  55          3HE       MET  55  -7.190  -9.455 -15.367
  458    HA   PRO  56           HA       PRO  56  -8.078  -2.683 -12.360
  459   1HB   PRO  56          2HB       PRO  56  -6.707  -0.493 -11.633
  460   2HB   PRO  56          1HB       PRO  56  -6.847  -1.896 -10.566
  461   1HG   PRO  56          2HG       PRO  56  -4.577  -1.085 -12.339
  462   2HG   PRO  56          1HG       PRO  56  -4.533  -1.699 -10.677
  463   1HD   PRO  56          2HD       PRO  56  -4.058  -3.248 -12.883
  464   2HD   PRO  56          1HD       PRO  56  -4.691  -3.879 -11.350
  465    H    ASP  57           H        ASP  57  -8.151  -0.050 -12.895
  466    HA   ASP  57           HA       ASP  57  -7.575   0.113 -15.781
  467   1HB   ASP  57          2HB       ASP  57  -9.851   1.425 -14.282
  468   2HB   ASP  57          1HB       ASP  57  -9.566   1.501 -16.018
  469    H    GLY  58           H        GLY  58  -7.880   1.985 -12.783
  470   1HA   GLY  58          2HA       GLY  58  -6.886   4.411 -13.888
  471   2HA   GLY  58          1HA       GLY  58  -7.017   4.031 -12.178
  472    H    ASP  59           H        ASP  59  -4.893   5.492 -13.168
  473    HA   ASP  59           HA       ASP  59  -2.646   3.624 -13.323
  474   1HB   ASP  59          2HB       ASP  59  -3.184   6.202 -14.440
  475   2HB   ASP  59          1HB       ASP  59  -1.753   6.326 -13.421
  476    H    GLY  60           H        GLY  60  -1.564   3.103 -11.549
  477   1HA   GLY  60          2HA       GLY  60  -2.052   4.400  -9.050
  478   2HA   GLY  60          1HA       GLY  60  -0.902   3.105  -9.341
  479    H    VAL  61           H        VAL  61   0.271   4.868 -11.560
  480    HA   VAL  61           HA       VAL  61   2.441   5.871 -10.150
  481    HB   VAL  61           HB       VAL  61   1.411   6.734 -12.857
  482   1HG1  VAL  61          1HG1      VAL  61   4.153   7.024 -11.646
  483   2HG1  VAL  61          2HG1      VAL  61   2.998   8.330 -11.914
  484   3HG1  VAL  61          3HG1      VAL  61   3.689   7.467 -13.289
  485   1HG2  VAL  61          1HG2      VAL  61   3.583   4.739 -12.260
  486   2HG2  VAL  61          2HG2      VAL  61   2.799   5.069 -13.805
  487   3HG2  VAL  61          3HG2      VAL  61   1.901   4.276 -12.512
  488    H    ASN  62           H        ASN  62  -0.545   7.446 -11.171
  489    HA   ASN  62           HA       ASN  62   0.328  10.024 -10.175
  490   1HB   ASN  62          2HB       ASN  62  -1.663   9.094 -12.001
  491   2HB   ASN  62          1HB       ASN  62  -2.460  10.035 -10.744
  492   1HD2  ASN  62          1HD2      ASN  62  -0.113  10.082 -13.314
  493   2HD2  ASN  62          2HD2      ASN  62  -0.019  11.801 -13.464
  494    H    PHE  63           H        PHE  63  -1.422   7.288  -9.020
  495    HA   PHE  63           HA       PHE  63  -3.015   8.549  -7.064
  496   1HB   PHE  63          2HB       PHE  63  -3.371   6.223  -7.820
  497   2HB   PHE  63          1HB       PHE  63  -1.870   5.749  -7.030
  498    HD1  PHE  63           1HD      PHE  63  -4.537   8.027  -5.809
  499    HD2  PHE  63           2HD      PHE  63  -2.537   4.299  -5.346
  500    HE1  PHE  63           1HE      PHE  63  -5.764   7.634  -3.714
  501    HE2  PHE  63           2HE      PHE  63  -3.761   3.898  -3.250
  502    HZ   PHE  63           HZ       PHE  63  -5.377   5.568  -2.432
  503    H    ILE  64           H        ILE  64   0.278   7.267  -6.985
  504    HA   ILE  64           HA       ILE  64   0.873   7.314  -4.320
  505    HB   ILE  64           HB       ILE  64   2.689   8.321  -6.514
  506   1HG1  ILE  64          2HG1      ILE  64   3.199   5.628  -5.606
  507   2HG1  ILE  64          1HG1      ILE  64   1.535   5.777  -6.164
  508   1HG2  ILE  64          1HG2      ILE  64   4.318   7.124  -4.738
  509   2HG2  ILE  64          2HG2      ILE  64   3.083   7.756  -3.650
  510   3HG2  ILE  64          3HG2      ILE  64   3.955   8.850  -4.725
  511   1HD1  ILE  64          1HD1      ILE  64   3.919   6.648  -7.771
  512   2HD1  ILE  64          2HD1      ILE  64   2.245   6.511  -8.309
  513   3HD1  ILE  64          3HD1      ILE  64   3.161   5.061  -7.900
  514    H    ASP  65           H        ASP  65   0.332  10.043  -6.415
  515    HA   ASP  65           HA       ASP  65   1.472  12.012  -4.707
  516   1HB   ASP  65          2HB       ASP  65   0.509  11.997  -7.288
  517   2HB   ASP  65          1HB       ASP  65  -0.720  12.923  -6.432
  518    H    PHE  66           H        PHE  66  -1.911  11.013  -5.313
  519    HA   PHE  66           HA       PHE  66  -3.210  12.688  -3.577
  520   1HB   PHE  66          2HB       PHE  66  -4.555  11.308  -4.929
  521   2HB   PHE  66          1HB       PHE  66  -3.738   9.842  -4.404
  522    HD1  PHE  66           1HD      PHE  66  -4.248   8.852  -2.222
  523    HD2  PHE  66           2HD      PHE  66  -6.365  12.242  -3.682
  524    HE1  PHE  66           1HE      PHE  66  -6.013   8.462  -0.555
  525    HE2  PHE  66           2HE      PHE  66  -8.134  11.860  -2.015
  526    HZ   PHE  66           HZ       PHE  66  -7.960   9.968  -0.448
  527    H    ILE  67           H        ILE  67  -1.510   9.677  -2.842
  528    HA   ILE  67           HA       ILE  67  -2.253   9.455  -0.146
  529    HB   ILE  67           HB       ILE  67   0.230   8.528  -1.591
  530   1HG1  ILE  67          2HG1      ILE  67  -0.946   6.279  -1.038
  531   2HG1  ILE  67          1HG1      ILE  67  -2.372   7.273  -0.764
  532   1HG2  ILE  67          1HG2      ILE  67   1.146   8.452   0.477
  533   2HG2  ILE  67          2HG2      ILE  67   0.201   6.967   0.591
  534   3HG2  ILE  67          3HG2      ILE  67  -0.420   8.463   1.289
  535   1HD1  ILE  67          1HD1      ILE  67  -0.839   7.491  -3.317
  536   2HD1  ILE  67          2HD1      ILE  67  -2.527   7.883  -2.988
  537   3HD1  ILE  67          3HD1      ILE  67  -2.012   6.199  -3.071
  538    H    LYS  68           H        LYS  68   0.570  11.051  -1.635
  539    HA   LYS  68           HA       LYS  68   1.503  12.057   0.888
  540   1HB   LYS  68          2HB       LYS  68   2.282  12.769  -1.947
  541   2HB   LYS  68          1HB       LYS  68   3.109  13.347  -0.507
  542   1HG   LYS  68          2HG       LYS  68   2.804  10.427  -0.715
  543   2HG   LYS  68          1HG       LYS  68   3.863  11.182  -1.909
  544   1HD   LYS  68          2HD       LYS  68   4.605  12.406   0.443
  545   2HD   LYS  68          1HD       LYS  68   4.264  10.750   0.949
  546   1HE   LYS  68          2HE       LYS  68   5.685  10.337  -1.333
  547   2HE   LYS  68          1HE       LYS  68   6.432  11.811  -0.722
  548   1HZ   LYS  68          1HZ       LYS  68   6.997  10.747   1.290
  549   2HZ   LYS  68          2HZ       LYS  68   7.443   9.672   0.062
  550   3HZ   LYS  68          3HZ       LYS  68   6.031   9.399   0.953
  551    H    GLU  69           H        GLU  69  -0.800  13.063  -1.439
  552    HA   GLU  69           HA       GLU  69  -0.700  15.861  -1.020
  553   1HB   GLU  69          2HB       GLU  69  -1.814  14.675  -2.944
  554   2HB   GLU  69          1HB       GLU  69  -3.109  14.244  -1.836
  555   1HG   GLU  69          2HG       GLU  69  -3.672  16.547  -1.498
  556   2HG   GLU  69          1HG       GLU  69  -2.270  17.069  -2.431
  557    H    ASN  70           H        ASN  70  -2.813  13.328   0.299
  558    HA   ASN  70           HA       ASN  70  -3.578  15.190   2.447
  559   1HB   ASN  70          2HB       ASN  70  -5.106  12.705   1.698
  560   2HB   ASN  70          1HB       ASN  70  -5.668  14.103   2.611
  561   1HD2  ASN  70          1HD2      ASN  70  -4.491  13.138  -0.580
  562   2HD2  ASN  70          2HD2      ASN  70  -5.441  14.272  -1.470
  563    H    SER  71           H        SER  71  -1.284  13.108   2.099
  564    HA   SER  71           HA       SER  71  -1.294  12.286   4.847
  565   1HB   SER  71          2HB       SER  71  -2.170  10.430   2.790
  566   2HB   SER  71          1HB       SER  71  -0.742   9.828   3.632
  567    HG   SER  71           HG       SER  71  -3.317  10.237   4.564
  568    HA   PRO  72           HA       PRO  72   2.829  13.036   2.779
  569   1HB   PRO  72          2HB       PRO  72   3.234  14.988   4.916
  570   2HB   PRO  72          1HB       PRO  72   3.335  15.214   3.169
  571   1HG   PRO  72          2HG       PRO  72   1.340  16.269   4.659
  572   2HG   PRO  72          1HG       PRO  72   1.112  15.760   2.976
  573   1HD   PRO  72          2HD       PRO  72   0.356  14.348   5.506
  574   2HD   PRO  72          1HD       PRO  72  -0.550  14.498   3.984
  575    H    ASP  73           H        ASP  73   1.681  12.382   5.927
  576    HA   ASP  73           HA       ASP  73   4.305  11.478   6.848
  577   1HB   ASP  73          2HB       ASP  73   2.052  12.653   8.140
  578   2HB   ASP  73          1HB       ASP  73   2.353  11.071   8.850
  579    H    SER  74           H        SER  74   2.704  10.077   4.809
  580    HA   SER  74           HA       SER  74   2.276   7.532   6.232
  581   1HB   SER  74          2HB       SER  74   0.196   8.391   5.268
  582   2HB   SER  74          1HB       SER  74   0.965   8.514   3.686
  583    HG   SER  74           HG       SER  74  -0.162   6.369   4.877
  584    H    VAL  75           H        VAL  75   2.293   5.719   4.314
  585    HA   VAL  75           HA       VAL  75   4.819   6.118   2.853
  586    HB   VAL  75           HB       VAL  75   4.002   3.547   4.211
  587   1HG1  VAL  75          1HG1      VAL  75   6.096   4.290   2.273
  588   2HG1  VAL  75          2HG1      VAL  75   5.345   2.726   2.590
  589   3HG1  VAL  75          3HG1      VAL  75   6.637   3.312   3.639
  590   1HG2  VAL  75          1HG2      VAL  75   4.984   5.772   5.454
  591   2HG2  VAL  75          2HG2      VAL  75   6.462   4.890   5.068
  592   3HG2  VAL  75          3HG2      VAL  75   5.197   4.117   6.023
  593    H    VAL  76           H        VAL  76   4.955   5.350   0.857
  594    HA   VAL  76           HA       VAL  76   2.597   3.945  -0.238
  595    HB   VAL  76           HB       VAL  76   4.222   5.703  -2.021
  596   1HG1  VAL  76          1HG1      VAL  76   2.550   4.281  -3.020
  597   2HG1  VAL  76          2HG1      VAL  76   2.040   5.964  -3.143
  598   3HG1  VAL  76          3HG1      VAL  76   1.318   4.911  -1.927
  599   1HG2  VAL  76          1HG2      VAL  76   2.184   6.663  -0.033
  600   2HG2  VAL  76          2HG2      VAL  76   2.570   7.555  -1.505
  601   3HG2  VAL  76          3HG2      VAL  76   3.822   7.262  -0.297
  602    H    ILE  77           H        ILE  77   3.570   1.929  -0.028
  603    HA   ILE  77           HA       ILE  77   6.157   1.356  -1.091
  604    HB   ILE  77           HB       ILE  77   3.944  -0.567  -0.355
  605   1HG1  ILE  77          2HG1      ILE  77   4.603   0.898   1.517
  606   2HG1  ILE  77          1HG1      ILE  77   5.090  -0.772   1.795
  607   1HG2  ILE  77          1HG2      ILE  77   5.496  -1.735  -1.693
  608   2HG2  ILE  77          2HG2      ILE  77   5.915  -2.126  -0.025
  609   3HG2  ILE  77          3HG2      ILE  77   6.873  -0.947  -0.920
  610   1HD1  ILE  77          1HD1      ILE  77   7.347   0.068   0.738
  611   2HD1  ILE  77          2HD1      ILE  77   6.977   0.320   2.443
  612   3HD1  ILE  77          3HD1      ILE  77   6.750   1.633   1.289
  613    H    VAL  78           H        VAL  78   3.024  -0.062  -2.067
  614    HA   VAL  78           HA       VAL  78   2.204  -0.671  -4.112
  615    HB   VAL  78           HB       VAL  78   4.203   1.292  -5.256
  616   1HG1  VAL  78          1HG1      VAL  78   1.580   0.304  -6.371
  617   2HG1  VAL  78          2HG1      VAL  78   3.169  -0.282  -6.862
  618   3HG1  VAL  78          3HG1      VAL  78   2.719   1.399  -7.155
  619   1HG2  VAL  78          1HG2      VAL  78   1.415   2.145  -4.977
  620   2HG2  VAL  78          2HG2      VAL  78   2.910   3.023  -4.654
  621   3HG2  VAL  78          3HG2      VAL  78   2.259   1.917  -3.446
  622    H    ILE  79           H        ILE  79   2.634  -2.628  -4.898
  623    HA   ILE  79           HA       ILE  79   5.406  -3.237  -5.699
  624    HB   ILE  79           HB       ILE  79   3.587  -5.450  -4.857
  625   1HG1  ILE  79          2HG1      ILE  79   5.147  -3.796  -2.867
  626   2HG1  ILE  79          1HG1      ILE  79   3.408  -3.656  -3.100
  627   1HG2  ILE  79          1HG2      ILE  79   5.618  -6.284  -5.571
  628   2HG2  ILE  79          2HG2      ILE  79   5.910  -6.117  -3.843
  629   3HG2  ILE  79          3HG2      ILE  79   6.518  -4.896  -4.960
  630   1HD1  ILE  79          1HD1      ILE  79   3.737  -5.036  -1.222
  631   2HD1  ILE  79          2HD1      ILE  79   4.945  -6.011  -2.060
  632   3HD1  ILE  79          3HD1      ILE  79   3.251  -6.099  -2.543
  633    H    THR  80           H        THR  80   4.211  -5.959  -6.603
  634    HA   THR  80           HA       THR  80   3.451  -6.895  -8.521
  635    HB   THR  80           HB       THR  80   1.896  -4.626  -9.511
  636    HG1  THR  80           1HG      THR  80   1.284  -5.614  -6.929
  637   1HG2  THR  80          1HG2      THR  80   0.035  -6.361  -8.944
  638   2HG2  THR  80          2HG2      THR  80   1.399  -7.470  -8.805
  639   3HG2  THR  80          3HG2      THR  80   1.111  -6.613 -10.318
  640    H    GLY  81           H        GLY  81   5.209  -7.059  -9.795
  641   1HA   GLY  81          2HA       GLY  81   5.433  -5.584 -12.144
  642   2HA   GLY  81          1HA       GLY  81   6.547  -4.864 -10.990
  643    H    HIS  82           H        HIS  82   5.692  -8.279 -11.298
  644    HA   HIS  82           HA       HIS  82   8.435  -9.059 -11.281
  645   1HB   HIS  82          2HB       HIS  82   6.026 -10.305 -10.725
  646   2HB   HIS  82          1HB       HIS  82   6.562 -11.104 -12.200
  647    HD1  HIS  82           1HD      HIS  82   9.681 -10.621 -11.148
  648    HD2  HIS  82           2HD      HIS  82   6.591 -12.751  -9.365
  649    HE1  HIS  82           1HE      HIS  82  10.800 -12.274  -9.619
  650    HE2  HIS  82           2HE      HIS  82   8.913 -13.610  -8.617
  651    H    GLY  83           H        GLY  83   9.392  -8.081 -13.087
  652   1HA   GLY  83          2HA       GLY  83   9.833  -9.506 -15.330
  653   2HA   GLY  83          1HA       GLY  83   8.364  -8.634 -15.738
  654    H    SER  84           H        SER  84   9.182  -6.303 -14.109
  655    HA   SER  84           HA       SER  84  11.621  -5.316 -15.254
  656   1HB   SER  84          2HB       SER  84   9.001  -4.661 -16.482
  657   2HB   SER  84          1HB       SER  84  10.110  -3.312 -16.240
  658    HG   SER  84           HG       SER  84  10.905  -5.728 -17.479
  659    H    VAL  85           H        VAL  85  12.420  -3.609 -14.121
  660    HA   VAL  85           HA       VAL  85  10.846  -2.746 -11.809
  661    HB   VAL  85           HB       VAL  85  13.773  -2.216 -12.315
  662   1HG1  VAL  85          1HG1      VAL  85  11.890  -1.756 -10.080
  663   2HG1  VAL  85          2HG1      VAL  85  13.297  -0.823 -10.591
  664   3HG1  VAL  85          3HG1      VAL  85  13.512  -2.303  -9.655
  665   1HG2  VAL  85          1HG2      VAL  85  12.454  -4.556 -10.948
  666   2HG2  VAL  85          2HG2      VAL  85  14.155  -4.136 -10.745
  667   3HG2  VAL  85          3HG2      VAL  85  13.543  -4.588 -12.335
  668    H    ASP  86           H        ASP  86  10.264  -1.685 -14.428
  669    HA   ASP  86           HA       ASP  86  11.334   1.021 -14.403
  670   1HB   ASP  86          2HB       ASP  86  10.101   1.306 -16.508
  671   2HB   ASP  86          1HB       ASP  86  11.111  -0.136 -16.556
  672    H    THR  87           H        THR  87   8.488  -0.692 -13.422
  673    HA   THR  87           HA       THR  87   6.798   1.631 -13.321
  674    HB   THR  87           HB       THR  87   6.001  -0.776 -13.582
  675    HG1  THR  87           1HG      THR  87   4.685   1.088 -12.931
  676   1HG2  THR  87          1HG2      THR  87   7.388  -1.429 -11.424
  677   2HG2  THR  87          2HG2      THR  87   5.891  -2.249 -11.867
  678   3HG2  THR  87          3HG2      THR  87   5.874  -0.988 -10.635
  679    H    ALA  88           H        ALA  88   8.868  -0.129 -11.114
  680    HA   ALA  88           HA       ALA  88   8.062   1.047  -8.700
  681   1HB   ALA  88          1HB       ALA  88  10.306   0.430  -7.879
  682   2HB   ALA  88          2HB       ALA  88  10.790   0.062  -9.535
  683   3HB   ALA  88          3HB       ALA  88   9.526  -0.890  -8.754
  684    H    VAL  89           H        VAL  89  10.797   1.879 -10.799
  685    HA   VAL  89           HA       VAL  89  11.583   4.216  -9.516
  686    HB   VAL  89           HB       VAL  89  12.673   4.854 -11.610
  687   1HG1  VAL  89          1HG1      VAL  89  12.975   1.884 -11.442
  688   2HG1  VAL  89          2HG1      VAL  89  13.444   2.905 -10.083
  689   3HG1  VAL  89          3HG1      VAL  89  14.210   3.124 -11.656
  690   1HG2  VAL  89          1HG2      VAL  89  12.373   3.604 -13.652
  691   2HG2  VAL  89          2HG2      VAL  89  10.810   4.219 -13.115
  692   3HG2  VAL  89          3HG2      VAL  89  11.224   2.524 -12.862
  693    H    LYS  90           H        LYS  90   8.968   3.624 -11.755
  694    HA   LYS  90           HA       LYS  90   8.447   6.392 -12.305
  695   1HB   LYS  90          2HB       LYS  90   7.824   4.710 -13.934
  696   2HB   LYS  90          1HB       LYS  90   6.792   3.906 -12.759
  697   1HG   LYS  90          2HG       LYS  90   5.243   5.711 -12.763
  698   2HG   LYS  90          1HG       LYS  90   6.336   6.722 -13.710
  699   1HD   LYS  90          2HD       LYS  90   6.126   4.611 -15.359
  700   2HD   LYS  90          1HD       LYS  90   4.551   4.527 -14.567
  701   1HE   LYS  90          2HE       LYS  90   4.178   6.903 -15.146
  702   2HE   LYS  90          1HE       LYS  90   5.714   6.907 -16.011
  703   1HZ   LYS  90          1HZ       LYS  90   4.892   5.476 -17.630
  704   2HZ   LYS  90          2HZ       LYS  90   3.596   6.525 -17.347
  705   3HZ   LYS  90          3HZ       LYS  90   3.587   4.970 -16.680
  706    H    ALA  91           H        ALA  91   7.822   4.355  -9.671
  707    HA   ALA  91           HA       ALA  91   5.542   5.992  -8.801
  708   1HB   ALA  91          1HB       ALA  91   5.039   4.217  -7.223
  709   2HB   ALA  91          2HB       ALA  91   6.485   3.339  -7.722
  710   3HB   ALA  91          3HB       ALA  91   5.157   3.571  -8.860
  711    H    ILE  92           H        ILE  92   8.695   4.757  -7.746
  712    HA   ILE  92           HA       ILE  92   8.626   6.060  -5.219
  713    HB   ILE  92           HB       ILE  92  10.874   5.398  -4.913
  714   1HG1  ILE  92          2HG1      ILE  92  11.009   4.956  -7.904
  715   2HG1  ILE  92          1HG1      ILE  92  11.828   6.231  -7.006
  716   1HG2  ILE  92          1HG2      ILE  92  10.816   2.993  -5.794
  717   2HG2  ILE  92          2HG2      ILE  92   9.249   3.423  -6.476
  718   3HG2  ILE  92          3HG2      ILE  92   9.508   3.517  -4.735
  719   1HD1  ILE  92          1HD1      ILE  92  12.326   3.290  -6.616
  720   2HD1  ILE  92          2HD1      ILE  92  13.223   4.628  -5.899
  721   3HD1  ILE  92          3HD1      ILE  92  13.299   4.347  -7.638
  722    H    LYS  93           H        LYS  93   9.672   7.000  -8.410
  723    HA   LYS  93           HA       LYS  93  11.170   9.280  -7.624
  724   1HB   LYS  93          2HB       LYS  93  11.197   8.097  -9.892
  725   2HB   LYS  93          1HB       LYS  93   9.713   8.970 -10.246
  726   1HG   LYS  93          2HG       LYS  93  11.977  10.594  -9.283
  727   2HG   LYS  93          1HG       LYS  93  12.152   9.871 -10.882
  728   1HD   LYS  93          2HD       LYS  93   9.928  10.840 -11.479
  729   2HD   LYS  93          1HD       LYS  93   9.941  11.687  -9.930
  730   1HE   LYS  93          2HE       LYS  93  12.399  12.309 -10.997
  731   2HE   LYS  93          1HE       LYS  93  11.349  12.291 -12.413
  732   1HZ   LYS  93          1HZ       LYS  93  10.951  14.394 -11.769
  733   2HZ   LYS  93          2HZ       LYS  93  11.389  14.119 -10.157
  734   3HZ   LYS  93          3HZ       LYS  93   9.852  13.672 -10.704
  735    H    LYS  94           H        LYS  94   7.800   8.611  -7.947
  736    HA   LYS  94           HA       LYS  94   7.012  11.395  -8.041
  737   1HB   LYS  94          2HB       LYS  94   5.323   8.918  -7.644
  738   2HB   LYS  94          1HB       LYS  94   4.726  10.534  -7.997
  739   1HG   LYS  94          2HG       LYS  94   6.632   9.213  -9.875
  740   2HG   LYS  94          1HG       LYS  94   4.921   8.784  -9.898
  741   1HD   LYS  94          2HD       LYS  94   5.957  11.606 -10.125
  742   2HD   LYS  94          1HD       LYS  94   5.558  10.585 -11.509
  743   1HE   LYS  94          2HE       LYS  94   3.281  10.322 -10.170
  744   2HE   LYS  94          1HE       LYS  94   3.775  11.887  -9.523
  745   1HZ   LYS  94          1HZ       LYS  94   4.093  12.548 -11.939
  746   2HZ   LYS  94          2HZ       LYS  94   2.500  12.381 -11.396
  747   3HZ   LYS  94          3HZ       LYS  94   3.207  11.162 -12.332
  748    H    GLY  95           H        GLY  95   6.568   8.689  -5.743
  749   1HA   GLY  95          2HA       GLY  95   7.218  10.212  -3.475
  750   2HA   GLY  95          1HA       GLY  95   5.476  10.255  -3.680
  751    H    ALA  96           H        ALA  96   7.375   7.430  -4.566
  752    HA   ALA  96           HA       ALA  96   5.913   5.909  -2.565
  753   1HB   ALA  96          1HB       ALA  96   6.175   4.085  -3.870
  754   2HB   ALA  96          2HB       ALA  96   7.827   4.508  -4.317
  755   3HB   ALA  96          3HB       ALA  96   6.468   5.294  -5.118
  756    H    TYR  97           H        TYR  97   7.343   3.978  -1.655
  757    HA   TYR  97           HA       TYR  97   9.415   5.298  -0.125
  758   1HB   TYR  97          2HB       TYR  97   7.841   4.001   1.140
  759   2HB   TYR  97          1HB       TYR  97   8.117   2.587   0.132
  760    HD1  TYR  97           1HD      TYR  97  10.223   4.952   2.133
  761    HD2  TYR  97           2HD      TYR  97   9.311   0.913   1.157
  762    HE1  TYR  97           1HE      TYR  97  11.952   4.187   3.704
  763    HE2  TYR  97           2HE      TYR  97  11.036   0.136   2.725
  764    HH   TYR  97           HH       TYR  97  13.336   2.253   4.123
  765    H    GLU  98           H        GLU  98   9.152   3.096  -2.717
  766    HA   GLU  98           HA       GLU  98  11.541   3.183  -3.843
  767   1HB   GLU  98          2HB       GLU  98  12.896   1.280  -2.886
  768   2HB   GLU  98          1HB       GLU  98  12.818   2.724  -1.891
  769   1HG   GLU  98          2HG       GLU  98  11.489   1.714  -0.299
  770   2HG   GLU  98          1HG       GLU  98  10.874   0.511  -1.430
  771    H    PHE  99           H        PHE  99   8.892   1.238  -2.892
  772    HA   PHE  99           HA       PHE  99   7.652  -0.231  -4.145
  773   1HB   PHE  99          2HB       PHE  99   9.115   0.911  -6.114
  774   2HB   PHE  99          1HB       PHE  99   9.731  -0.736  -6.195
  775    HD1  PHE  99           1HD      PHE  99   8.452  -2.474  -7.137
  776    HD2  PHE  99           2HD      PHE  99   6.680   1.329  -6.420
  777    HE1  PHE  99           1HE      PHE  99   6.490  -3.140  -8.466
  778    HE2  PHE  99           2HE      PHE  99   4.718   0.669  -7.748
  779    HZ   PHE  99           HZ       PHE  99   4.621  -1.568  -8.772
  780    H    LEU 100           H        LEU 100   7.522  -2.059  -3.030
  781    HA   LEU 100           HA       LEU 100   9.580  -3.527  -1.940
  782   1HB   LEU 100          2HB       LEU 100   6.892  -3.648  -1.816
  783   2HB   LEU 100          1HB       LEU 100   7.200  -5.053  -2.817
  784    HG   LEU 100           HG       LEU 100   7.104  -5.881  -0.625
  785   1HD1  LEU 100          1HD1      LEU 100   9.114  -6.554  -2.012
  786   2HD1  LEU 100          2HD1      LEU 100   9.227  -6.833  -0.274
  787   3HD1  LEU 100          3HD1      LEU 100  10.053  -5.456  -1.002
  788   1HD2  LEU 100          1HD2      LEU 100   8.482  -3.350   0.054
  789   2HD2  LEU 100          2HD2      LEU 100   8.836  -4.756   1.058
  790   3HD2  LEU 100          3HD2      LEU 100   7.174  -4.191   0.887
  791    H    GLU 101           H        GLU 101  11.277  -4.004  -3.278
  792    HA   GLU 101           HA       GLU 101  10.762  -5.498  -5.735
  793   1HB   GLU 101          2HB       GLU 101  13.177  -4.111  -4.607
  794   2HB   GLU 101          1HB       GLU 101  13.332  -5.259  -5.930
  795   1HG   GLU 101          2HG       GLU 101  11.277  -3.191  -6.295
  796   2HG   GLU 101          1HG       GLU 101  12.941  -2.611  -6.245
  797    H    LYS 102           H        LYS 102  12.110  -7.409  -6.205
  798    HA   LYS 102           HA       LYS 102  12.779  -9.531  -5.738
  799   1HB   LYS 102          2HB       LYS 102  14.666  -8.370  -4.669
  800   2HB   LYS 102          1HB       LYS 102  13.760  -8.277  -3.166
  801   1HG   LYS 102          2HG       LYS 102  13.699 -10.961  -3.752
  802   2HG   LYS 102          1HG       LYS 102  15.308 -10.469  -4.287
  803   1HD   LYS 102          2HD       LYS 102  14.377  -9.486  -1.645
  804   2HD   LYS 102          1HD       LYS 102  14.802 -11.194  -1.776
  805   1HE   LYS 102          2HE       LYS 102  16.990 -10.516  -2.737
  806   2HE   LYS 102          1HE       LYS 102  16.557  -8.833  -2.439
  807   1HZ   LYS 102          1HZ       LYS 102  17.150 -10.960  -0.487
  808   2HZ   LYS 102          2HZ       LYS 102  16.217  -9.623  -0.035
  809   3HZ   LYS 102          3HZ       LYS 102  17.798  -9.402  -0.592
  810    HA   PRO 103           HA       PRO 103   9.113  -9.982  -2.785
  811   1HB   PRO 103          2HB       PRO 103   7.203 -10.646  -4.570
  812   2HB   PRO 103          1HB       PRO 103   7.573  -8.965  -4.168
  813   1HG   PRO 103          2HG       PRO 103   8.448 -10.584  -6.529
  814   2HG   PRO 103          1HG       PRO 103   7.870  -8.908  -6.474
  815   1HD   PRO 103          2HD       PRO 103  10.508  -9.572  -6.617
  816   2HD   PRO 103          1HD       PRO 103   9.920  -8.093  -5.833
  817    H    PHE 104           H        PHE 104   9.843 -11.857  -1.888
  818    HA   PHE 104           HA       PHE 104  10.130 -14.257  -3.482
  819   1HB   PHE 104          2HB       PHE 104  10.842 -13.418  -0.730
  820   2HB   PHE 104          1HB       PHE 104  10.504 -15.130  -0.958
  821    HD1  PHE 104           1HD      PHE 104  12.580 -12.337  -2.244
  822    HD2  PHE 104           2HD      PHE 104  12.122 -16.548  -1.842
  823    HE1  PHE 104           1HE      PHE 104  14.858 -12.664  -3.117
  824    HE2  PHE 104           2HE      PHE 104  14.399 -16.883  -2.712
  825    HZ   PHE 104           HZ       PHE 104  15.769 -14.940  -3.352
  826    H    SER 105           H        SER 105   7.872 -12.877  -1.205
  827    HA   SER 105           HA       SER 105   5.749 -14.521  -2.010
  828   1HB   SER 105          2HB       SER 105   6.898 -16.305  -0.815
  829   2HB   SER 105          1HB       SER 105   7.012 -15.301   0.629
  830    HG   SER 105           HG       SER 105   4.725 -15.326   0.725
  831    H    VAL 106           H        VAL 106   6.951 -13.057   1.012
  832    HA   VAL 106           HA       VAL 106   5.305 -10.811   0.942
  833    HB   VAL 106           HB       VAL 106   3.463 -12.458   1.178
  834   1HG1  VAL 106          1HG1      VAL 106   3.950 -12.981   4.006
  835   2HG1  VAL 106          2HG1      VAL 106   5.131 -13.739   2.938
  836   3HG1  VAL 106          3HG1      VAL 106   3.411 -14.068   2.727
  837   1HG2  VAL 106          1HG2      VAL 106   3.373 -11.053   3.763
  838   2HG2  VAL 106          2HG2      VAL 106   2.253 -11.004   2.402
  839   3HG2  VAL 106          3HG2      VAL 106   3.731 -10.043   2.361
  840    H    GLU 107           H        GLU 107   7.146 -13.127   2.796
  841    HA   GLU 107           HA       GLU 107   7.336 -11.897   5.253
  842   1HB   GLU 107          2HB       GLU 107   8.399 -14.093   4.312
  843   2HB   GLU 107          1HB       GLU 107   9.781 -13.054   3.993
  844   1HG   GLU 107          2HG       GLU 107   9.668 -12.380   6.424
  845   2HG   GLU 107          1HG       GLU 107   8.523 -13.703   6.637
  846    H    ARG 108           H        ARG 108   9.391 -11.338   2.399
  847    HA   ARG 108           HA       ARG 108  11.026  -9.360   3.494
  848   1HB   ARG 108          2HB       ARG 108  10.921 -10.615   1.101
  849   2HB   ARG 108          1HB       ARG 108  10.272  -9.046   0.647
  850   1HG   ARG 108          2HG       ARG 108  12.467  -8.629   0.292
  851   2HG   ARG 108          1HG       ARG 108  12.392  -8.204   2.003
  852   1HD   ARG 108          2HD       ARG 108  13.195 -10.904   0.928
  853   2HD   ARG 108          1HD       ARG 108  14.320  -9.648   1.435
  854    HE   ARG 108           HE       ARG 108  13.674  -9.993   3.670
  855   1HH1  ARG 108          1HH1      ARG 108  12.052 -12.186   1.479
  856   2HH1  ARG 108          2HH1      ARG 108  11.583 -13.281   2.734
  857   1HH2  ARG 108          1HH2      ARG 108  13.051 -11.435   5.310
  858   2HH2  ARG 108          2HH2      ARG 108  12.146 -12.856   4.906
  859    H    PHE 109           H        PHE 109   7.860  -9.144   1.968
  860    HA   PHE 109           HA       PHE 109   7.676  -6.350   1.772
  861   1HB   PHE 109          2HB       PHE 109   6.066  -7.615   0.586
  862   2HB   PHE 109          1HB       PHE 109   5.621  -8.544   2.011
  863    HD1  PHE 109           1HD      PHE 109   5.216  -5.369   0.243
  864    HD2  PHE 109           2HD      PHE 109   4.066  -7.674   3.631
  865    HE1  PHE 109           1HE      PHE 109   3.347  -3.826   0.653
  866    HE2  PHE 109           2HE      PHE 109   2.193  -6.134   4.046
  867    HZ   PHE 109           HZ       PHE 109   1.833  -4.207   2.557
  868    H    LEU 110           H        LEU 110   7.273  -8.535   4.453
  869    HA   LEU 110           HA       LEU 110   5.912  -6.744   6.184
  870   1HB   LEU 110          2HB       LEU 110   6.524  -9.393   6.234
  871   2HB   LEU 110          1HB       LEU 110   7.628  -8.753   7.435
  872    HG   LEU 110           HG       LEU 110   4.729  -8.032   7.559
  873   1HD1  LEU 110          1HD1      LEU 110   5.725 -10.408   9.050
  874   2HD1  LEU 110          2HD1      LEU 110   5.229 -10.603   7.369
  875   3HD1  LEU 110          3HD1      LEU 110   4.084  -9.987   8.561
  876   1HD2  LEU 110          1HD2      LEU 110   6.786  -7.145   8.987
  877   2HD2  LEU 110          2HD2      LEU 110   6.437  -8.604   9.914
  878   3HD2  LEU 110          3HD2      LEU 110   5.185  -7.382   9.689
  879    H    LEU 111           H        LEU 111   9.319  -7.654   5.825
  880    HA   LEU 111           HA       LEU 111  10.441  -6.256   7.908
  881   1HB   LEU 111          2HB       LEU 111  11.440  -6.873   5.158
  882   2HB   LEU 111          1HB       LEU 111  12.422  -5.955   6.282
  883    HG   LEU 111           HG       LEU 111  11.642  -8.167   7.763
  884   1HD1  LEU 111          1HD1      LEU 111  10.819  -9.160   5.624
  885   2HD1  LEU 111          2HD1      LEU 111  12.070 -10.100   6.437
  886   3HD1  LEU 111          3HD1      LEU 111  12.479  -9.117   5.031
  887   1HD2  LEU 111          1HD2      LEU 111  13.925  -6.869   7.230
  888   2HD2  LEU 111          2HD2      LEU 111  14.197  -8.335   6.289
  889   3HD2  LEU 111          3HD2      LEU 111  13.872  -8.445   8.020
  890    H    THR 112           H        THR 112   9.562  -5.026   4.705
  891    HA   THR 112           HA       THR 112  10.591  -2.415   5.123
  892    HB   THR 112           HB       THR 112   8.518  -3.461   3.181
  893    HG1  THR 112           1HG      THR 112  11.234  -2.780   2.755
  894   1HG2  THR 112          1HG2      THR 112   9.762  -1.253   2.052
  895   2HG2  THR 112          2HG2      THR 112   9.337  -0.745   3.687
  896   3HG2  THR 112          3HG2      THR 112   8.091  -1.367   2.606
  897    H    ILE 113           H        ILE 113   7.329  -3.799   5.359
  898    HA   ILE 113           HA       ILE 113   5.804  -1.602   5.864
  899    HB   ILE 113           HB       ILE 113   5.669  -4.398   6.919
  900   1HG1  ILE 113          2HG1      ILE 113   4.981  -3.884   4.605
  901   2HG1  ILE 113          1HG1      ILE 113   3.636  -4.472   5.577
  902   1HG2  ILE 113          1HG2      ILE 113   4.101  -2.065   7.918
  903   2HG2  ILE 113          2HG2      ILE 113   4.747  -3.449   8.800
  904   3HG2  ILE 113          3HG2      ILE 113   3.321  -3.641   7.780
  905   1HD1  ILE 113          1HD1      ILE 113   4.186  -1.655   4.698
  906   2HD1  ILE 113          2HD1      ILE 113   2.986  -2.069   5.923
  907   3HD1  ILE 113          3HD1      ILE 113   2.816  -2.684   4.278
  908    H    LYS 114           H        LYS 114   7.354  -3.516   8.451
  909    HA   LYS 114           HA       LYS 114   6.721  -1.984  10.617
  910   1HB   LYS 114          2HB       LYS 114   7.995  -4.128  10.663
  911   2HB   LYS 114          1HB       LYS 114   9.426  -3.245  10.149
  912   1HG   LYS 114          2HG       LYS 114   7.983  -2.338  12.588
  913   2HG   LYS 114          1HG       LYS 114   8.996  -3.780  12.677
  914   1HD   LYS 114          2HD       LYS 114  10.820  -2.517  12.809
  915   2HD   LYS 114          1HD       LYS 114  10.422  -1.746  11.273
  916   1HE   LYS 114          2HE       LYS 114  10.556   0.022  12.804
  917   2HE   LYS 114          1HE       LYS 114   8.828  -0.278  12.620
  918   1HZ   LYS 114          1HZ       LYS 114   9.857  -0.003  14.970
  919   2HZ   LYS 114          2HZ       LYS 114  10.301  -1.625  14.779
  920   3HZ   LYS 114          3HZ       LYS 114   8.670  -1.179  14.708
  921    H    HIS 115           H        HIS 115   9.652  -1.622   8.635
  922    HA   HIS 115           HA       HIS 115  10.571   0.722   9.863
  923   1HB   HIS 115          2HB       HIS 115  11.005  -0.171   7.006
  924   2HB   HIS 115          1HB       HIS 115  11.983   1.000   7.884
  925    HD1  HIS 115           1HD      HIS 115  12.360  -2.218   6.755
  926    HD2  HIS 115           2HD      HIS 115  12.777  -0.545  10.536
  927    HE1  HIS 115           1HE      HIS 115  13.841  -3.801   8.031
  928    HE2  HIS 115           2HE      HIS 115  14.014  -2.809  10.340
  929    H    ALA 116           H        ALA 116   8.154   0.194   7.400
  930    HA   ALA 116           HA       ALA 116   8.033   2.788   6.327
  931   1HB   ALA 116          1HB       ALA 116   5.543   1.183   6.604
  932   2HB   ALA 116          2HB       ALA 116   6.861   0.536   5.629
  933   3HB   ALA 116          3HB       ALA 116   6.150   2.098   5.225
  934    H    PHE 117           H        PHE 117   6.536   1.345   9.169
  935    HA   PHE 117           HA       PHE 117   4.874   3.587   9.759
  936   1HB   PHE 117          2HB       PHE 117   5.697   1.122  11.258
  937   2HB   PHE 117          1HB       PHE 117   4.834   2.412  12.087
  938    HD1  PHE 117           1HD      PHE 117   4.120  -0.602  11.262
  939    HD2  PHE 117           2HD      PHE 117   3.009   3.264   9.873
  940    HE1  PHE 117           1HE      PHE 117   1.983  -1.503  10.437
  941    HE2  PHE 117           2HE      PHE 117   0.881   2.359   9.045
  942    HZ   PHE 117           HZ       PHE 117   0.363  -0.026   9.334
  943    H    GLU 118           H        GLU 118   8.193   2.940  10.189
  944    HA   GLU 118           HA       GLU 118   8.793   4.294  12.540
  945   1HB   GLU 118          2HB       GLU 118  10.279   2.916  10.890
  946   2HB   GLU 118          1HB       GLU 118  10.606   4.492  10.180
  947   1HG   GLU 118          2HG       GLU 118  11.184   5.200  12.590
  948   2HG   GLU 118          1HG       GLU 118  11.293   3.468  12.901
  949    H    GLU 119           H        GLU 119   7.743   5.527   9.503
  950    HA   GLU 119           HA       GLU 119   8.654   8.231  10.125
  951   1HB   GLU 119          2HB       GLU 119   7.105   7.337   7.696
  952   2HB   GLU 119          1HB       GLU 119   8.038   8.815   7.892
  953   1HG   GLU 119          2HG       GLU 119  10.076   7.691   7.738
  954   2HG   GLU 119          1HG       GLU 119   9.335   6.120   8.046
  955    H    TYR 120           H        TYR 120   6.663   7.048  11.811
  956    HA   TYR 120           HA       TYR 120   4.492   8.969  11.357
  957   1HB   TYR 120          2HB       TYR 120   3.732   6.719  10.628
  958   2HB   TYR 120          1HB       TYR 120   4.069   6.107  12.244
  959    HD1  TYR 120           1HD      TYR 120   1.969   5.511  13.072
  960    HD2  TYR 120           2HD      TYR 120   2.478   9.324  11.256
  961    HE1  TYR 120           1HE      TYR 120  -0.296   6.147  13.787
  962    HE2  TYR 120           2HE      TYR 120   0.215   9.972  11.967
  963    HH   TYR 120           HH       TYR 120  -2.015   8.530  12.552
  964    H    SER 121           H        SER 121   6.879   8.887  13.111
  965    HA   SER 121           HA       SER 121   5.471   9.146  15.685
  966   1HB   SER 121          2HB       SER 121   8.360   8.318  15.519
  967   2HB   SER 121          1HB       SER 121   7.237   8.144  16.868
  968    HG   SER 121           HG       SER 121   7.433   6.630  14.507
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1  -3.568   0.534  16.992
    2   2H    MET   1          2HT       MET   1  -3.631   1.414  15.519
    3   3H    MET   1          3HT       MET   1  -3.361   2.236  17.001
    4    HA   MET   1           HA       MET   1  -1.305   2.142  16.069
    5   1HB   MET   1          2HB       MET   1  -1.969   0.386  18.272
    6   2HB   MET   1          1HB       MET   1  -0.554  -0.209  17.413
    7   1HG   MET   1          2HG       MET   1   0.739   1.530  18.046
    8   2HG   MET   1          1HG       MET   1  -0.602   2.674  18.042
    9   1HE   MET   1          1HE       MET   1   1.156   3.090  21.047
   10   2HE   MET   1          2HE       MET   1   1.870   2.127  19.754
   11   3HE   MET   1          3HE       MET   1   1.632   1.420  21.351
   12    H    LYS   2           H        LYS   2  -0.223   1.552  14.305
   13    HA   LYS   2           HA       LYS   2   0.468   0.381  12.483
   14   1HB   LYS   2          2HB       LYS   2   0.187  -1.644  14.590
   15   2HB   LYS   2          1HB       LYS   2   0.188  -2.270  12.949
   16   1HG   LYS   2          2HG       LYS   2   2.423  -2.329  13.721
   17   2HG   LYS   2          1HG       LYS   2   2.312  -1.002  12.565
   18   1HD   LYS   2          2HD       LYS   2   2.484   0.617  14.207
   19   2HD   LYS   2          1HD       LYS   2   1.910  -0.466  15.477
   20   1HE   LYS   2          2HE       LYS   2   3.994  -1.026  16.005
   21   2HE   LYS   2          1HE       LYS   2   4.329  -1.504  14.341
   22   1HZ   LYS   2          1HZ       LYS   2   5.841   0.218  15.033
   23   2HZ   LYS   2          2HZ       LYS   2   4.560   1.239  15.455
   24   3HZ   LYS   2          3HZ       LYS   2   4.813   0.827  13.835
   25    H    ARG   3           H        ARG   3  -1.004   0.892  10.938
   26    HA   ARG   3           HA       ARG   3  -3.032  -1.120  10.360
   27   1HB   ARG   3          2HB       ARG   3  -3.855   1.759  10.216
   28   2HB   ARG   3          1HB       ARG   3  -4.864   0.322  10.291
   29   1HG   ARG   3          2HG       ARG   3  -5.147   1.190  12.393
   30   2HG   ARG   3          1HG       ARG   3  -3.824   0.055  12.665
   31   1HD   ARG   3          2HD       ARG   3  -2.483   1.698  13.328
   32   2HD   ARG   3          1HD       ARG   3  -2.778   2.597  11.840
   33    HE   ARG   3           HE       ARG   3  -4.010   3.027  14.411
   34   1HH1  ARG   3          1HH1      ARG   3  -4.270   3.546  10.969
   35   2HH1  ARG   3          2HH1      ARG   3  -5.310   4.920  11.129
   36   1HH2  ARG   3          1HH2      ARG   3  -5.376   4.835  14.623
   37   2HH2  ARG   3          2HH2      ARG   3  -5.936   5.655  13.203
   38    H    VAL   4           H        VAL   4  -1.646  -1.641   8.610
   39    HA   VAL   4           HA       VAL   4  -1.011   0.364   6.636
   40    HB   VAL   4           HB       VAL   4  -0.676  -2.628   6.410
   41   1HG1  VAL   4          1HG1      VAL   4   1.366  -1.427   5.040
   42   2HG1  VAL   4          2HG1      VAL   4   0.015  -0.338   4.728
   43   3HG1  VAL   4          3HG1      VAL   4  -0.118  -2.049   4.320
   44   1HG2  VAL   4          1HG2      VAL   4   1.289  -0.586   7.457
   45   2HG2  VAL   4          2HG2      VAL   4   1.594  -2.309   7.238
   46   3HG2  VAL   4          3HG2      VAL   4   0.421  -1.766   8.438
   47    H    LEU   5           H        LEU   5  -1.819   0.498   4.532
   48    HA   LEU   5           HA       LEU   5  -4.438  -0.784   4.159
   49   1HB   LEU   5          2HB       LEU   5  -4.426   1.683   4.223
   50   2HB   LEU   5          1HB       LEU   5  -3.337   1.702   2.848
   51    HG   LEU   5           HG       LEU   5  -5.130   0.510   1.531
   52   1HD1  LEU   5          1HD1      LEU   5  -6.742  -0.394   2.797
   53   2HD1  LEU   5          2HD1      LEU   5  -7.444   1.223   2.768
   54   3HD1  LEU   5          3HD1      LEU   5  -6.455   0.715   4.136
   55   1HD2  LEU   5          1HD2      LEU   5  -6.622   2.655   1.520
   56   2HD2  LEU   5          2HD2      LEU   5  -4.950   2.732   0.964
   57   3HD2  LEU   5          3HD2      LEU   5  -5.368   3.291   2.583
   58    H    VAL   6           H        VAL   6  -4.914  -1.927   2.359
   59    HA   VAL   6           HA       VAL   6  -2.709  -2.392   0.455
   60    HB   VAL   6           HB       VAL   6  -4.896  -4.346   1.165
   61   1HG1  VAL   6          1HG1      VAL   6  -3.895  -4.656  -1.047
   62   2HG1  VAL   6          2HG1      VAL   6  -3.485  -5.980   0.042
   63   3HG1  VAL   6          3HG1      VAL   6  -2.294  -4.729  -0.312
   64   1HG2  VAL   6          1HG2      VAL   6  -3.753  -5.069   2.933
   65   2HG2  VAL   6          2HG2      VAL   6  -2.817  -3.579   2.819
   66   3HG2  VAL   6          3HG2      VAL   6  -2.226  -5.052   2.051
   67    H    VAL   7           H        VAL   7  -3.182  -2.557  -1.728
   68    HA   VAL   7           HA       VAL   7  -5.950  -2.007  -2.544
   69    HB   VAL   7           HB       VAL   7  -3.575  -0.683  -3.856
   70   1HG1  VAL   7          1HG1      VAL   7  -5.818  -1.097  -5.063
   71   2HG1  VAL   7          2HG1      VAL   7  -5.100   0.512  -5.132
   72   3HG1  VAL   7          3HG1      VAL   7  -6.432   0.188  -4.023
   73   1HG2  VAL   7          1HG2      VAL   7  -5.509   0.641  -1.968
   74   2HG2  VAL   7          2HG2      VAL   7  -4.049   1.327  -2.683
   75   3HG2  VAL   7          3HG2      VAL   7  -3.923   0.049  -1.474
   76    H    ASP   8           H        ASP   8  -6.629  -3.520  -3.915
   77    HA   ASP   8           HA       ASP   8  -4.907  -4.477  -6.024
   78   1HB   ASP   8          2HB       ASP   8  -4.143  -5.974  -4.336
   79   2HB   ASP   8          1HB       ASP   8  -5.776  -6.273  -3.755
   80    H    ASP   9           H        ASP   9  -6.042  -5.518  -7.687
   81    HA   ASP   9           HA       ASP   9  -8.854  -4.865  -7.762
   82   1HB   ASP   9          2HB       ASP   9  -7.446  -4.379  -9.702
   83   2HB   ASP   9          1HB       ASP   9  -7.048  -6.084  -9.865
   84    H    GLU  10           H        GLU  10  -8.585  -6.723  -5.862
   85    HA   GLU  10           HA       GLU  10  -9.797  -9.106  -7.084
   86   1HB   GLU  10          2HB       GLU  10  -7.323  -9.195  -6.016
   87   2HB   GLU  10          1HB       GLU  10  -8.277  -9.500  -4.572
   88   1HG   GLU  10          2HG       GLU  10  -9.332 -11.130  -6.614
   89   2HG   GLU  10          1HG       GLU  10  -7.577 -11.284  -6.681
   90    H    GLU  11           H        GLU  11 -10.465 -10.466  -4.779
   91    HA   GLU  11           HA       GLU  11 -12.354  -8.600  -3.501
   92   1HB   GLU  11          2HB       GLU  11 -13.839 -10.514  -3.173
   93   2HB   GLU  11          1HB       GLU  11 -13.445 -10.312  -4.875
   94   1HG   GLU  11          2HG       GLU  11 -11.854 -12.123  -4.762
   95   2HG   GLU  11          1HG       GLU  11 -12.125 -12.287  -3.028
   96    H    SER  12           H        SER  12 -12.333  -8.386  -1.344
   97    HA   SER  12           HA       SER  12 -11.652  -8.561   0.820
   98   1HB   SER  12          2HB       SER  12 -11.786 -10.679   1.822
   99   2HB   SER  12          1HB       SER  12 -12.822 -10.835   0.403
  100    HG   SER  12           HG       SER  12 -10.223 -11.845   0.824
  101    H    ILE  13           H        ILE  13  -9.808  -9.133   2.257
  102    HA   ILE  13           HA       ILE  13  -7.456  -8.140   1.639
  103    HB   ILE  13           HB       ILE  13  -7.324 -10.762   3.070
  104   1HG1  ILE  13          2HG1      ILE  13  -9.325  -9.720   3.970
  105   2HG1  ILE  13          1HG1      ILE  13  -8.024  -9.586   5.146
  106   1HG2  ILE  13          1HG2      ILE  13  -5.231  -9.883   3.088
  107   2HG2  ILE  13          2HG2      ILE  13  -5.875  -9.118   4.541
  108   3HG2  ILE  13          3HG2      ILE  13  -5.807  -8.218   3.027
  109   1HD1  ILE  13          1HD1      ILE  13  -7.682  -7.286   4.596
  110   2HD1  ILE  13          2HD1      ILE  13  -9.395  -7.545   4.926
  111   3HD1  ILE  13          3HD1      ILE  13  -8.831  -7.390   3.262
  112    H    THR  14           H        THR  14  -5.345  -8.906   1.093
  113    HA   THR  14           HA       THR  14  -5.412 -10.660  -1.210
  114    HB   THR  14           HB       THR  14  -3.221  -9.845  -1.714
  115    HG1  THR  14           1HG      THR  14  -3.175  -8.613   0.834
  116   1HG2  THR  14          1HG2      THR  14  -3.454  -7.451  -1.743
  117   2HG2  THR  14          2HG2      THR  14  -4.707  -7.524  -0.505
  118   3HG2  THR  14          3HG2      THR  14  -5.010  -8.199  -2.106
  119    H    SER  15           H        SER  15  -4.900 -12.726  -1.155
  120    HA   SER  15           HA       SER  15  -4.548 -14.295   1.003
  121   1HB   SER  15          2HB       SER  15  -3.370 -14.677  -1.751
  122   2HB   SER  15          1HB       SER  15  -3.390 -15.938  -0.518
  123    HG   SER  15           HG       SER  15  -5.346 -15.197  -2.183
  124    H    SER  16           H        SER  16  -3.036 -14.876   2.413
  125    HA   SER  16           HA       SER  16  -1.010 -15.174   3.418
  126   1HB   SER  16          2HB       SER  16  -0.146 -15.504   1.048
  127   2HB   SER  16          1HB       SER  16   0.350 -13.813   1.107
  128    HG   SER  16           HG       SER  16   1.709 -14.292   2.809
  129    H    LEU  17           H        LEU  17  -2.324 -12.211   2.531
  130    HA   LEU  17           HA       LEU  17  -0.347 -10.613   3.945
  131   1HB   LEU  17          2HB       LEU  17  -1.823 -10.042   1.805
  132   2HB   LEU  17          1HB       LEU  17  -2.961  -9.511   3.021
  133    HG   LEU  17           HG       LEU  17  -0.960  -7.994   1.860
  134   1HD1  LEU  17          1HD1      LEU  17  -2.775  -6.864   2.658
  135   2HD1  LEU  17          2HD1      LEU  17  -1.567  -6.444   3.872
  136   3HD1  LEU  17          3HD1      LEU  17  -2.760  -7.698   4.209
  137   1HD2  LEU  17          1HD2      LEU  17   0.566  -7.381   3.648
  138   2HD2  LEU  17          2HD2      LEU  17   0.749  -9.085   3.240
  139   3HD2  LEU  17          3HD2      LEU  17  -0.128  -8.619   4.694
  140    H    SER  18           H        SER  18  -3.848 -11.252   4.211
  141    HA   SER  18           HA       SER  18  -4.356  -9.926   6.575
  142   1HB   SER  18          2HB       SER  18  -5.927 -11.280   4.951
  143   2HB   SER  18          1HB       SER  18  -5.655 -12.583   6.107
  144    HG   SER  18           HG       SER  18  -6.384 -11.117   7.748
  145    H    ALA  19           H        ALA  19  -3.419 -13.347   6.213
  146    HA   ALA  19           HA       ALA  19  -3.331 -13.992   8.924
  147   1HB   ALA  19          1HB       ALA  19  -2.970 -15.392   6.659
  148   2HB   ALA  19          2HB       ALA  19  -2.512 -15.989   8.254
  149   3HB   ALA  19          3HB       ALA  19  -1.298 -15.261   7.203
  150    H    ILE  20           H        ILE  20  -0.854 -12.609   6.820
  151    HA   ILE  20           HA       ILE  20   1.295 -12.722   8.614
  152    HB   ILE  20           HB       ILE  20   0.690 -10.968   6.246
  153   1HG1  ILE  20          2HG1      ILE  20   2.900 -12.960   6.769
  154   2HG1  ILE  20          1HG1      ILE  20   1.378 -13.354   5.975
  155   1HG2  ILE  20          1HG2      ILE  20   2.844 -10.600   8.268
  156   2HG2  ILE  20          2HG2      ILE  20   1.964  -9.400   7.323
  157   3HG2  ILE  20          3HG2      ILE  20   3.238 -10.355   6.566
  158   1HD1  ILE  20          1HD1      ILE  20   3.586 -11.582   4.999
  159   2HD1  ILE  20          2HD1      ILE  20   1.969 -11.550   4.296
  160   3HD1  ILE  20          3HD1      ILE  20   2.922 -13.033   4.250
  161    H    LEU  21           H        LEU  21  -0.562  -9.776   7.774
  162    HA   LEU  21           HA       LEU  21   0.372  -8.168   9.810
  163   1HB   LEU  21          2HB       LEU  21  -2.398  -8.215   8.627
  164   2HB   LEU  21          1HB       LEU  21  -1.706  -6.885   9.537
  165    HG   LEU  21           HG       LEU  21  -0.012  -7.671   7.315
  166   1HD1  LEU  21          1HD1      LEU  21  -1.623  -8.105   5.832
  167   2HD1  LEU  21          2HD1      LEU  21  -1.874  -6.360   5.836
  168   3HD1  LEU  21          3HD1      LEU  21  -2.883  -7.399   6.841
  169   1HD2  LEU  21          1HD2      LEU  21  -0.440  -5.455   8.847
  170   2HD2  LEU  21          2HD2      LEU  21  -1.238  -5.019   7.335
  171   3HD2  LEU  21          3HD2      LEU  21   0.462  -5.486   7.331
  172    H    GLU  22           H        GLU  22  -2.116 -10.631   9.896
  173    HA   GLU  22           HA       GLU  22  -3.147  -9.989  12.460
  174   1HB   GLU  22          2HB       GLU  22  -3.312 -12.360  10.656
  175   2HB   GLU  22          1HB       GLU  22  -3.862 -12.501  12.319
  176   1HG   GLU  22          2HG       GLU  22  -5.094 -10.213  11.547
  177   2HG   GLU  22          1HG       GLU  22  -5.075 -11.124  10.038
  178    H    GLU  23           H        GLU  23  -0.379 -11.763  11.343
  179    HA   GLU  23           HA       GLU  23   0.076 -13.094  13.863
  180   1HB   GLU  23          2HB       GLU  23   0.845 -14.303  11.992
  181   2HB   GLU  23          1HB       GLU  23   1.592 -12.885  11.271
  182   1HG   GLU  23          2HG       GLU  23   3.512 -13.218  12.338
  183   2HG   GLU  23          1HG       GLU  23   2.707 -13.557  13.870
  184    H    GLU  24           H        GLU  24   1.186 -10.236  12.166
  185    HA   GLU  24           HA       GLU  24   3.234  -9.631  14.099
  186   1HB   GLU  24          2HB       GLU  24   2.117  -8.164  11.725
  187   2HB   GLU  24          1HB       GLU  24   3.288  -7.424  12.810
  188   1HG   GLU  24          2HG       GLU  24   3.817 -10.060  11.488
  189   2HG   GLU  24          1HG       GLU  24   4.154  -8.530  10.681
  190    H    GLY  25           H        GLY  25  -0.112  -8.833  13.585
  191   1HA   GLY  25          2HA       GLY  25  -1.540  -8.020  15.274
  192   2HA   GLY  25          1HA       GLY  25  -0.132  -7.421  16.138
  193    H    TYR  26           H        TYR  26  -1.648  -6.914  12.953
  194    HA   TYR  26           HA       TYR  26  -1.367  -4.010  13.393
  195   1HB   TYR  26          2HB       TYR  26  -0.978  -5.670  10.921
  196   2HB   TYR  26          1HB       TYR  26  -1.384  -3.967  10.799
  197    HD1  TYR  26           1HD      TYR  26   0.429  -2.695  10.239
  198    HD2  TYR  26           2HD      TYR  26   0.985  -5.945  12.925
  199    HE1  TYR  26           1HE      TYR  26   2.804  -2.106  10.448
  200    HE2  TYR  26           2HE      TYR  26   3.364  -5.363  13.141
  201    HH   TYR  26           HH       TYR  26   5.097  -4.058  11.523
  202    H    HIS  27           H        HIS  27  -2.797  -2.935  11.518
  203    HA   HIS  27           HA       HIS  27  -5.486  -4.124  11.619
  204   1HB   HIS  27          2HB       HIS  27  -4.762  -1.839  12.985
  205   2HB   HIS  27          1HB       HIS  27  -5.397  -1.183  11.479
  206    HD1  HIS  27           1HD      HIS  27  -6.806  -4.264  13.122
  207    HD2  HIS  27           2HD      HIS  27  -7.771  -0.262  12.552
  208    HE1  HIS  27           1HE      HIS  27  -9.189  -4.031  13.893
  209    HE2  HIS  27           2HE      HIS  27  -9.774  -1.616  13.474
  210    HA   PRO  28           HA       PRO  28  -4.224  -3.245   7.303
  211   1HB   PRO  28          2HB       PRO  28  -4.648  -5.675   6.279
  212   2HB   PRO  28          1HB       PRO  28  -3.202  -5.305   7.225
  213   1HG   PRO  28          2HG       PRO  28  -5.686  -6.748   8.043
  214   2HG   PRO  28          1HG       PRO  28  -3.999  -7.097   8.456
  215   1HD   PRO  28          2HD       PRO  28  -5.793  -5.751  10.085
  216   2HD   PRO  28          1HD       PRO  28  -4.030  -5.666  10.232
  217    H    ASP  29           H        ASP  29  -5.404  -2.768   5.553
  218    HA   ASP  29           HA       ASP  29  -8.190  -3.635   5.376
  219   1HB   ASP  29          2HB       ASP  29  -8.186  -1.415   6.499
  220   2HB   ASP  29          1HB       ASP  29  -7.310  -0.749   5.126
  221    H    THR  30           H        THR  30  -8.769  -4.073   3.269
  222    HA   THR  30           HA       THR  30  -6.818  -3.284   1.211
  223    HB   THR  30           HB       THR  30  -7.048  -5.396   0.145
  224    HG1  THR  30           1HG      THR  30  -9.191  -5.785   1.942
  225   1HG2  THR  30          1HG2      THR  30  -5.824  -6.595   1.562
  226   2HG2  THR  30          2HG2      THR  30  -7.068  -6.563   2.809
  227   3HG2  THR  30          3HG2      THR  30  -5.962  -5.203   2.636
  228    H    ALA  31           H        ALA  31  -7.553  -2.373  -0.591
  229    HA   ALA  31           HA       ALA  31 -10.457  -2.039  -0.866
  230   1HB   ALA  31          1HB       ALA  31  -8.956  -0.019  -0.657
  231   2HB   ALA  31          2HB       ALA  31 -10.031  -0.033  -2.055
  232   3HB   ALA  31          3HB       ALA  31  -8.323  -0.429  -2.251
  233    H    LYS  32           H        LYS  32 -10.485  -1.264  -3.571
  234    HA   LYS  32           HA       LYS  32  -9.826  -3.825  -4.866
  235   1HB   LYS  32          2HB       LYS  32 -11.904  -1.928  -5.916
  236   2HB   LYS  32          1HB       LYS  32 -11.748  -3.657  -6.193
  237   1HG   LYS  32          2HG       LYS  32 -12.465  -4.124  -3.935
  238   2HG   LYS  32          1HG       LYS  32 -12.514  -2.399  -3.567
  239   1HD   LYS  32          2HD       LYS  32 -14.322  -2.049  -5.088
  240   2HD   LYS  32          1HD       LYS  32 -14.168  -3.685  -5.733
  241   1HE   LYS  32          2HE       LYS  32 -14.552  -3.684  -2.859
  242   2HE   LYS  32          1HE       LYS  32 -15.861  -2.854  -3.698
  243   1HZ   LYS  32          1HZ       LYS  32 -16.580  -4.751  -4.637
  244   2HZ   LYS  32          2HZ       LYS  32 -15.785  -5.483  -3.336
  245   3HZ   LYS  32          3HZ       LYS  32 -15.026  -5.388  -4.845
  246    H    THR  33           H        THR  33  -9.642  -0.350  -5.111
  247    HA   THR  33           HA       THR  33  -7.495  -0.528  -6.996
  248    HB   THR  33           HB       THR  33  -9.660   1.178  -8.078
  249    HG1  THR  33           1HG      THR  33 -10.716  -0.559  -9.026
  250   1HG2  THR  33          1HG2      THR  33  -7.400  -0.409  -9.114
  251   2HG2  THR  33          2HG2      THR  33  -7.973   1.194  -9.573
  252   3HG2  THR  33          3HG2      THR  33  -8.813  -0.244 -10.156
  253    H    LEU  34           H        LEU  34  -7.218   1.954  -7.887
  254    HA   LEU  34           HA       LEU  34  -6.464   3.413  -5.595
  255   1HB   LEU  34          2HB       LEU  34  -6.820   4.490  -8.391
  256   2HB   LEU  34          1HB       LEU  34  -5.818   5.168  -7.120
  257    HG   LEU  34           HG       LEU  34  -5.309   2.421  -8.236
  258   1HD1  LEU  34          1HD1      LEU  34  -3.415   3.840  -9.438
  259   2HD1  LEU  34          2HD1      LEU  34  -4.676   5.072  -9.397
  260   3HD1  LEU  34          3HD1      LEU  34  -4.978   3.526 -10.190
  261   1HD2  LEU  34          1HD2      LEU  34  -4.328   3.303  -6.025
  262   2HD2  LEU  34          2HD2      LEU  34  -3.327   4.329  -7.053
  263   3HD2  LEU  34          3HD2      LEU  34  -3.233   2.574  -7.200
  264    H    ARG  35           H        ARG  35  -9.218   3.686  -7.795
  265    HA   ARG  35           HA       ARG  35 -10.296   6.060  -6.744
  266   1HB   ARG  35          2HB       ARG  35 -11.658   3.711  -8.076
  267   2HB   ARG  35          1HB       ARG  35 -12.452   5.240  -7.721
  268   1HG   ARG  35          2HG       ARG  35 -10.178   5.989  -9.100
  269   2HG   ARG  35          1HG       ARG  35 -10.708   4.518  -9.917
  270   1HD   ARG  35          2HD       ARG  35 -11.996   5.991 -11.059
  271   2HD   ARG  35          1HD       ARG  35 -13.068   5.746  -9.682
  272    HE   ARG  35           HE       ARG  35 -12.682   7.908  -9.039
  273   1HH1  ARG  35          1HH1      ARG  35 -10.257   6.975 -11.370
  274   2HH1  ARG  35          2HH1      ARG  35  -9.606   8.572 -11.516
  275   1HH2  ARG  35          1HH2      ARG  35 -11.827  10.008  -9.233
  276   2HH2  ARG  35          2HH2      ARG  35 -10.499  10.295 -10.307
  277    H    GLU  36           H        GLU  36 -10.869   2.655  -5.949
  278    HA   GLU  36           HA       GLU  36 -12.794   3.127  -3.932
  279   1HB   GLU  36          2HB       GLU  36 -11.204   0.841  -4.895
  280   2HB   GLU  36          1HB       GLU  36 -11.655   0.756  -3.198
  281   1HG   GLU  36          2HG       GLU  36 -13.310  -0.378  -4.485
  282   2HG   GLU  36          1HG       GLU  36 -14.014   1.112  -3.860
  283    H    ALA  37           H        ALA  37  -9.275   2.859  -3.908
  284    HA   ALA  37           HA       ALA  37  -8.927   2.825  -1.106
  285   1HB   ALA  37          1HB       ALA  37  -6.849   4.178  -2.704
  286   2HB   ALA  37          2HB       ALA  37  -7.256   2.538  -3.208
  287   3HB   ALA  37          3HB       ALA  37  -6.713   2.845  -1.559
  288    H    GLU  38           H        GLU  38  -8.623   5.535  -3.421
  289    HA   GLU  38           HA       GLU  38  -8.173   7.595  -1.681
  290   1HB   GLU  38          2HB       GLU  38  -9.869   7.576  -4.177
  291   2HB   GLU  38          1HB       GLU  38  -9.388   9.044  -3.336
  292   1HG   GLU  38          2HG       GLU  38  -7.078   8.621  -3.783
  293   2HG   GLU  38          1HG       GLU  38  -7.450   7.031  -4.446
  294    H    LYS  39           H        LYS  39 -11.278   6.112  -2.496
  295    HA   LYS  39           HA       LYS  39 -12.936   7.890  -1.096
  296   1HB   LYS  39          2HB       LYS  39 -13.849   6.265  -2.657
  297   2HB   LYS  39          1HB       LYS  39 -13.279   4.938  -1.657
  298   1HG   LYS  39          2HG       LYS  39 -15.081   6.881  -0.356
  299   2HG   LYS  39          1HG       LYS  39 -15.790   5.849  -1.601
  300   1HD   LYS  39          2HD       LYS  39 -14.936   3.869  -0.426
  301   2HD   LYS  39          1HD       LYS  39 -14.260   4.912   0.827
  302   1HE   LYS  39          2HE       LYS  39 -17.138   5.231   0.201
  303   2HE   LYS  39          1HE       LYS  39 -16.657   3.758   1.042
  304   1HZ   LYS  39          1HZ       LYS  39 -17.231   6.027   2.287
  305   2HZ   LYS  39          2HZ       LYS  39 -15.565   6.244   2.082
  306   3HZ   LYS  39          3HZ       LYS  39 -16.147   4.887   2.908
  307    H    LYS  40           H        LYS  40 -11.253   4.954  -0.089
  308    HA   LYS  40           HA       LYS  40 -12.248   4.994   2.586
  309   1HB   LYS  40          2HB       LYS  40 -10.091   3.491   1.155
  310   2HB   LYS  40          1HB       LYS  40 -10.224   3.398   2.906
  311   1HG   LYS  40          2HG       LYS  40 -12.738   2.952   1.468
  312   2HG   LYS  40          1HG       LYS  40 -11.484   1.748   1.163
  313   1HD   LYS  40          2HD       LYS  40 -11.214   1.583   3.673
  314   2HD   LYS  40          1HD       LYS  40 -12.688   2.543   3.805
  315   1HE   LYS  40          2HE       LYS  40 -13.887   0.843   2.492
  316   2HE   LYS  40          1HE       LYS  40 -12.413  -0.123   2.420
  317   1HZ   LYS  40          1HZ       LYS  40 -14.148   0.436   4.733
  318   2HZ   LYS  40          2HZ       LYS  40 -12.521   0.039   4.975
  319   3HZ   LYS  40          3HZ       LYS  40 -13.549  -1.047   4.182
  320    H    ILE  41           H        ILE  41  -9.232   5.990   1.035
  321    HA   ILE  41           HA       ILE  41  -7.961   6.838   3.436
  322    HB   ILE  41           HB       ILE  41  -7.336   7.737   0.626
  323   1HG1  ILE  41          2HG1      ILE  41  -6.025   5.452   2.090
  324   2HG1  ILE  41          1HG1      ILE  41  -7.424   5.205   1.050
  325   1HG2  ILE  41          1HG2      ILE  41  -6.034   8.055   3.252
  326   2HG2  ILE  41          2HG2      ILE  41  -5.985   9.091   1.825
  327   3HG2  ILE  41          3HG2      ILE  41  -4.974   7.647   1.903
  328   1HD1  ILE  41          1HD1      ILE  41  -6.094   5.104  -0.706
  329   2HD1  ILE  41          2HD1      ILE  41  -4.695   5.359   0.337
  330   3HD1  ILE  41          3HD1      ILE  41  -5.522   6.740  -0.383
  331    H    LYS  42           H        LYS  42 -10.345   8.258   1.422
  332    HA   LYS  42           HA       LYS  42  -9.845  10.969   1.643
  333   1HB   LYS  42          2HB       LYS  42 -11.824   9.500   0.563
  334   2HB   LYS  42          1HB       LYS  42 -12.657  10.153   1.966
  335   1HG   LYS  42          2HG       LYS  42 -11.109  12.111   0.424
  336   2HG   LYS  42          1HG       LYS  42 -12.476  11.392  -0.430
  337   1HD   LYS  42          2HD       LYS  42 -13.994  12.083   1.296
  338   2HD   LYS  42          1HD       LYS  42 -12.660  12.629   2.313
  339   1HE   LYS  42          2HE       LYS  42 -12.113  14.150   0.255
  340   2HE   LYS  42          1HE       LYS  42 -13.805  13.867  -0.150
  341   1HZ   LYS  42          1HZ       LYS  42 -12.652  15.394   2.047
  342   2HZ   LYS  42          2HZ       LYS  42 -14.061  14.522   2.392
  343   3HZ   LYS  42          3HZ       LYS  42 -14.061  15.676   1.155
  344    H    GLU  43           H        GLU  43 -10.828   8.732   4.080
  345    HA   GLU  43           HA       GLU  43 -11.077  10.957   5.982
  346   1HB   GLU  43          2HB       GLU  43 -12.600   8.365   6.203
  347   2HB   GLU  43          1HB       GLU  43 -12.810   9.817   7.170
  348   1HG   GLU  43          2HG       GLU  43 -13.824  10.979   5.404
  349   2HG   GLU  43          1HG       GLU  43 -13.286   9.799   4.210
  350    H    LEU  44           H        LEU  44 -10.521   7.447   5.753
  351    HA   LEU  44           HA       LEU  44  -9.303   7.153   8.261
  352   1HB   LEU  44          2HB       LEU  44  -9.637   5.554   5.843
  353   2HB   LEU  44          1HB       LEU  44  -8.127   5.219   6.668
  354    HG   LEU  44           HG       LEU  44  -9.985   3.713   7.333
  355   1HD1  LEU  44          1HD1      LEU  44  -9.320   3.588   9.527
  356   2HD1  LEU  44          2HD1      LEU  44  -9.289   5.340   9.731
  357   3HD1  LEU  44          3HD1      LEU  44  -8.008   4.536   8.825
  358   1HD2  LEU  44          1HD2      LEU  44 -11.802   4.529   8.675
  359   2HD2  LEU  44          2HD2      LEU  44 -11.776   5.424   7.156
  360   3HD2  LEU  44          3HD2      LEU  44 -11.155   6.169   8.628
  361    H    PHE  45           H        PHE  45  -7.428   7.876   9.000
  362    HA   PHE  45           HA       PHE  45  -5.483   9.014   7.184
  363   1HB   PHE  45          2HB       PHE  45  -6.065  10.170   9.286
  364   2HB   PHE  45          1HB       PHE  45  -5.442   8.802  10.203
  365    HD1  PHE  45           1HD      PHE  45  -4.174  10.813   7.322
  366    HD2  PHE  45           2HD      PHE  45  -3.465   9.304  11.238
  367    HE1  PHE  45           1HE      PHE  45  -1.933  11.828   7.304
  368    HE2  PHE  45           2HE      PHE  45  -1.223  10.317  11.227
  369    HZ   PHE  45           HZ       PHE  45  -0.453  11.581   9.258
  370    H    PHE  46           H        PHE  46  -5.414   6.562   6.424
  371    HA   PHE  46           HA       PHE  46  -3.961   4.660   7.846
  372   1HB   PHE  46          2HB       PHE  46  -4.485   5.147   4.942
  373   2HB   PHE  46          1HB       PHE  46  -3.310   3.920   5.402
  374    HD1  PHE  46           1HD      PHE  46  -6.535   4.311   4.407
  375    HD2  PHE  46           2HD      PHE  46  -4.306   2.438   7.509
  376    HE1  PHE  46           1HE      PHE  46  -8.362   2.694   4.736
  377    HE2  PHE  46           2HE      PHE  46  -6.127   0.817   7.845
  378    HZ   PHE  46           HZ       PHE  46  -8.158   0.945   6.458
  379    HA   PRO  47           HA       PRO  47   0.065   6.646   7.823
  380   1HB   PRO  47          2HB       PRO  47   1.422   4.666   9.075
  381   2HB   PRO  47          1HB       PRO  47   0.342   5.770   9.936
  382   1HG   PRO  47          2HG       PRO  47  -0.168   2.980   8.979
  383   2HG   PRO  47          1HG       PRO  47  -0.604   3.729  10.526
  384   1HD   PRO  47          2HD       PRO  47  -2.372   3.422   8.490
  385   2HD   PRO  47          1HD       PRO  47  -2.460   4.765   9.643
  386    H    VAL  48           H        VAL  48  -0.511   3.345   6.729
  387    HA   VAL  48           HA       VAL  48   1.624   3.709   4.741
  388    HB   VAL  48           HB       VAL  48   0.945   1.039   5.957
  389   1HG1  VAL  48          1HG1      VAL  48   2.866   2.048   3.957
  390   2HG1  VAL  48          2HG1      VAL  48   2.099   0.466   4.100
  391   3HG1  VAL  48          3HG1      VAL  48   3.491   0.864   5.106
  392   1HG2  VAL  48          1HG2      VAL  48   1.742   2.271   7.794
  393   2HG2  VAL  48          2HG2      VAL  48   2.968   3.083   6.822
  394   3HG2  VAL  48          3HG2      VAL  48   3.137   1.369   7.200
  395    H    ILE  49           H        ILE  49   1.178   3.088   2.684
  396    HA   ILE  49           HA       ILE  49  -1.341   1.680   2.143
  397    HB   ILE  49           HB       ILE  49  -0.621   4.000   0.402
  398   1HG1  ILE  49          2HG1      ILE  49  -0.762   4.708   2.893
  399   2HG1  ILE  49          1HG1      ILE  49  -1.706   5.604   1.711
  400   1HG2  ILE  49          1HG2      ILE  49  -2.904   2.212   0.834
  401   2HG2  ILE  49          2HG2      ILE  49  -2.357   3.032  -0.629
  402   3HG2  ILE  49          3HG2      ILE  49  -3.322   3.904   0.563
  403   1HD1  ILE  49          1HD1      ILE  49  -3.004   5.201   3.694
  404   2HD1  ILE  49          2HD1      ILE  49  -2.733   3.464   3.557
  405   3HD1  ILE  49          3HD1      ILE  49  -3.688   4.307   2.338
  406    H    VAL  50           H        VAL  50  -0.616  -0.145   1.096
  407    HA   VAL  50           HA       VAL  50   1.497   0.191  -0.911
  408    HB   VAL  50           HB       VAL  50   0.472  -2.348   0.372
  409   1HG1  VAL  50          1HG1      VAL  50   2.918  -2.947  -0.604
  410   2HG1  VAL  50          2HG1      VAL  50   2.368  -1.782  -1.808
  411   3HG1  VAL  50          3HG1      VAL  50   1.413  -3.226  -1.479
  412   1HG2  VAL  50          1HG2      VAL  50   3.079  -2.024   1.164
  413   2HG2  VAL  50          2HG2      VAL  50   1.656  -1.669   2.144
  414   3HG2  VAL  50          3HG2      VAL  50   2.445  -0.380   1.237
  415    H    LEU  51           H        LEU  51   1.079  -0.183  -3.016
  416    HA   LEU  51           HA       LEU  51  -1.668  -0.922  -3.732
  417   1HB   LEU  51          2HB       LEU  51  -1.036   1.186  -4.642
  418   2HB   LEU  51          1HB       LEU  51   0.489   0.550  -5.226
  419    HG   LEU  51           HG       LEU  51  -0.853  -0.918  -6.797
  420   1HD1  LEU  51          1HD1      LEU  51  -3.022  -1.021  -6.153
  421   2HD1  LEU  51          2HD1      LEU  51  -3.149   0.368  -7.231
  422   3HD1  LEU  51          3HD1      LEU  51  -3.021   0.613  -5.489
  423   1HD2  LEU  51          1HD2      LEU  51  -0.624   2.045  -6.938
  424   2HD2  LEU  51          2HD2      LEU  51  -1.527   1.207  -8.200
  425   3HD2  LEU  51          3HD2      LEU  51   0.164   0.802  -7.909
  426    H    ASP  52           H        ASP  52  -2.125  -2.682  -4.937
  427    HA   ASP  52           HA       ASP  52   0.149  -4.364  -5.755
  428   1HB   ASP  52          2HB       ASP  52  -1.741  -5.008  -3.894
  429   2HB   ASP  52          1HB       ASP  52  -2.446  -5.700  -5.352
  430    H    VAL  53           H        VAL  53   0.128  -3.293  -7.815
  431    HA   VAL  53           HA       VAL  53  -2.082  -3.165  -9.530
  432    HB   VAL  53           HB       VAL  53  -0.139  -1.853 -10.039
  433   1HG1  VAL  53          1HG1      VAL  53   2.006  -2.613 -10.303
  434   2HG1  VAL  53          2HG1      VAL  53   1.492  -4.224 -10.802
  435   3HG1  VAL  53          3HG1      VAL  53   1.403  -3.756  -9.106
  436   1HG2  VAL  53          1HG2      VAL  53  -0.023  -2.148 -12.343
  437   2HG2  VAL  53          2HG2      VAL  53  -1.561  -2.900 -11.915
  438   3HG2  VAL  53          3HG2      VAL  53  -0.143  -3.904 -12.222
  439    H    TRP  54           H        TRP  54  -3.104  -5.253  -9.203
  440    HA   TRP  54           HA       TRP  54  -1.774  -7.600 -10.267
  441   1HB   TRP  54          2HB       TRP  54  -3.172  -7.966  -8.352
  442   2HB   TRP  54          1HB       TRP  54  -4.530  -7.146  -9.112
  443    HD1  TRP  54           HD       TRP  54  -6.299  -8.972  -9.438
  444    HE1  TRP  54           1HE      TRP  54  -6.347 -11.311 -10.510
  445    HE3  TRP  54           3HE      TRP  54  -1.313  -9.512 -10.439
  446    HZ2  TRP  54           2HZ      TRP  54  -4.515 -13.143 -11.630
  447    HZ3  TRP  54           3HZ      TRP  54  -0.544 -11.588 -11.512
  448    HH2  TRP  54           HH       TRP  54  -2.113 -13.366 -12.094
  449    H    MET  55           H        MET  55  -5.082  -6.490 -10.921
  450    HA   MET  55           HA       MET  55  -4.505  -6.320 -13.769
  451   1HB   MET  55          2HB       MET  55  -6.168  -8.433 -12.496
  452   2HB   MET  55          1HB       MET  55  -6.753  -7.744 -14.005
  453   1HG   MET  55          2HG       MET  55  -3.929  -8.473 -14.067
  454   2HG   MET  55          1HG       MET  55  -5.009  -9.833 -13.769
  455   1HE   MET  55          1HE       MET  55  -3.481  -8.993 -17.426
  456   2HE   MET  55          2HE       MET  55  -3.047  -8.257 -15.884
  457   3HE   MET  55          3HE       MET  55  -3.960  -7.332 -17.075
  458    HA   PRO  56           HA       PRO  56  -7.914  -3.482 -12.306
  459   1HB   PRO  56          2HB       PRO  56  -6.399  -1.310 -11.481
  460   2HB   PRO  56          1HB       PRO  56  -7.050  -2.555 -10.417
  461   1HG   PRO  56          2HG       PRO  56  -4.315  -2.031 -11.014
  462   2HG   PRO  56          1HG       PRO  56  -4.972  -3.331 -10.012
  463   1HD   PRO  56          2HD       PRO  56  -4.079  -3.388 -12.841
  464   2HD   PRO  56          1HD       PRO  56  -4.120  -4.690 -11.637
  465    H    ASP  57           H        ASP  57  -7.653  -0.741 -12.739
  466    HA   ASP  57           HA       ASP  57  -6.444  -0.315 -15.333
  467   1HB   ASP  57          2HB       ASP  57  -8.638  -1.365 -15.854
  468   2HB   ASP  57          1HB       ASP  57  -9.437  -0.040 -15.013
  469    H    GLY  58           H        GLY  58  -5.454   1.016 -13.426
  470   1HA   GLY  58          2HA       GLY  58  -6.538   3.714 -13.709
  471   2HA   GLY  58          1HA       GLY  58  -6.403   3.084 -12.074
  472    H    ASP  59           H        ASP  59  -5.075   5.386 -12.877
  473    HA   ASP  59           HA       ASP  59  -2.330   4.686 -13.484
  474   1HB   ASP  59          2HB       ASP  59  -3.945   7.104 -13.498
  475   2HB   ASP  59          1HB       ASP  59  -2.385   7.372 -12.728
  476    H    GLY  60           H        GLY  60  -0.976   4.006 -11.966
  477   1HA   GLY  60          2HA       GLY  60  -1.548   4.543  -9.162
  478   2HA   GLY  60          1HA       GLY  60  -0.333   3.438  -9.784
  479    H    VAL  61           H        VAL  61   0.695   5.573 -11.620
  480    HA   VAL  61           HA       VAL  61   2.745   6.547  -9.975
  481    HB   VAL  61           HB       VAL  61   1.876   7.593 -12.672
  482   1HG1  VAL  61          1HG1      VAL  61   4.423   7.871 -11.103
  483   2HG1  VAL  61          2HG1      VAL  61   3.350   9.151 -11.667
  484   3HG1  VAL  61          3HG1      VAL  61   4.299   8.221 -12.826
  485   1HG2  VAL  61          1HG2      VAL  61   4.084   5.619 -12.198
  486   2HG2  VAL  61          2HG2      VAL  61   3.232   5.997 -13.695
  487   3HG2  VAL  61          3HG2      VAL  61   2.418   5.086 -12.423
  488    H    ASN  62           H        ASN  62  -0.211   8.055 -11.203
  489    HA   ASN  62           HA       ASN  62   0.383  10.625 -10.093
  490   1HB   ASN  62          2HB       ASN  62  -1.463   9.601 -11.937
  491   2HB   ASN  62          1HB       ASN  62  -2.437  10.201 -10.597
  492   1HD2  ASN  62          1HD2      ASN  62   0.492  11.225 -12.326
  493   2HD2  ASN  62          2HD2      ASN  62  -0.017  12.859 -12.563
  494    H    PHE  63           H        PHE  63  -1.195   7.744  -8.964
  495    HA   PHE  63           HA       PHE  63  -2.770   8.826  -6.915
  496   1HB   PHE  63          2HB       PHE  63  -2.939   6.485  -7.703
  497   2HB   PHE  63          1HB       PHE  63  -1.383   6.137  -6.954
  498    HD1  PHE  63           1HD      PHE  63  -4.245   8.129  -5.673
  499    HD2  PHE  63           2HD      PHE  63  -1.845   4.642  -5.244
  500    HE1  PHE  63           1HE      PHE  63  -5.381   7.613  -3.553
  501    HE2  PHE  63           2HE      PHE  63  -2.978   4.119  -3.123
  502    HZ   PHE  63           HZ       PHE  63  -4.748   5.607  -2.277
  503    H    ILE  64           H        ILE  64   0.640   7.983  -7.024
  504    HA   ILE  64           HA       ILE  64   1.373   7.940  -4.397
  505    HB   ILE  64           HB       ILE  64   2.807   9.141  -6.760
  506   1HG1  ILE  64          2HG1      ILE  64   4.128   6.897  -5.636
  507   2HG1  ILE  64          1HG1      ILE  64   2.417   6.493  -5.728
  508   1HG2  ILE  64          1HG2      ILE  64   4.870   8.976  -5.297
  509   2HG2  ILE  64          2HG2      ILE  64   3.767   8.876  -3.925
  510   3HG2  ILE  64          3HG2      ILE  64   3.768  10.309  -4.953
  511   1HD1  ILE  64          1HD1      ILE  64   4.114   7.465  -8.014
  512   2HD1  ILE  64          2HD1      ILE  64   2.410   7.019  -8.098
  513   3HD1  ILE  64          3HD1      ILE  64   3.623   5.797  -7.722
  514    H    ASP  65           H        ASP  65   0.356  10.720  -6.252
  515    HA   ASP  65           HA       ASP  65   1.238  12.640  -4.301
  516   1HB   ASP  65          2HB       ASP  65   0.959  13.093  -6.785
  517   2HB   ASP  65          1HB       ASP  65  -0.780  13.095  -6.501
  518    H    PHE  66           H        PHE  66  -1.795  11.034  -5.127
  519    HA   PHE  66           HA       PHE  66  -3.524  12.519  -3.522
  520   1HB   PHE  66          2HB       PHE  66  -4.310  10.851  -5.145
  521   2HB   PHE  66          1HB       PHE  66  -3.639   9.560  -4.151
  522    HD1  PHE  66           1HD      PHE  66  -4.547   9.330  -1.766
  523    HD2  PHE  66           2HD      PHE  66  -6.490  11.569  -4.818
  524    HE1  PHE  66           1HE      PHE  66  -6.661   9.193  -0.516
  525    HE2  PHE  66           2HE      PHE  66  -8.607  11.436  -3.574
  526    HZ   PHE  66           HZ       PHE  66  -8.695  10.246  -1.418
  527    H    ILE  67           H        ILE  67  -1.465   9.758  -2.736
  528    HA   ILE  67           HA       ILE  67  -2.349   9.320  -0.118
  529    HB   ILE  67           HB       ILE  67   0.353   8.855  -1.386
  530   1HG1  ILE  67          2HG1      ILE  67  -0.546   6.419  -0.976
  531   2HG1  ILE  67          1HG1      ILE  67  -2.112   7.220  -0.911
  532   1HG2  ILE  67          1HG2      ILE  67   1.116   8.768   0.734
  533   2HG2  ILE  67          2HG2      ILE  67   0.345   7.182   0.733
  534   3HG2  ILE  67          3HG2      ILE  67  -0.498   8.571   1.420
  535   1HD1  ILE  67          1HD1      ILE  67  -0.365   7.864  -3.207
  536   2HD1  ILE  67          2HD1      ILE  67  -2.118   7.685  -3.124
  537   3HD1  ILE  67          3HD1      ILE  67  -1.086   6.255  -3.155
  538    H    LYS  68           H        LYS  68   0.238  11.422  -1.362
  539    HA   LYS  68           HA       LYS  68   0.898  12.428   1.242
  540   1HB   LYS  68          2HB       LYS  68   1.593  13.570  -1.472
  541   2HB   LYS  68          1HB       LYS  68   2.361  13.977   0.057
  542   1HG   LYS  68          2HG       LYS  68   2.363  11.129  -0.764
  543   2HG   LYS  68          1HG       LYS  68   3.417  12.244  -1.638
  544   1HD   LYS  68          2HD       LYS  68   4.368  12.974   0.529
  545   2HD   LYS  68          1HD       LYS  68   3.375  11.761   1.341
  546   1HE   LYS  68          2HE       LYS  68   5.123  10.881  -0.897
  547   2HE   LYS  68          1HE       LYS  68   5.884  11.277   0.644
  548   1HZ   LYS  68          1HZ       LYS  68   4.893   9.529   1.687
  549   2HZ   LYS  68          2HZ       LYS  68   5.019   8.873   0.133
  550   3HZ   LYS  68          3HZ       LYS  68   3.546   9.512   0.665
  551    H    GLU  69           H        GLU  69  -1.374  13.244  -1.234
  552    HA   GLU  69           HA       GLU  69  -1.820  15.949  -0.600
  553   1HB   GLU  69          2HB       GLU  69  -2.616  14.689  -2.651
  554   2HB   GLU  69          1HB       GLU  69  -3.898  14.036  -1.643
  555   1HG   GLU  69          2HG       GLU  69  -4.862  16.163  -1.319
  556   2HG   GLU  69          1HG       GLU  69  -3.446  16.984  -1.973
  557    H    ASN  70           H        ASN  70  -3.319  12.966   0.573
  558    HA   ASN  70           HA       ASN  70  -4.564  14.534   2.736
  559   1HB   ASN  70          2HB       ASN  70  -5.618  11.859   1.876
  560   2HB   ASN  70          1HB       ASN  70  -6.454  13.164   2.711
  561   1HD2  ASN  70          1HD2      ASN  70  -4.923  12.354  -0.369
  562   2HD2  ASN  70          2HD2      ASN  70  -5.995  13.288  -1.349
  563    H    SER  71           H        SER  71  -1.913  12.981   2.399
  564    HA   SER  71           HA       SER  71  -1.807  12.022   5.075
  565   1HB   SER  71          2HB       SER  71  -2.451  10.115   2.975
  566   2HB   SER  71          1HB       SER  71  -0.960   9.683   3.809
  567    HG   SER  71           HG       SER  71  -3.359  10.351   5.160
  568    HA   PRO  72           HA       PRO  72   2.160  13.389   3.031
  569   1HB   PRO  72          2HB       PRO  72   2.358  15.182   5.333
  570   2HB   PRO  72          1HB       PRO  72   2.421  15.568   3.612
  571   1HG   PRO  72          2HG       PRO  72   0.325  16.251   5.174
  572   2HG   PRO  72          1HG       PRO  72   0.146  15.852   3.457
  573   1HD   PRO  72          2HD       PRO  72  -0.420  14.169   5.865
  574   2HD   PRO  72          1HD       PRO  72  -1.343  14.323   4.355
  575    H    ASP  73           H        ASP  73   1.172  12.338   6.124
  576    HA   ASP  73           HA       ASP  73   3.920  11.622   6.868
  577   1HB   ASP  73          2HB       ASP  73   2.445  12.950   8.460
  578   2HB   ASP  73          1HB       ASP  73   1.503  11.477   8.657
  579    H    SER  74           H        SER  74   2.267  10.195   4.881
  580    HA   SER  74           HA       SER  74   1.995   7.604   6.248
  581   1HB   SER  74          2HB       SER  74  -0.101   8.361   5.250
  582   2HB   SER  74          1HB       SER  74   0.695   8.565   3.690
  583    HG   SER  74           HG       SER  74  -0.148   6.593   3.511
  584    H    VAL  75           H        VAL  75   2.214   5.756   4.421
  585    HA   VAL  75           HA       VAL  75   4.701   6.313   2.942
  586    HB   VAL  75           HB       VAL  75   4.057   3.759   4.430
  587   1HG1  VAL  75          1HG1      VAL  75   6.521   4.578   2.887
  588   2HG1  VAL  75          2HG1      VAL  75   5.344   3.359   2.398
  589   3HG1  VAL  75          3HG1      VAL  75   6.343   3.097   3.828
  590   1HG2  VAL  75          1HG2      VAL  75   4.710   5.873   5.755
  591   2HG2  VAL  75          2HG2      VAL  75   6.315   5.623   5.068
  592   3HG2  VAL  75          3HG2      VAL  75   5.582   4.372   6.074
  593    H    VAL  76           H        VAL  76   4.966   5.274   0.976
  594    HA   VAL  76           HA       VAL  76   2.640   3.764  -0.015
  595    HB   VAL  76           HB       VAL  76   4.279   5.558  -1.789
  596   1HG1  VAL  76          1HG1      VAL  76   3.075   4.416  -3.291
  597   2HG1  VAL  76          2HG1      VAL  76   1.733   5.436  -2.775
  598   3HG1  VAL  76          3HG1      VAL  76   1.940   3.830  -2.075
  599   1HG2  VAL  76          1HG2      VAL  76   1.688   6.330  -0.459
  600   2HG2  VAL  76          2HG2      VAL  76   2.674   7.319  -1.534
  601   3HG2  VAL  76          3HG2      VAL  76   3.275   6.888   0.066
  602    H    ILE  77           H        ILE  77   3.186   1.765  -0.584
  603    HA   ILE  77           HA       ILE  77   6.001   1.174  -1.135
  604    HB   ILE  77           HB       ILE  77   3.698  -0.701  -0.597
  605   1HG1  ILE  77          2HG1      ILE  77   4.397   0.667   1.346
  606   2HG1  ILE  77          1HG1      ILE  77   4.746  -1.044   1.575
  607   1HG2  ILE  77          1HG2      ILE  77   4.979  -2.292  -1.473
  608   2HG2  ILE  77          2HG2      ILE  77   6.122  -2.016  -0.160
  609   3HG2  ILE  77          3HG2      ILE  77   6.322  -1.171  -1.694
  610   1HD1  ILE  77          1HD1      ILE  77   6.982   0.337   0.382
  611   2HD1  ILE  77          2HD1      ILE  77   6.907  -0.643   1.847
  612   3HD1  ILE  77          3HD1      ILE  77   6.497   1.071   1.911
  613    H    VAL  78           H        VAL  78   2.879   0.026  -2.453
  614    HA   VAL  78           HA       VAL  78   2.232  -0.484  -4.583
  615    HB   VAL  78           HB       VAL  78   4.551   1.159  -5.599
  616   1HG1  VAL  78          1HG1      VAL  78   1.781   0.661  -6.694
  617   2HG1  VAL  78          2HG1      VAL  78   3.258  -0.131  -7.242
  618   3HG1  VAL  78          3HG1      VAL  78   3.052   1.607  -7.467
  619   1HG2  VAL  78          1HG2      VAL  78   2.006   2.062  -4.312
  620   2HG2  VAL  78          2HG2      VAL  78   2.736   3.022  -5.598
  621   3HG2  VAL  78          3HG2      VAL  78   3.643   2.690  -4.122
  622    H    ILE  79           H        ILE  79   2.540  -2.518  -5.235
  623    HA   ILE  79           HA       ILE  79   5.284  -3.370  -5.883
  624    HB   ILE  79           HB       ILE  79   3.380  -5.388  -4.783
  625   1HG1  ILE  79          2HG1      ILE  79   4.985  -3.532  -3.017
  626   2HG1  ILE  79          1HG1      ILE  79   3.250  -3.400  -3.257
  627   1HG2  ILE  79          1HG2      ILE  79   5.537  -6.145  -5.561
  628   2HG2  ILE  79          2HG2      ILE  79   5.506  -6.251  -3.802
  629   3HG2  ILE  79          3HG2      ILE  79   6.355  -4.924  -4.592
  630   1HD1  ILE  79          1HD1      ILE  79   2.807  -5.071  -1.848
  631   2HD1  ILE  79          2HD1      ILE  79   4.440  -4.771  -1.252
  632   3HD1  ILE  79          3HD1      ILE  79   4.151  -6.053  -2.429
  633    H    THR  80           H        THR  80   4.088  -6.114  -6.493
  634    HA   THR  80           HA       THR  80   3.505  -7.234  -8.377
  635    HB   THR  80           HB       THR  80   1.378  -5.717  -9.415
  636    HG1  THR  80           1HG      THR  80   1.453  -5.618  -6.582
  637   1HG2  THR  80          1HG2      THR  80   0.078  -7.475  -8.835
  638   2HG2  THR  80          2HG2      THR  80   0.827  -7.655  -7.248
  639   3HG2  THR  80          3HG2      THR  80   1.660  -8.242  -8.688
  640    H    GLY  81           H        GLY  81   2.763  -6.827 -10.819
  641   1HA   GLY  81          2HA       GLY  81   3.330  -4.700 -12.359
  642   2HA   GLY  81          1HA       GLY  81   4.938  -5.283 -11.958
  643    H    HIS  82           H        HIS  82   4.489  -5.263 -14.528
  644    HA   HIS  82           HA       HIS  82   3.964  -8.079 -15.198
  645   1HB   HIS  82          2HB       HIS  82   2.347  -5.976 -15.985
  646   2HB   HIS  82          1HB       HIS  82   3.392  -6.219 -17.381
  647    HD1  HIS  82           1HD      HIS  82   2.805  -8.108 -18.903
  648    HD2  HIS  82           2HD      HIS  82   0.879  -8.384 -15.232
  649    HE1  HIS  82           1HE      HIS  82   1.191 -10.021 -19.134
  650    HE2  HIS  82           2HE      HIS  82   0.100 -10.225 -16.871
  651    H    GLY  83           H        GLY  83   6.483  -7.137 -14.603
  652   1HA   GLY  83          2HA       GLY  83   8.550  -7.664 -15.600
  653   2HA   GLY  83          1HA       GLY  83   7.802  -7.511 -17.182
  654    H    SER  84           H        SER  84  10.300  -6.380 -16.386
  655    HA   SER  84           HA       SER  84  11.478  -4.444 -16.574
  656   1HB   SER  84          2HB       SER  84  10.251  -4.196 -18.676
  657   2HB   SER  84          1HB       SER  84   8.907  -3.442 -17.820
  658    HG   SER  84           HG       SER  84  10.263  -1.876 -18.755
  659    H    VAL  85           H        VAL  85  11.854  -3.832 -14.503
  660    HA   VAL  85           HA       VAL  85   9.874  -2.713 -12.793
  661    HB   VAL  85           HB       VAL  85  12.869  -2.484 -12.490
  662   1HG1  VAL  85          1HG1      VAL  85  10.548  -2.200 -10.607
  663   2HG1  VAL  85          2HG1      VAL  85  11.848  -1.055 -10.937
  664   3HG1  VAL  85          3HG1      VAL  85  12.182  -2.532 -10.033
  665   1HG2  VAL  85          1HG2      VAL  85  11.021  -4.703 -11.618
  666   2HG2  VAL  85          2HG2      VAL  85  12.708  -4.537 -11.127
  667   3HG2  VAL  85          3HG2      VAL  85  12.304  -4.813 -12.823
  668    H    ASP  86           H        ASP  86   9.256  -1.147 -14.637
  669    HA   ASP  86           HA       ASP  86  10.902   1.278 -14.572
  670   1HB   ASP  86          2HB       ASP  86  10.252   0.426 -16.789
  671   2HB   ASP  86          1HB       ASP  86   8.554   0.576 -16.347
  672    H    THR  87           H        THR  87   7.520   0.235 -14.123
  673    HA   THR  87           HA       THR  87   6.467   2.696 -13.359
  674    HB   THR  87           HB       THR  87   5.240   0.476 -13.810
  675    HG1  THR  87           1HG      THR  87   4.318   2.506 -12.988
  676   1HG2  THR  87          1HG2      THR  87   6.280  -0.932 -12.138
  677   2HG2  THR  87          2HG2      THR  87   4.551  -0.774 -11.827
  678   3HG2  THR  87          3HG2      THR  87   5.708   0.137 -10.856
  679    H    ALA  88           H        ALA  88   8.374   0.389 -11.580
  680    HA   ALA  88           HA       ALA  88   7.911   1.314  -8.973
  681   1HB   ALA  88          1HB       ALA  88  10.270  -0.050 -10.245
  682   2HB   ALA  88          2HB       ALA  88   9.029  -0.754  -9.210
  683   3HB   ALA  88          3HB       ALA  88  10.219   0.354  -8.529
  684    H    VAL  89           H        VAL  89  10.656   2.012 -11.123
  685    HA   VAL  89           HA       VAL  89  11.773   4.057  -9.588
  686    HB   VAL  89           HB       VAL  89  12.964   4.748 -11.607
  687   1HG1  VAL  89          1HG1      VAL  89  13.244   2.408 -10.318
  688   2HG1  VAL  89          2HG1      VAL  89  14.298   2.926 -11.634
  689   3HG1  VAL  89          3HG1      VAL  89  12.963   1.818 -11.957
  690   1HG2  VAL  89          1HG2      VAL  89  12.451   4.066 -13.762
  691   2HG2  VAL  89          2HG2      VAL  89  10.855   4.346 -13.066
  692   3HG2  VAL  89          3HG2      VAL  89  11.479   2.703 -13.210
  693    H    LYS  90           H        LYS  90   9.019   4.045 -11.688
  694    HA   LYS  90           HA       LYS  90   8.927   6.915 -11.998
  695   1HB   LYS  90          2HB       LYS  90   8.097   5.532 -13.800
  696   2HB   LYS  90          1HB       LYS  90   6.968   4.732 -12.717
  697   1HG   LYS  90          2HG       LYS  90   5.661   6.708 -12.494
  698   2HG   LYS  90          1HG       LYS  90   6.871   7.672 -13.338
  699   1HD   LYS  90          2HD       LYS  90   5.629   5.321 -14.701
  700   2HD   LYS  90          1HD       LYS  90   4.745   6.846 -14.604
  701   1HE   LYS  90          2HE       LYS  90   6.123   7.891 -16.056
  702   2HE   LYS  90          1HE       LYS  90   7.555   7.043 -15.473
  703   1HZ   LYS  90          1HZ       LYS  90   7.307   6.141 -17.546
  704   2HZ   LYS  90          2HZ       LYS  90   5.618   6.225 -17.522
  705   3HZ   LYS  90          3HZ       LYS  90   6.416   5.027 -16.635
  706    H    ALA  91           H        ALA  91   8.061   4.750  -9.558
  707    HA   ALA  91           HA       ALA  91   6.026   6.600  -8.511
  708   1HB   ALA  91          1HB       ALA  91   5.219   4.740  -7.148
  709   2HB   ALA  91          2HB       ALA  91   6.474   3.699  -7.821
  710   3HB   ALA  91          3HB       ALA  91   5.202   4.334  -8.865
  711    H    ILE  92           H        ILE  92   8.964   4.813  -7.700
  712    HA   ILE  92           HA       ILE  92   9.049   5.691  -4.989
  713    HB   ILE  92           HB       ILE  92  11.201   4.706  -4.838
  714   1HG1  ILE  92          2HG1      ILE  92  11.256   4.660  -7.865
  715   2HG1  ILE  92          1HG1      ILE  92  12.216   5.718  -6.839
  716   1HG2  ILE  92          1HG2      ILE  92  10.814   2.486  -6.057
  717   2HG2  ILE  92          2HG2      ILE  92   9.315   3.216  -6.631
  718   3HG2  ILE  92          3HG2      ILE  92   9.593   3.018  -4.902
  719   1HD1  ILE  92          1HD1      ILE  92  13.618   4.025  -6.175
  720   2HD1  ILE  92          2HD1      ILE  92  13.257   3.557  -7.838
  721   3HD1  ILE  92          3HD1      ILE  92  12.425   2.767  -6.499
  722    H    LYS  93           H        LYS  93  10.729   7.063  -4.071
  723    HA   LYS  93           HA       LYS  93  12.064   8.917  -3.952
  724   1HB   LYS  93          2HB       LYS  93  11.775   9.247  -6.940
  725   2HB   LYS  93          1HB       LYS  93  12.984   9.975  -5.895
  726   1HG   LYS  93          2HG       LYS  93  12.997   7.084  -5.721
  727   2HG   LYS  93          1HG       LYS  93  13.263   7.659  -7.368
  728   1HD   LYS  93          2HD       LYS  93  14.755   8.932  -5.119
  729   2HD   LYS  93          1HD       LYS  93  15.274   7.352  -5.707
  730   1HE   LYS  93          2HE       LYS  93  15.196   8.427  -8.040
  731   2HE   LYS  93          1HE       LYS  93  15.161   9.965  -7.177
  732   1HZ   LYS  93          1HZ       LYS  93  17.269   9.624  -6.321
  733   2HZ   LYS  93          2HZ       LYS  93  17.412   9.010  -7.891
  734   3HZ   LYS  93          3HZ       LYS  93  17.235   7.952  -6.581
  735    H    LYS  94           H        LYS  94   9.381   9.176  -6.262
  736    HA   LYS  94           HA       LYS  94   8.822  11.898  -5.616
  737   1HB   LYS  94          2HB       LYS  94   8.248  10.659  -7.776
  738   2HB   LYS  94          1HB       LYS  94   6.894   9.974  -6.887
  739   1HG   LYS  94          2HG       LYS  94   6.064  11.835  -8.083
  740   2HG   LYS  94          1HG       LYS  94   6.161  12.320  -6.389
  741   1HD   LYS  94          2HD       LYS  94   8.579  12.860  -7.969
  742   2HD   LYS  94          1HD       LYS  94   7.149  13.764  -8.471
  743   1HE   LYS  94          2HE       LYS  94   6.946  14.136  -5.847
  744   2HE   LYS  94          1HE       LYS  94   8.688  13.882  -5.934
  745   1HZ   LYS  94          1HZ       LYS  94   8.990  15.764  -7.192
  746   2HZ   LYS  94          2HZ       LYS  94   7.717  16.253  -6.191
  747   3HZ   LYS  94          3HZ       LYS  94   7.403  15.776  -7.783
  748    H    GLY  95           H        GLY  95   7.878   8.810  -4.338
  749   1HA   GLY  95          2HA       GLY  95   6.760   9.961  -2.011
  750   2HA   GLY  95          1HA       GLY  95   5.471   9.459  -3.090
  751    H    ALA  96           H        ALA  96   6.943   7.123  -4.116
  752    HA   ALA  96           HA       ALA  96   6.073   5.242  -2.226
  753   1HB   ALA  96          1HB       ALA  96   6.408   3.763  -3.862
  754   2HB   ALA  96          2HB       ALA  96   8.104   4.211  -4.034
  755   3HB   ALA  96          3HB       ALA  96   6.857   5.143  -4.863
  756    H    TYR  97           H        TYR  97   7.699   3.404  -1.563
  757    HA   TYR  97           HA       TYR  97   9.790   4.756  -0.026
  758   1HB   TYR  97          2HB       TYR  97   8.577   3.637   1.555
  759   2HB   TYR  97          1HB       TYR  97   8.066   2.382   0.437
  760    HD1  TYR  97           1HD      TYR  97  10.656   3.447   2.792
  761    HD2  TYR  97           2HD      TYR  97   9.433   0.398   0.089
  762    HE1  TYR  97           1HE      TYR  97  12.312   1.917   3.776
  763    HE2  TYR  97           2HE      TYR  97  11.085  -1.140   1.064
  764    HH   TYR  97           HH       TYR  97  12.419  -0.859   3.887
  765    H    GLU  98           H        GLU  98   9.451   2.929  -2.784
  766    HA   GLU  98           HA       GLU  98  11.741   2.798  -3.917
  767   1HB   GLU  98          2HB       GLU  98  13.148   0.930  -3.114
  768   2HB   GLU  98          1HB       GLU  98  13.032   2.243  -1.955
  769   1HG   GLU  98          2HG       GLU  98  12.353   0.817  -0.406
  770   2HG   GLU  98          1HG       GLU  98  10.952   0.399  -1.392
  771    H    PHE  99           H        PHE  99   8.989   1.055  -3.047
  772    HA   PHE  99           HA       PHE  99   7.686  -0.347  -4.308
  773   1HB   PHE  99          2HB       PHE  99   9.370   0.692  -6.224
  774   2HB   PHE  99          1HB       PHE  99   9.661  -1.036  -6.366
  775    HD1  PHE  99           1HD      PHE  99   8.111  -2.446  -7.417
  776    HD2  PHE  99           2HD      PHE  99   7.033   1.559  -6.463
  777    HE1  PHE  99           1HE      PHE  99   6.070  -2.677  -8.773
  778    HE2  PHE  99           2HE      PHE  99   4.994   1.336  -7.820
  779    HZ   PHE  99           HZ       PHE  99   4.509  -0.783  -8.976
  780    H    LEU 100           H        LEU 100   7.346  -2.304  -3.514
  781    HA   LEU 100           HA       LEU 100   9.468  -3.932  -2.517
  782   1HB   LEU 100          2HB       LEU 100   6.681  -3.733  -2.180
  783   2HB   LEU 100          1HB       LEU 100   6.973  -5.346  -2.796
  784    HG   LEU 100           HG       LEU 100   6.961  -5.547  -0.463
  785   1HD1  LEU 100          1HD1      LEU 100   8.814  -6.722  -1.586
  786   2HD1  LEU 100          2HD1      LEU 100   9.184  -6.299   0.085
  787   3HD1  LEU 100          3HD1      LEU 100   9.867  -5.351  -1.236
  788   1HD2  LEU 100          1HD2      LEU 100   8.347  -2.946  -0.549
  789   2HD2  LEU 100          2HD2      LEU 100   8.831  -4.041   0.745
  790   3HD2  LEU 100          3HD2      LEU 100   7.143  -3.557   0.585
  791    H    GLU 101           H        GLU 101   9.871  -6.167  -3.170
  792    HA   GLU 101           HA       GLU 101   9.440  -6.569  -6.057
  793   1HB   GLU 101          2HB       GLU 101  11.759  -7.626  -4.438
  794   2HB   GLU 101          1HB       GLU 101  11.574  -7.663  -6.186
  795   1HG   GLU 101          2HG       GLU 101  11.744  -5.111  -4.612
  796   2HG   GLU 101          1HG       GLU 101  13.156  -5.937  -5.270
  797    H    LYS 102           H        LYS 102   9.181  -8.739  -6.799
  798    HA   LYS 102           HA       LYS 102   8.333 -10.846  -6.751
  799   1HB   LYS 102          2HB       LYS 102   9.925 -10.655  -4.309
  800   2HB   LYS 102          1HB       LYS 102   8.617 -11.821  -4.178
  801   1HG   LYS 102          2HG       LYS 102   9.446 -13.124  -5.930
  802   2HG   LYS 102          1HG       LYS 102  10.489 -11.827  -6.518
  803   1HD   LYS 102          2HD       LYS 102  10.873 -12.994  -3.783
  804   2HD   LYS 102          1HD       LYS 102  11.553 -13.782  -5.208
  805   1HE   LYS 102          2HE       LYS 102  12.260 -11.132  -5.533
  806   2HE   LYS 102          1HE       LYS 102  12.428 -11.393  -3.798
  807   1HZ   LYS 102          1HZ       LYS 102  13.794 -12.822  -5.999
  808   2HZ   LYS 102          2HZ       LYS 102  13.740 -13.443  -4.427
  809   3HZ   LYS 102          3HZ       LYS 102  14.487 -11.955  -4.724
  810    HA   PRO 103           HA       PRO 103   4.468  -9.261  -4.768
  811   1HB   PRO 103          2HB       PRO 103   2.882  -9.615  -6.928
  812   2HB   PRO 103          1HB       PRO 103   3.888  -8.176  -6.715
  813   1HG   PRO 103          2HG       PRO 103   4.406 -10.622  -8.366
  814   2HG   PRO 103          1HG       PRO 103   4.655  -8.916  -8.785
  815   1HD   PRO 103          2HD       PRO 103   6.674 -10.544  -7.978
  816   2HD   PRO 103          1HD       PRO 103   6.654  -8.800  -7.651
  817    H    PHE 104           H        PHE 104   5.300 -11.608  -3.910
  818    HA   PHE 104           HA       PHE 104   2.949 -13.293  -4.148
  819   1HB   PHE 104          2HB       PHE 104   5.067 -13.922  -5.749
  820   2HB   PHE 104          1HB       PHE 104   5.448 -14.853  -4.305
  821    HD1  PHE 104           1HD      PHE 104   2.176 -14.058  -5.892
  822    HD2  PHE 104           2HD      PHE 104   4.984 -17.059  -4.792
  823    HE1  PHE 104           1HE      PHE 104   0.588 -15.798  -6.601
  824    HE2  PHE 104           2HE      PHE 104   3.402 -18.805  -5.500
  825    HZ   PHE 104           HZ       PHE 104   1.201 -18.175  -6.407
  826    H    SER 105           H        SER 105   2.352 -13.810  -2.158
  827    HA   SER 105           HA       SER 105   2.459 -14.584  -0.005
  828   1HB   SER 105          2HB       SER 105   4.332 -15.624   0.823
  829   2HB   SER 105          1HB       SER 105   4.754 -15.614  -0.888
  830    HG   SER 105           HG       SER 105   6.151 -13.978  -0.550
  831    H    VAL 106           H        VAL 106   4.878 -12.103  -0.784
  832    HA   VAL 106           HA       VAL 106   5.150  -9.984  -0.025
  833    HB   VAL 106           HB       VAL 106   3.481  -8.788   0.968
  834   1HG1  VAL 106          1HG1      VAL 106   1.677 -11.039   0.215
  835   2HG1  VAL 106          2HG1      VAL 106   2.692 -10.282  -1.014
  836   3HG1  VAL 106          3HG1      VAL 106   1.526  -9.312  -0.114
  837   1HG2  VAL 106          1HG2      VAL 106   1.720 -10.506   2.321
  838   2HG2  VAL 106          2HG2      VAL 106   2.804  -9.301   3.017
  839   3HG2  VAL 106          3HG2      VAL 106   3.341 -10.968   2.826
  840    H    GLU 107           H        GLU 107   5.650 -12.726   1.668
  841    HA   GLU 107           HA       GLU 107   6.073 -12.164   4.286
  842   1HB   GLU 107          2HB       GLU 107   6.618 -14.290   2.962
  843   2HB   GLU 107          1HB       GLU 107   8.188 -13.556   2.668
  844   1HG   GLU 107          2HG       GLU 107   7.924 -13.275   5.366
  845   2HG   GLU 107          1HG       GLU 107   7.120 -14.815   5.070
  846    H    ARG 108           H        ARG 108   8.149 -11.225   1.579
  847    HA   ARG 108           HA       ARG 108  10.170 -10.009   3.168
  848   1HB   ARG 108          2HB       ARG 108  10.606 -10.699   0.861
  849   2HB   ARG 108          1HB       ARG 108   9.408  -9.554   0.273
  850   1HG   ARG 108          2HG       ARG 108  11.401  -8.456  -0.112
  851   2HG   ARG 108          1HG       ARG 108  10.879  -7.774   1.429
  852   1HD   ARG 108          2HD       ARG 108  12.296  -9.660   2.480
  853   2HD   ARG 108          1HD       ARG 108  13.039  -9.778   0.884
  854    HE   ARG 108           HE       ARG 108  13.136  -7.111   1.563
  855   1HH1  ARG 108          1HH1      ARG 108  14.350 -10.102   2.890
  856   2HH1  ARG 108          2HH1      ARG 108  15.741  -9.364   3.610
  857   1HH2  ARG 108          1HH2      ARG 108  14.965  -6.138   2.509
  858   2HH2  ARG 108          2HH2      ARG 108  16.090  -7.113   3.396
  859    H    PHE 109           H        PHE 109   7.206  -8.911   1.654
  860    HA   PHE 109           HA       PHE 109   7.479  -6.150   2.013
  861   1HB   PHE 109          2HB       PHE 109   5.712  -6.873   0.618
  862   2HB   PHE 109          1HB       PHE 109   5.094  -7.988   1.825
  863    HD1  PHE 109           1HD      PHE 109   5.961  -4.381   2.107
  864    HD2  PHE 109           2HD      PHE 109   2.913  -7.349   2.241
  865    HE1  PHE 109           1HE      PHE 109   4.344  -2.680   2.842
  866    HE2  PHE 109           2HE      PHE 109   1.290  -5.651   2.977
  867    HZ   PHE 109           HZ       PHE 109   2.005  -3.314   3.278
  868    H    LEU 110           H        LEU 110   6.894  -8.692   4.260
  869    HA   LEU 110           HA       LEU 110   5.597  -7.290   6.319
  870   1HB   LEU 110          2HB       LEU 110   6.257  -9.850   5.919
  871   2HB   LEU 110          1HB       LEU 110   7.519  -9.401   7.049
  872    HG   LEU 110           HG       LEU 110   4.612  -8.903   7.632
  873   1HD1  LEU 110          1HD1      LEU 110   4.683 -10.974   8.975
  874   2HD1  LEU 110          2HD1      LEU 110   6.252 -11.348   8.261
  875   3HD1  LEU 110          3HD1      LEU 110   4.817 -11.267   7.241
  876   1HD2  LEU 110          1HD2      LEU 110   7.152  -8.504   9.013
  877   2HD2  LEU 110          2HD2      LEU 110   5.956  -9.370   9.976
  878   3HD2  LEU 110          3HD2      LEU 110   5.570  -7.783   9.313
  879    H    LEU 111           H        LEU 111   9.037  -8.026   5.836
  880    HA   LEU 111           HA       LEU 111  10.062  -6.799   8.095
  881   1HB   LEU 111          2HB       LEU 111  11.325  -6.928   5.356
  882   2HB   LEU 111          1HB       LEU 111  12.174  -6.607   6.856
  883    HG   LEU 111           HG       LEU 111  10.899  -9.010   7.361
  884   1HD1  LEU 111          1HD1      LEU 111  11.754  -8.870   4.487
  885   2HD1  LEU 111          2HD1      LEU 111  10.235  -9.462   5.158
  886   3HD1  LEU 111          3HD1      LEU 111  11.719 -10.388   5.382
  887   1HD2  LEU 111          1HD2      LEU 111  13.076  -8.664   8.135
  888   2HD2  LEU 111          2HD2      LEU 111  13.688  -8.287   6.524
  889   3HD2  LEU 111          3HD2      LEU 111  13.243  -9.944   6.933
  890    H    THR 112           H        THR 112   9.726  -5.360   4.844
  891    HA   THR 112           HA       THR 112  10.641  -2.824   5.402
  892    HB   THR 112           HB       THR 112   8.375  -3.596   3.554
  893    HG1  THR 112           1HG      THR 112  10.068  -4.648   2.774
  894   1HG2  THR 112          1HG2      THR 112   9.107  -1.623   2.232
  895   2HG2  THR 112          2HG2      THR 112  10.090  -1.129   3.611
  896   3HG2  THR 112          3HG2      THR 112   8.336  -1.226   3.769
  897    H    ILE 113           H        ILE 113   7.237  -3.867   5.472
  898    HA   ILE 113           HA       ILE 113   5.826  -1.768   6.200
  899    HB   ILE 113           HB       ILE 113   5.746  -4.517   7.394
  900   1HG1  ILE 113          2HG1      ILE 113   4.989  -4.090   5.060
  901   2HG1  ILE 113          1HG1      ILE 113   3.715  -4.718   6.100
  902   1HG2  ILE 113          1HG2      ILE 113   4.334  -2.124   8.396
  903   2HG2  ILE 113          2HG2      ILE 113   4.792  -3.608   9.230
  904   3HG2  ILE 113          3HG2      ILE 113   3.366  -3.584   8.192
  905   1HD1  ILE 113          1HD1      ILE 113   3.370  -2.035   6.372
  906   2HD1  ILE 113          2HD1      ILE 113   2.496  -3.062   5.236
  907   3HD1  ILE 113          3HD1      ILE 113   3.916  -2.164   4.701
  908    H    LYS 114           H        LYS 114   7.434  -3.621   8.802
  909    HA   LYS 114           HA       LYS 114   7.014  -1.846  10.867
  910   1HB   LYS 114          2HB       LYS 114   8.154  -4.147  10.908
  911   2HB   LYS 114          1HB       LYS 114   9.635  -3.281  10.523
  912   1HG   LYS 114          2HG       LYS 114   7.944  -2.543  12.886
  913   2HG   LYS 114          1HG       LYS 114   9.173  -3.806  12.971
  914   1HD   LYS 114          2HD       LYS 114  10.721  -2.249  13.310
  915   2HD   LYS 114          1HD       LYS 114  10.369  -1.573  11.719
  916   1HE   LYS 114          2HE       LYS 114   9.235   0.164  12.579
  917   2HE   LYS 114          1HE       LYS 114   8.433  -0.837  13.789
  918   1HZ   LYS 114          1HZ       LYS 114   9.972   0.883  14.693
  919   2HZ   LYS 114          2HZ       LYS 114  11.260   0.030  14.007
  920   3HZ   LYS 114          3HZ       LYS 114  10.309  -0.693  15.205
  921    H    HIS 115           H        HIS 115   9.909  -2.043   8.855
  922    HA   HIS 115           HA       HIS 115  11.160   0.288   9.698
  923   1HB   HIS 115          2HB       HIS 115  12.161  -1.485   8.234
  924   2HB   HIS 115          1HB       HIS 115  11.253  -0.806   6.886
  925    HD1  HIS 115           1HD      HIS 115  13.011   1.299   9.469
  926    HD2  HIS 115           2HD      HIS 115  13.433   0.158   5.496
  927    HE1  HIS 115           1HE      HIS 115  14.863   2.731   8.551
  928    HE2  HIS 115           2HE      HIS 115  15.155   1.966   6.169
  929    H    ALA 116           H        ALA 116   8.409  -0.116   7.613
  930    HA   ALA 116           HA       ALA 116   8.552   2.414   6.315
  931   1HB   ALA 116          1HB       ALA 116   6.015   0.877   6.771
  932   2HB   ALA 116          2HB       ALA 116   7.227   0.347   5.604
  933   3HB   ALA 116          3HB       ALA 116   6.449   1.918   5.416
  934    H    PHE 117           H        PHE 117   6.772   1.229   9.154
  935    HA   PHE 117           HA       PHE 117   5.422   3.657   9.680
  936   1HB   PHE 117          2HB       PHE 117   6.038   1.233  11.353
  937   2HB   PHE 117          1HB       PHE 117   5.210   2.630  12.034
  938    HD1  PHE 117           1HD      PHE 117   2.915   3.001  11.635
  939    HD2  PHE 117           2HD      PHE 117   4.991  -0.002   9.454
  940    HE1  PHE 117           1HE      PHE 117   0.774   2.146  10.780
  941    HE2  PHE 117           2HE      PHE 117   2.860  -0.860   8.596
  942    HZ   PHE 117           HZ       PHE 117   0.744   0.215   9.255
  943    H    GLU 118           H        GLU 118   8.680   2.808  10.051
  944    HA   GLU 118           HA       GLU 118   9.419   4.157  12.376
  945   1HB   GLU 118          2HB       GLU 118  10.741   2.680  10.569
  946   2HB   GLU 118          1HB       GLU 118  11.288   4.283  10.098
  947   1HG   GLU 118          2HG       GLU 118  11.553   3.018  12.814
  948   2HG   GLU 118          1HG       GLU 118  12.846   3.301  11.649
  949    H    GLU 119           H        GLU 119   8.294   5.413   9.402
  950    HA   GLU 119           HA       GLU 119   9.522   8.021   9.810
  951   1HB   GLU 119          2HB       GLU 119   7.611   7.119   7.650
  952   2HB   GLU 119          1HB       GLU 119   8.525   8.621   7.671
  953   1HG   GLU 119          2HG       GLU 119  10.613   7.326   7.575
  954   2HG   GLU 119          1HG       GLU 119   9.665   5.841   7.486
  955    H    TYR 120           H        TYR 120   7.696   7.148  11.823
  956    HA   TYR 120           HA       TYR 120   5.643   9.229  11.527
  957   1HB   TYR 120          2HB       TYR 120   4.766   6.833  11.247
  958   2HB   TYR 120          1HB       TYR 120   5.102   6.636  12.964
  959    HD1  TYR 120           1HD      TYR 120   3.296   6.903  14.361
  960    HD2  TYR 120           2HD      TYR 120   3.435   9.162  10.759
  961    HE1  TYR 120           1HE      TYR 120   1.112   7.895  14.905
  962    HE2  TYR 120           2HE      TYR 120   1.253  10.160  11.293
  963    HH   TYR 120           HH       TYR 120  -0.799   8.948  13.642
  964    H    SER 121           H        SER 121   8.313   8.997  12.906
  965    HA   SER 121           HA       SER 121   7.372   9.867  15.549
  966   1HB   SER 121          2HB       SER 121   8.354   7.503  15.561
  967   2HB   SER 121          1HB       SER 121   9.905   8.263  15.206
  968    HG   SER 121           HG       SER 121   8.257   8.685  17.475
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1  -2.545   1.644  16.975
    2   2H    MET   1          2HT       MET   1  -3.430   1.804  15.514
    3   3H    MET   1          3HT       MET   1  -3.538   3.018  16.723
    4    HA   MET   1           HA       MET   1  -2.136   3.961  15.251
    5   1HB   MET   1          2HB       MET   1  -1.251   3.601  17.646
    6   2HB   MET   1          1HB       MET   1  -0.177   2.406  16.930
    7   1HG   MET   1          2HG       MET   1   1.075   3.970  15.844
    8   2HG   MET   1          1HG       MET   1  -0.258   5.116  15.724
    9   1HE   MET   1          1HE       MET   1   2.762   5.205  16.370
   10   2HE   MET   1          2HE       MET   1   3.140   4.595  17.981
   11   3HE   MET   1          3HE       MET   1   3.009   6.331  17.704
   12    H    LYS   2           H        LYS   2  -1.754   0.504  15.394
   13    HA   LYS   2           HA       LYS   2   0.035   0.531  13.076
   14   1HB   LYS   2          2HB       LYS   2  -0.854  -1.792  14.794
   15   2HB   LYS   2          1HB       LYS   2   0.365  -1.848  13.530
   16   1HG   LYS   2          2HG       LYS   2   0.567  -0.184  16.029
   17   2HG   LYS   2          1HG       LYS   2   1.313  -1.768  15.804
   18   1HD   LYS   2          2HD       LYS   2   1.900   0.132  13.657
   19   2HD   LYS   2          1HD       LYS   2   2.493   0.641  15.239
   20   1HE   LYS   2          2HE       LYS   2   2.969  -2.149  14.267
   21   2HE   LYS   2          1HE       LYS   2   3.999  -0.827  13.717
   22   1HZ   LYS   2          1HZ       LYS   2   3.606  -1.787  16.492
   23   2HZ   LYS   2          2HZ       LYS   2   4.346  -0.308  16.136
   24   3HZ   LYS   2          3HZ       LYS   2   5.040  -1.754  15.597
   25    H    ARG   3           H        ARG   3  -1.290   0.989  11.360
   26    HA   ARG   3           HA       ARG   3  -3.133  -1.138  10.580
   27   1HB   ARG   3          2HB       ARG   3  -3.924   1.771  10.398
   28   2HB   ARG   3          1HB       ARG   3  -4.911   0.373   9.994
   29   1HG   ARG   3          2HG       ARG   3  -5.757   0.921  12.042
   30   2HG   ARG   3          1HG       ARG   3  -4.520  -0.249  12.505
   31   1HD   ARG   3          2HD       ARG   3  -3.316   1.287  13.593
   32   2HD   ARG   3          1HD       ARG   3  -3.514   2.481  12.313
   33    HE   ARG   3           HE       ARG   3  -5.170   2.149  14.675
   34   1HH1  ARG   3          1HH1      ARG   3  -4.815   3.647  11.538
   35   2HH1  ARG   3          2HH1      ARG   3  -5.931   4.924  11.886
   36   1HH2  ARG   3          1HH2      ARG   3  -6.637   3.828  15.128
   37   2HH2  ARG   3          2HH2      ARG   3  -6.964   5.027  13.921
   38    H    VAL   4           H        VAL   4  -2.794  -1.721   8.523
   39    HA   VAL   4           HA       VAL   4  -1.399   0.198   6.767
   40    HB   VAL   4           HB       VAL   4  -1.287  -2.820   6.614
   41   1HG1  VAL   4          1HG1      VAL   4  -0.174  -0.612   4.962
   42   2HG1  VAL   4          2HG1      VAL   4  -0.807  -2.183   4.471
   43   3HG1  VAL   4          3HG1      VAL   4   0.800  -2.065   5.186
   44   1HG2  VAL   4          1HG2      VAL   4   0.779  -0.874   7.641
   45   2HG2  VAL   4          2HG2      VAL   4   1.002  -2.612   7.450
   46   3HG2  VAL   4          3HG2      VAL   4  -0.161  -1.996   8.623
   47    H    LEU   5           H        LEU   5  -1.951   0.151   4.502
   48    HA   LEU   5           HA       LEU   5  -4.678  -0.857   4.036
   49   1HB   LEU   5          2HB       LEU   5  -4.458   1.620   4.070
   50   2HB   LEU   5          1HB       LEU   5  -3.352   1.509   2.713
   51    HG   LEU   5           HG       LEU   5  -5.178   0.479   1.366
   52   1HD1  LEU   5          1HD1      LEU   5  -7.307   0.175   2.136
   53   2HD1  LEU   5          2HD1      LEU   5  -7.154   1.411   3.383
   54   3HD1  LEU   5          3HD1      LEU   5  -6.395  -0.164   3.606
   55   1HD2  LEU   5          1HD2      LEU   5  -6.096   3.115   2.464
   56   2HD2  LEU   5          2HD2      LEU   5  -6.189   2.510   0.810
   57   3HD2  LEU   5          3HD2      LEU   5  -4.631   2.978   1.492
   58    H    VAL   6           H        VAL   6  -5.046  -2.169   2.370
   59    HA   VAL   6           HA       VAL   6  -2.822  -2.665   0.501
   60    HB   VAL   6           HB       VAL   6  -4.945  -4.645   1.317
   61   1HG1  VAL   6          1HG1      VAL   6  -2.709  -4.654  -0.606
   62   2HG1  VAL   6          2HG1      VAL   6  -4.229  -5.547  -0.625
   63   3HG1  VAL   6          3HG1      VAL   6  -2.891  -6.107   0.377
   64   1HG2  VAL   6          1HG2      VAL   6  -3.466  -5.603   2.846
   65   2HG2  VAL   6          2HG2      VAL   6  -3.290  -3.870   3.122
   66   3HG2  VAL   6          3HG2      VAL   6  -2.078  -4.740   2.184
   67    H    VAL   7           H        VAL   7  -3.537  -1.194  -1.052
   68    HA   VAL   7           HA       VAL   7  -6.214  -1.428  -2.122
   69    HB   VAL   7           HB       VAL   7  -3.949   0.212  -3.255
   70   1HG1  VAL   7          1HG1      VAL   7  -6.078  -0.209  -4.575
   71   2HG1  VAL   7          2HG1      VAL   7  -5.602   1.474  -4.342
   72   3HG1  VAL   7          3HG1      VAL   7  -6.891   0.778  -3.361
   73   1HG2  VAL   7          1HG2      VAL   7  -5.871   0.895  -1.041
   74   2HG2  VAL   7          2HG2      VAL   7  -4.938   2.097  -1.931
   75   3HG2  VAL   7          3HG2      VAL   7  -4.109   0.872  -0.971
   76    H    ASP   8           H        ASP   8  -6.424  -3.388  -3.114
   77    HA   ASP   8           HA       ASP   8  -4.627  -3.893  -5.395
   78   1HB   ASP   8          2HB       ASP   8  -4.258  -5.488  -3.530
   79   2HB   ASP   8          1HB       ASP   8  -5.945  -5.977  -3.638
   80    H    ASP   9           H        ASP   9  -5.565  -4.192  -7.319
   81    HA   ASP   9           HA       ASP   9  -8.241  -3.566  -7.770
   82   1HB   ASP   9          2HB       ASP   9  -6.532  -3.364  -9.505
   83   2HB   ASP   9          1HB       ASP   9  -6.334  -5.112  -9.541
   84    H    GLU  10           H        GLU  10  -6.762  -6.780  -8.304
   85    HA   GLU  10           HA       GLU  10  -8.640  -8.232  -6.833
   86   1HB   GLU  10          2HB       GLU  10  -9.898  -7.217  -9.004
   87   2HB   GLU  10          1HB       GLU  10  -9.310  -8.735  -9.668
   88   1HG   GLU  10          2HG       GLU  10 -10.635  -8.891  -7.039
   89   2HG   GLU  10          1HG       GLU  10 -11.659  -8.470  -8.411
   90    H    GLU  11           H        GLU  11  -7.424  -9.912  -6.313
   91    HA   GLU  11           HA       GLU  11  -6.423 -11.696  -8.307
   92   1HB   GLU  11          2HB       GLU  11  -4.034 -11.433  -7.041
   93   2HB   GLU  11          1HB       GLU  11  -4.428 -10.681  -8.578
   94   1HG   GLU  11          2HG       GLU  11  -5.107  -8.640  -7.363
   95   2HG   GLU  11          1HG       GLU  11  -4.589  -9.402  -5.860
   96    H    SER  12           H        SER  12  -4.842 -11.265  -5.183
   97    HA   SER  12           HA       SER  12  -6.520 -12.882  -3.635
   98   1HB   SER  12          2HB       SER  12  -5.989 -14.697  -5.134
   99   2HB   SER  12          1HB       SER  12  -4.263 -14.372  -4.987
  100    HG   SER  12           HG       SER  12  -6.019 -15.317  -2.971
  101    H    ILE  13           H        ILE  13  -4.518 -10.602  -3.594
  102    HA   ILE  13           HA       ILE  13  -2.529 -11.495  -1.694
  103    HB   ILE  13           HB       ILE  13  -3.167  -8.792  -2.871
  104   1HG1  ILE  13          2HG1      ILE  13  -0.947  -9.030  -3.883
  105   2HG1  ILE  13          1HG1      ILE  13  -0.725 -10.571  -3.062
  106   1HG2  ILE  13          1HG2      ILE  13  -1.110  -9.464  -0.772
  107   2HG2  ILE  13          2HG2      ILE  13  -2.473  -8.358  -0.611
  108   3HG2  ILE  13          3HG2      ILE  13  -1.141  -7.963  -1.696
  109   1HD1  ILE  13          1HD1      ILE  13  -1.368 -10.671  -5.494
  110   2HD1  ILE  13          2HD1      ILE  13  -2.957 -10.082  -5.004
  111   3HD1  ILE  13          3HD1      ILE  13  -2.360 -11.621  -4.388
  112    H    THR  14           H        THR  14  -5.543  -9.677  -1.676
  113    HA   THR  14           HA       THR  14  -5.431  -8.681   0.935
  114    HB   THR  14           HB       THR  14  -7.888  -8.514   0.780
  115    HG1  THR  14           1HG      THR  14  -8.883  -9.309  -1.131
  116   1HG2  THR  14          1HG2      THR  14  -6.478  -6.853  -0.411
  117   2HG2  THR  14          2HG2      THR  14  -8.074  -7.091  -1.122
  118   3HG2  THR  14          3HG2      THR  14  -6.656  -7.823  -1.873
  119    H    SER  15           H        SER  15  -6.322 -11.839  -0.298
  120    HA   SER  15           HA       SER  15  -7.234 -12.735   2.315
  121   1HB   SER  15          2HB       SER  15  -8.202 -13.384  -0.040
  122   2HB   SER  15          1HB       SER  15  -6.900 -14.573  -0.025
  123    HG   SER  15           HG       SER  15  -8.754 -14.279   2.095
  124    H    SER  16           H        SER  16  -4.414 -11.976   1.927
  125    HA   SER  16           HA       SER  16  -3.241 -14.293   3.171
  126   1HB   SER  16          2HB       SER  16  -1.404 -14.561   1.585
  127   2HB   SER  16          1HB       SER  16  -2.945 -14.806   0.764
  128    HG   SER  16           HG       SER  16  -2.778 -12.618   0.037
  129    H    LEU  17           H        LEU  17  -2.198 -11.344   1.463
  130    HA   LEU  17           HA       LEU  17  -0.092 -10.685   3.165
  131   1HB   LEU  17          2HB       LEU  17  -0.305  -9.647   1.016
  132   2HB   LEU  17          1HB       LEU  17  -1.871  -8.980   1.425
  133    HG   LEU  17           HG       LEU  17   0.172  -7.416   1.372
  134   1HD1  LEU  17          1HD1      LEU  17  -0.799  -5.995   2.997
  135   2HD1  LEU  17          2HD1      LEU  17  -1.522  -7.354   3.851
  136   3HD1  LEU  17          3HD1      LEU  17  -2.109  -6.910   2.251
  137   1HD2  LEU  17          1HD2      LEU  17   1.284  -7.245   3.617
  138   2HD2  LEU  17          2HD2      LEU  17   1.747  -8.645   2.650
  139   3HD2  LEU  17          3HD2      LEU  17   0.618  -8.833   3.989
  140    H    SER  18           H        SER  18  -3.471  -9.541   3.232
  141    HA   SER  18           HA       SER  18  -3.271  -7.851   5.432
  142   1HB   SER  18          2HB       SER  18  -5.627  -7.923   5.558
  143   2HB   SER  18          1HB       SER  18  -5.278  -8.248   3.861
  144    HG   SER  18           HG       SER  18  -6.835  -9.684   4.944
  145    H    ALA  19           H        ALA  19  -3.970 -11.329   5.324
  146    HA   ALA  19           HA       ALA  19  -4.347 -11.728   8.071
  147   1HB   ALA  19          1HB       ALA  19  -4.932 -13.392   6.363
  148   2HB   ALA  19          2HB       ALA  19  -3.903 -14.079   7.621
  149   3HB   ALA  19          3HB       ALA  19  -3.217 -13.664   6.051
  150    H    ILE  20           H        ILE  20  -1.436 -11.717   6.085
  151    HA   ILE  20           HA       ILE  20   0.395 -12.667   7.960
  152    HB   ILE  20           HB       ILE  20   0.666 -10.853   5.582
  153   1HG1  ILE  20          2HG1      ILE  20   2.031 -13.474   6.087
  154   2HG1  ILE  20          1HG1      ILE  20   0.360 -13.414   5.536
  155   1HG2  ILE  20          1HG2      ILE  20   2.849 -11.585   7.524
  156   2HG2  ILE  20          2HG2      ILE  20   2.330  -9.970   7.041
  157   3HG2  ILE  20          3HG2      ILE  20   3.150 -11.016   5.882
  158   1HD1  ILE  20          1HD1      ILE  20   2.465 -11.913   4.054
  159   2HD1  ILE  20          2HD1      ILE  20   0.931 -12.566   3.477
  160   3HD1  ILE  20          3HD1      ILE  20   2.280 -13.651   3.818
  161    H    LEU  21           H        LEU  21  -0.102  -9.222   7.099
  162    HA   LEU  21           HA       LEU  21   1.375  -8.092   9.127
  163   1HB   LEU  21          2HB       LEU  21  -1.233  -7.088   7.998
  164   2HB   LEU  21          1HB       LEU  21  -0.073  -6.122   8.889
  165    HG   LEU  21           HG       LEU  21   1.152  -7.471   6.627
  166   1HD1  LEU  21          1HD1      LEU  21  -1.145  -7.197   5.746
  167   2HD1  LEU  21          2HD1      LEU  21   0.071  -6.269   4.867
  168   3HD1  LEU  21          3HD1      LEU  21  -0.997  -5.459   6.013
  169   1HD2  LEU  21          1HD2      LEU  21   0.911  -4.624   7.568
  170   2HD2  LEU  21          2HD2      LEU  21   1.849  -5.112   6.156
  171   3HD2  LEU  21          3HD2      LEU  21   2.284  -5.714   7.757
  172    H    GLU  22           H        GLU  22  -1.827  -9.485   9.248
  173    HA   GLU  22           HA       GLU  22  -2.605  -8.505  11.774
  174   1HB   GLU  22          2HB       GLU  22  -3.950  -9.748   9.894
  175   2HB   GLU  22          1HB       GLU  22  -3.502 -11.180  10.812
  176   1HG   GLU  22          2HG       GLU  22  -4.461  -9.280  12.659
  177   2HG   GLU  22          1HG       GLU  22  -5.588  -9.307  11.304
  178    H    GLU  23           H        GLU  23  -0.515 -11.100  10.776
  179    HA   GLU  23           HA       GLU  23  -0.516 -12.424  13.328
  180   1HB   GLU  23          2HB       GLU  23  -0.076 -13.823  11.471
  181   2HB   GLU  23          1HB       GLU  23   1.106 -12.706  10.805
  182   1HG   GLU  23          2HG       GLU  23   2.775 -13.553  12.015
  183   2HG   GLU  23          1HG       GLU  23   1.781 -13.705  13.463
  184    H    GLU  24           H        GLU  24   1.478 -10.087  11.609
  185    HA   GLU  24           HA       GLU  24   3.599 -10.065  13.491
  186   1HB   GLU  24          2HB       GLU  24   3.166  -8.970  10.994
  187   2HB   GLU  24          1HB       GLU  24   3.247  -7.569  12.053
  188   1HG   GLU  24          2HG       GLU  24   5.333  -9.690  11.643
  189   2HG   GLU  24          1HG       GLU  24   5.433  -7.979  11.234
  190    H    GLY  25           H        GLY  25   0.874  -7.850  12.929
  191   1HA   GLY  25          2HA       GLY  25  -0.163  -7.307  15.239
  192   2HA   GLY  25          1HA       GLY  25   1.416  -6.594  15.513
  193    H    TYR  26           H        TYR  26  -1.016  -6.561  12.903
  194    HA   TYR  26           HA       TYR  26  -0.980  -3.626  13.017
  195   1HB   TYR  26          2HB       TYR  26  -0.845  -5.238  10.462
  196   2HB   TYR  26          1HB       TYR  26  -0.932  -3.486  10.576
  197    HD1  TYR  26           1HD      TYR  26   1.003  -2.286  11.759
  198    HD2  TYR  26           2HD      TYR  26   1.223  -6.318  10.428
  199    HE1  TYR  26           1HE      TYR  26   3.456  -2.162  11.812
  200    HE2  TYR  26           2HE      TYR  26   3.677  -6.207  10.473
  201    HH   TYR  26           HH       TYR  26   5.397  -4.187  12.082
  202    H    HIS  27           H        HIS  27  -2.720  -2.957  11.140
  203    HA   HIS  27           HA       HIS  27  -5.129  -4.585  11.504
  204   1HB   HIS  27          2HB       HIS  27  -4.745  -2.338  13.005
  205   2HB   HIS  27          1HB       HIS  27  -5.579  -1.670  11.606
  206    HD1  HIS  27           1HD      HIS  27  -6.080  -3.877  14.565
  207    HD2  HIS  27           2HD      HIS  27  -8.257  -2.488  11.310
  208    HE1  HIS  27           1HE      HIS  27  -8.478  -4.440  15.071
  209    HE2  HIS  27           2HE      HIS  27  -9.771  -3.645  13.059
  210    HA   PRO  28           HA       PRO  28  -4.243  -3.426   7.066
  211   1HB   PRO  28          2HB       PRO  28  -5.708  -5.993   6.781
  212   2HB   PRO  28          1HB       PRO  28  -4.247  -5.430   5.962
  213   1HG   PRO  28          2HG       PRO  28  -4.114  -7.262   7.894
  214   2HG   PRO  28          1HG       PRO  28  -2.871  -6.007   7.731
  215   1HD   PRO  28          2HD       PRO  28  -5.113  -6.217   9.690
  216   2HD   PRO  28          1HD       PRO  28  -3.465  -5.601   9.923
  217    H    ASP  29           H        ASP  29  -5.665  -2.705   5.510
  218    HA   ASP  29           HA       ASP  29  -8.507  -2.839   6.170
  219   1HB   ASP  29          2HB       ASP  29  -7.050  -0.580   6.608
  220   2HB   ASP  29          1HB       ASP  29  -7.750  -0.274   5.022
  221    H    THR  30           H        THR  30  -6.426  -3.682   3.956
  222    HA   THR  30           HA       THR  30  -6.429  -3.301   1.574
  223    HB   THR  30           HB       THR  30  -7.073  -5.415   0.853
  224    HG1  THR  30           1HG      THR  30  -9.022  -5.311   2.898
  225   1HG2  THR  30          1HG2      THR  30  -6.032  -6.800   2.288
  226   2HG2  THR  30          2HG2      THR  30  -6.969  -6.248   3.677
  227   3HG2  THR  30          3HG2      THR  30  -5.613  -5.285   3.087
  228    H    ALA  31           H        ALA  31  -7.305  -2.291  -0.034
  229    HA   ALA  31           HA       ALA  31 -10.234  -2.091  -0.227
  230   1HB   ALA  31          1HB       ALA  31  -9.768   0.050   0.516
  231   2HB   ALA  31          2HB       ALA  31  -9.697   0.255  -1.233
  232   3HB   ALA  31          3HB       ALA  31  -8.207   0.107  -0.301
  233    H    LYS  32           H        LYS  32 -10.908  -1.426  -2.492
  234    HA   LYS  32           HA       LYS  32  -9.478  -3.074  -4.378
  235   1HB   LYS  32          2HB       LYS  32 -11.802  -1.274  -5.043
  236   2HB   LYS  32          1HB       LYS  32 -11.307  -2.757  -5.846
  237   1HG   LYS  32          2HG       LYS  32 -11.978  -4.049  -3.888
  238   2HG   LYS  32          1HG       LYS  32 -12.471  -2.562  -3.076
  239   1HD   LYS  32          2HD       LYS  32 -14.472  -3.381  -3.933
  240   2HD   LYS  32          1HD       LYS  32 -13.973  -2.202  -5.149
  241   1HE   LYS  32          2HE       LYS  32 -12.762  -4.404  -6.107
  242   2HE   LYS  32          1HE       LYS  32 -14.148  -5.145  -5.310
  243   1HZ   LYS  32          1HZ       LYS  32 -15.628  -3.823  -6.608
  244   2HZ   LYS  32          2HZ       LYS  32 -14.534  -4.560  -7.669
  245   3HZ   LYS  32          3HZ       LYS  32 -14.355  -2.927  -7.270
  246    H    THR  33           H        THR  33  -9.882  -1.634  -6.771
  247    HA   THR  33           HA       THR  33  -7.530  -0.311  -7.086
  248    HB   THR  33           HB       THR  33  -9.858   0.716  -8.637
  249    HG1  THR  33           1HG      THR  33  -9.892  -1.261  -9.802
  250   1HG2  THR  33          1HG2      THR  33  -7.017   0.150  -9.112
  251   2HG2  THR  33          2HG2      THR  33  -8.067   1.384  -9.807
  252   3HG2  THR  33          3HG2      THR  33  -8.111  -0.266 -10.431
  253    H    LEU  34           H        LEU  34  -7.213   1.997  -7.725
  254    HA   LEU  34           HA       LEU  34  -7.172   3.707  -5.682
  255   1HB   LEU  34          2HB       LEU  34  -7.844   4.718  -8.435
  256   2HB   LEU  34          1HB       LEU  34  -6.885   5.511  -7.200
  257    HG   LEU  34           HG       LEU  34  -6.089   3.066  -8.782
  258   1HD1  LEU  34          1HD1      LEU  34  -4.213   4.720  -9.424
  259   2HD1  LEU  34          2HD1      LEU  34  -5.356   5.960  -8.908
  260   3HD1  LEU  34          3HD1      LEU  34  -5.784   4.855 -10.214
  261   1HD2  LEU  34          1HD2      LEU  34  -5.012   4.280  -6.315
  262   2HD2  LEU  34          2HD2      LEU  34  -3.836   3.829  -7.550
  263   3HD2  LEU  34          3HD2      LEU  34  -4.934   2.615  -6.892
  264    H    ARG  35           H        ARG  35 -10.009   3.172  -7.700
  265    HA   ARG  35           HA       ARG  35 -11.580   5.317  -6.891
  266   1HB   ARG  35          2HB       ARG  35 -12.327   2.484  -7.620
  267   2HB   ARG  35          1HB       ARG  35 -13.528   3.728  -7.299
  268   1HG   ARG  35          2HG       ARG  35 -12.529   5.086  -9.121
  269   2HG   ARG  35          1HG       ARG  35 -11.461   3.730  -9.486
  270   1HD   ARG  35          2HD       ARG  35 -14.459   3.481  -9.436
  271   2HD   ARG  35          1HD       ARG  35 -13.562   3.921 -10.889
  272    HE   ARG  35           HE       ARG  35 -12.352   1.641 -10.053
  273   1HH1  ARG  35          1HH1      ARG  35 -15.662   2.501 -10.744
  274   2HH1  ARG  35          2HH1      ARG  35 -16.104   0.904 -11.244
  275   1HH2  ARG  35          1HH2      ARG  35 -12.931  -0.461 -10.712
  276   2HH2  ARG  35          2HH2      ARG  35 -14.554  -0.779 -11.227
  277    H    GLU  36           H        GLU  36 -11.736   2.015  -5.556
  278    HA   GLU  36           HA       GLU  36 -13.223   2.760  -3.273
  279   1HB   GLU  36          2HB       GLU  36 -11.625   0.335  -4.025
  280   2HB   GLU  36          1HB       GLU  36 -12.292   0.492  -2.407
  281   1HG   GLU  36          2HG       GLU  36 -13.788  -0.802  -3.751
  282   2HG   GLU  36          1HG       GLU  36 -14.537   0.753  -3.394
  283    H    ALA  37           H        ALA  37  -9.777   2.545  -3.942
  284    HA   ALA  37           HA       ALA  37  -8.863   2.682  -1.277
  285   1HB   ALA  37          1HB       ALA  37  -7.093   4.043  -3.110
  286   2HB   ALA  37          2HB       ALA  37  -7.693   2.539  -3.808
  287   3HB   ALA  37          3HB       ALA  37  -6.866   2.520  -2.252
  288    H    GLU  38           H        GLU  38  -8.830   5.305  -3.699
  289    HA   GLU  38           HA       GLU  38  -8.241   7.416  -2.099
  290   1HB   GLU  38          2HB       GLU  38  -9.886   7.130  -4.543
  291   2HB   GLU  38          1HB       GLU  38 -10.037   8.640  -3.655
  292   1HG   GLU  38          2HG       GLU  38  -7.368   8.438  -3.744
  293   2HG   GLU  38          1HG       GLU  38  -7.784   7.579  -5.227
  294    H    LYS  39           H        LYS  39 -11.418   5.924  -2.498
  295    HA   LYS  39           HA       LYS  39 -12.860   7.736  -0.897
  296   1HB   LYS  39          2HB       LYS  39 -13.890   6.032  -2.388
  297   2HB   LYS  39          1HB       LYS  39 -13.379   4.781  -1.263
  298   1HG   LYS  39          2HG       LYS  39 -15.088   7.047  -0.329
  299   2HG   LYS  39          1HG       LYS  39 -15.801   5.663  -1.162
  300   1HD   LYS  39          2HD       LYS  39 -14.437   4.269   0.565
  301   2HD   LYS  39          1HD       LYS  39 -14.408   5.776   1.483
  302   1HE   LYS  39          2HE       LYS  39 -17.027   4.926   0.403
  303   2HE   LYS  39          1HE       LYS  39 -16.359   3.953   1.712
  304   1HZ   LYS  39          1HZ       LYS  39 -17.521   5.540   2.859
  305   2HZ   LYS  39          2HZ       LYS  39 -17.204   6.766   1.736
  306   3HZ   LYS  39          3HZ       LYS  39 -15.994   6.265   2.805
  307    H    LYS  40           H        LYS  40 -11.348   4.618  -0.113
  308    HA   LYS  40           HA       LYS  40 -11.909   4.690   2.647
  309   1HB   LYS  40          2HB       LYS  40  -9.794   3.233   1.072
  310   2HB   LYS  40          1HB       LYS  40 -10.051   2.992   2.794
  311   1HG   LYS  40          2HG       LYS  40 -12.272   2.638   0.814
  312   2HG   LYS  40          1HG       LYS  40 -11.135   1.341   1.179
  313   1HD   LYS  40          2HD       LYS  40 -12.403   2.731   3.472
  314   2HD   LYS  40          1HD       LYS  40 -13.421   1.658   2.511
  315   1HE   LYS  40          2HE       LYS  40 -11.017   0.272   2.929
  316   2HE   LYS  40          1HE       LYS  40 -11.426   1.009   4.479
  317   1HZ   LYS  40          1HZ       LYS  40 -13.656   0.018   4.266
  318   2HZ   LYS  40          2HZ       LYS  40 -12.430  -1.146   4.329
  319   3HZ   LYS  40          3HZ       LYS  40 -13.162  -0.767   2.851
  320    H    ILE  41           H        ILE  41  -9.238   5.954   0.741
  321    HA   ILE  41           HA       ILE  41  -7.718   6.687   3.098
  322    HB   ILE  41           HB       ILE  41  -7.172   7.471   0.246
  323   1HG1  ILE  41          2HG1      ILE  41  -6.033   5.100   1.732
  324   2HG1  ILE  41          1HG1      ILE  41  -7.380   4.980   0.605
  325   1HG2  ILE  41          1HG2      ILE  41  -5.661   7.622   2.806
  326   2HG2  ILE  41          2HG2      ILE  41  -5.777   8.793   1.492
  327   3HG2  ILE  41          3HG2      ILE  41  -4.770   7.357   1.307
  328   1HD1  ILE  41          1HD1      ILE  41  -5.910   4.702  -1.018
  329   2HD1  ILE  41          2HD1      ILE  41  -4.570   5.024   0.082
  330   3HD1  ILE  41          3HD1      ILE  41  -5.364   6.358  -0.757
  331    H    LYS  42           H        LYS  42 -10.322   8.031   1.499
  332    HA   LYS  42           HA       LYS  42  -9.493  10.792   1.947
  333   1HB   LYS  42          2HB       LYS  42 -11.618   9.462   0.385
  334   2HB   LYS  42          1HB       LYS  42 -12.005  11.041   1.053
  335   1HG   LYS  42          2HG       LYS  42  -9.667  11.663  -0.008
  336   2HG   LYS  42          1HG       LYS  42 -10.056  10.295  -1.052
  337   1HD   LYS  42          2HD       LYS  42 -12.405  11.826  -0.862
  338   2HD   LYS  42          1HD       LYS  42 -11.089  12.977  -1.101
  339   1HE   LYS  42          2HE       LYS  42 -11.907  12.338  -3.253
  340   2HE   LYS  42          1HE       LYS  42 -10.327  11.589  -3.030
  341   1HZ   LYS  42          1HZ       LYS  42 -11.400   9.514  -2.489
  342   2HZ   LYS  42          2HZ       LYS  42 -11.960  10.062  -3.989
  343   3HZ   LYS  42          3HZ       LYS  42 -12.931  10.222  -2.614
  344    H    GLU  43           H        GLU  43  -9.918   8.983   4.190
  345    HA   GLU  43           HA       GLU  43 -11.778  10.652   5.667
  346   1HB   GLU  43          2HB       GLU  43 -12.113   7.649   5.596
  347   2HB   GLU  43          1HB       GLU  43 -13.050   8.777   6.568
  348   1HG   GLU  43          2HG       GLU  43 -13.958   9.783   4.546
  349   2HG   GLU  43          1HG       GLU  43 -13.002   8.678   3.559
  350    H    LEU  44           H        LEU  44  -9.791   7.693   5.899
  351    HA   LEU  44           HA       LEU  44  -8.946   8.560   8.572
  352   1HB   LEU  44          2HB       LEU  44  -9.687   6.399   8.822
  353   2HB   LEU  44          1HB       LEU  44  -9.195   5.926   7.209
  354    HG   LEU  44           HG       LEU  44  -7.081   6.513   9.234
  355   1HD1  LEU  44          1HD1      LEU  44  -7.260   3.927   9.637
  356   2HD1  LEU  44          2HD1      LEU  44  -8.960   4.211   9.263
  357   3HD1  LEU  44          3HD1      LEU  44  -8.197   5.067  10.604
  358   1HD2  LEU  44          1HD2      LEU  44  -7.003   4.230   7.363
  359   2HD2  LEU  44          2HD2      LEU  44  -5.735   5.364   7.825
  360   3HD2  LEU  44          3HD2      LEU  44  -6.957   5.840   6.647
  361    H    PHE  45           H        PHE  45  -6.712   8.426   9.160
  362    HA   PHE  45           HA       PHE  45  -4.951   9.153   6.946
  363   1HB   PHE  45          2HB       PHE  45  -5.152  10.556   9.049
  364   2HB   PHE  45          1HB       PHE  45  -4.331   9.253   9.901
  365    HD1  PHE  45           1HD      PHE  45  -3.940  11.572   7.022
  366    HD2  PHE  45           2HD      PHE  45  -2.018   9.195   9.983
  367    HE1  PHE  45           1HE      PHE  45  -1.768  12.526   6.372
  368    HE2  PHE  45           2HE      PHE  45   0.159  10.145   9.339
  369    HZ   PHE  45           HZ       PHE  45   0.287  11.812   7.531
  370    H    PHE  46           H        PHE  46  -4.597   7.089   6.054
  371    HA   PHE  46           HA       PHE  46  -3.669   4.883   7.583
  372   1HB   PHE  46          2HB       PHE  46  -3.828   5.514   4.660
  373   2HB   PHE  46          1HB       PHE  46  -2.904   4.115   5.195
  374    HD1  PHE  46           1HD      PHE  46  -6.041   5.230   4.149
  375    HD2  PHE  46           2HD      PHE  46  -4.195   2.543   6.884
  376    HE1  PHE  46           1HE      PHE  46  -8.114   3.909   4.243
  377    HE2  PHE  46           2HE      PHE  46  -6.266   1.216   6.984
  378    HZ   PHE  46           HZ       PHE  46  -8.230   1.902   5.665
  379    HA   PRO  47           HA       PRO  47   0.577   6.288   7.901
  380   1HB   PRO  47          2HB       PRO  47   1.528   4.229   9.339
  381   2HB   PRO  47          1HB       PRO  47   0.453   5.437  10.053
  382   1HG   PRO  47          2HG       PRO  47  -0.184   2.694   9.042
  383   2HG   PRO  47          1HG       PRO  47  -0.740   3.497  10.522
  384   1HD   PRO  47          2HD       PRO  47  -2.236   3.330   8.238
  385   2HD   PRO  47          1HD       PRO  47  -2.399   4.639   9.424
  386    H    VAL  48           H        VAL  48  -0.455   3.193   6.664
  387    HA   VAL  48           HA       VAL  48   1.851   3.157   4.865
  388    HB   VAL  48           HB       VAL  48   0.890   0.603   6.118
  389   1HG1  VAL  48          1HG1      VAL  48   3.047   1.448   4.300
  390   2HG1  VAL  48          2HG1      VAL  48   2.204  -0.097   4.425
  391   3HG1  VAL  48          3HG1      VAL  48   3.511   0.286   5.544
  392   1HG2  VAL  48          1HG2      VAL  48   1.563   1.770   8.020
  393   2HG2  VAL  48          2HG2      VAL  48   2.886   2.572   7.171
  394   3HG2  VAL  48          3HG2      VAL  48   2.995   0.852   7.551
  395    H    ILE  49           H        ILE  49   1.324   2.739   2.844
  396    HA   ILE  49           HA       ILE  49  -1.319   1.587   2.259
  397    HB   ILE  49           HB       ILE  49   0.095   3.466   0.387
  398   1HG1  ILE  49          2HG1      ILE  49  -0.178   4.633   2.553
  399   2HG1  ILE  49          1HG1      ILE  49  -1.194   5.324   1.292
  400   1HG2  ILE  49          1HG2      ILE  49  -2.800   2.707   0.742
  401   2HG2  ILE  49          2HG2      ILE  49  -1.714   2.119  -0.517
  402   3HG2  ILE  49          3HG2      ILE  49  -2.169   3.822  -0.469
  403   1HD1  ILE  49          1HD1      ILE  49  -2.064   3.489   3.508
  404   2HD1  ILE  49          2HD1      ILE  49  -3.103   4.041   2.194
  405   3HD1  ILE  49          3HD1      ILE  49  -2.432   5.205   3.335
  406    H    VAL  50           H        VAL  50  -1.472   0.294   0.369
  407    HA   VAL  50           HA       VAL  50   1.030  -0.532  -0.892
  408    HB   VAL  50           HB       VAL  50  -0.869  -2.525   0.355
  409   1HG1  VAL  50          1HG1      VAL  50   1.767  -3.434  -0.517
  410   2HG1  VAL  50          2HG1      VAL  50   0.741  -2.875  -1.838
  411   3HG1  VAL  50          3HG1      VAL  50   0.178  -4.158  -0.766
  412   1HG2  VAL  50          1HG2      VAL  50   0.881  -3.001   1.934
  413   2HG2  VAL  50          2HG2      VAL  50   0.520  -1.276   1.988
  414   3HG2  VAL  50          3HG2      VAL  50   1.960  -1.849   1.146
  415    H    LEU  51           H        LEU  51   0.587  -0.065  -2.931
  416    HA   LEU  51           HA       LEU  51  -2.084  -0.603  -3.990
  417   1HB   LEU  51          2HB       LEU  51  -1.194   1.608  -4.416
  418   2HB   LEU  51          1HB       LEU  51   0.251   0.925  -5.138
  419    HG   LEU  51           HG       LEU  51  -1.041   0.067  -7.009
  420   1HD1  LEU  51          1HD1      LEU  51  -3.148  -0.500  -6.412
  421   2HD1  LEU  51          2HD1      LEU  51  -3.497   1.119  -7.016
  422   3HD1  LEU  51          3HD1      LEU  51  -3.310   0.847  -5.284
  423   1HD2  LEU  51          1HD2      LEU  51  -2.010   2.870  -6.754
  424   2HD2  LEU  51          2HD2      LEU  51  -1.240   2.060  -8.118
  425   3HD2  LEU  51          3HD2      LEU  51  -0.273   2.566  -6.734
  426    H    ASP  52           H        ASP  52  -1.923  -2.871  -4.121
  427    HA   ASP  52           HA       ASP  52   0.141  -4.211  -5.528
  428   1HB   ASP  52          2HB       ASP  52  -1.868  -5.019  -3.882
  429   2HB   ASP  52          1HB       ASP  52  -2.510  -5.507  -5.446
  430    H    VAL  53           H        VAL  53   0.130  -2.669  -7.381
  431    HA   VAL  53           HA       VAL  53  -1.899  -2.387  -9.233
  432    HB   VAL  53           HB       VAL  53   0.062  -1.030  -9.438
  433   1HG1  VAL  53          1HG1      VAL  53   2.236  -1.768  -9.748
  434   2HG1  VAL  53          2HG1      VAL  53   1.724  -3.353 -10.323
  435   3HG1  VAL  53          3HG1      VAL  53   1.580  -2.948  -8.615
  436   1HG2  VAL  53          1HG2      VAL  53   0.095  -0.907 -11.695
  437   2HG2  VAL  53          2HG2      VAL  53  -1.196  -2.102 -11.554
  438   3HG2  VAL  53          3HG2      VAL  53   0.456  -2.623 -11.890
  439    H    TRP  54           H        TRP  54  -2.995  -4.401  -9.408
  440    HA   TRP  54           HA       TRP  54  -1.691  -6.739 -10.407
  441   1HB   TRP  54          2HB       TRP  54  -3.709  -6.974  -9.088
  442   2HB   TRP  54          1HB       TRP  54  -4.618  -5.986 -10.225
  443    HD1  TRP  54           HD       TRP  54  -6.283  -7.553 -11.370
  444    HE1  TRP  54           1HE      TRP  54  -6.164  -9.860 -12.500
  445    HE3  TRP  54           3HE      TRP  54  -1.408  -8.708 -10.348
  446    HZ2  TRP  54           2HZ      TRP  54  -4.257 -11.903 -12.907
  447    HZ3  TRP  54           3HZ      TRP  54  -0.515 -10.858 -11.144
  448    HH2  TRP  54           HH       TRP  54  -1.911 -12.422 -12.396
  449    H    MET  55           H        MET  55  -4.456  -5.177 -11.982
  450    HA   MET  55           HA       MET  55  -2.993  -4.561 -14.365
  451   1HB   MET  55          2HB       MET  55  -4.324  -6.081 -15.837
  452   2HB   MET  55          1HB       MET  55  -3.187  -6.913 -14.786
  453   1HG   MET  55          2HG       MET  55  -4.797  -8.092 -13.832
  454   2HG   MET  55          1HG       MET  55  -5.768  -6.653 -13.527
  455   1HE   MET  55          1HE       MET  55  -4.403  -8.958 -16.025
  456   2HE   MET  55          2HE       MET  55  -5.350  -8.673 -17.485
  457   3HE   MET  55          3HE       MET  55  -5.856  -9.909 -16.335
  458    HA   PRO  56           HA       PRO  56  -7.101  -2.416 -13.773
  459   1HB   PRO  56          2HB       PRO  56  -6.021  -0.148 -12.474
  460   2HB   PRO  56          1HB       PRO  56  -6.964  -1.440 -11.735
  461   1HG   PRO  56          2HG       PRO  56  -4.272  -0.870 -11.238
  462   2HG   PRO  56          1HG       PRO  56  -5.125  -2.354 -10.788
  463   1HD   PRO  56          2HD       PRO  56  -3.331  -1.826 -13.114
  464   2HD   PRO  56          1HD       PRO  56  -3.534  -3.304 -12.154
  465    H    ASP  57           H        ASP  57  -7.036   0.410 -13.915
  466    HA   ASP  57           HA       ASP  57  -5.316   1.225 -16.067
  467   1HB   ASP  57          2HB       ASP  57  -7.179   1.714 -17.651
  468   2HB   ASP  57          1HB       ASP  57  -6.922  -0.007 -17.386
  469    H    GLY  58           H        GLY  58  -5.465   2.324 -13.617
  470   1HA   GLY  58          2HA       GLY  58  -7.006   4.807 -14.060
  471   2HA   GLY  58          1HA       GLY  58  -6.765   4.104 -12.469
  472    H    ASP  59           H        ASP  59  -4.017   3.806 -14.433
  473    HA   ASP  59           HA       ASP  59  -1.929   4.697 -14.253
  474   1HB   ASP  59          2HB       ASP  59  -3.770   6.835 -14.878
  475   2HB   ASP  59          1HB       ASP  59  -2.409   7.451 -13.945
  476    H    GLY  60           H        GLY  60  -1.682   3.701 -12.142
  477   1HA   GLY  60          2HA       GLY  60  -2.266   5.014  -9.724
  478   2HA   GLY  60          1HA       GLY  60  -1.084   3.733  -9.928
  479    H    VAL  61           H        VAL  61   0.275   5.547 -12.006
  480    HA   VAL  61           HA       VAL  61   2.344   6.485 -10.467
  481    HB   VAL  61           HB       VAL  61   1.425   7.758 -13.043
  482   1HG1  VAL  61          1HG1      VAL  61   3.972   7.734 -11.489
  483   2HG1  VAL  61          2HG1      VAL  61   3.133   9.086 -12.249
  484   3HG1  VAL  61          3HG1      VAL  61   4.008   7.921 -13.242
  485   1HG2  VAL  61          1HG2      VAL  61   2.702   5.137 -12.479
  486   2HG2  VAL  61          2HG2      VAL  61   3.275   6.047 -13.876
  487   3HG2  VAL  61          3HG2      VAL  61   1.574   5.596 -13.755
  488    H    ASN  62           H        ASN  62  -0.530   8.263 -11.552
  489    HA   ASN  62           HA       ASN  62   0.263  10.712 -10.307
  490   1HB   ASN  62          2HB       ASN  62  -1.871   9.802 -12.019
  491   2HB   ASN  62          1HB       ASN  62  -2.532  10.743 -10.685
  492   1HD2  ASN  62          1HD2      ASN  62  -0.850  10.816 -13.637
  493   2HD2  ASN  62          2HD2      ASN  62  -0.571  12.520 -13.707
  494    H    PHE  63           H        PHE  63  -1.418   7.869  -9.282
  495    HA   PHE  63           HA       PHE  63  -2.902   8.899  -7.140
  496   1HB   PHE  63          2HB       PHE  63  -3.144   6.605  -8.069
  497   2HB   PHE  63          1HB       PHE  63  -1.606   6.173  -7.332
  498    HD1  PHE  63           1HD      PHE  63  -4.391   8.202  -5.941
  499    HD2  PHE  63           2HD      PHE  63  -2.149   4.591  -5.729
  500    HE1  PHE  63           1HE      PHE  63  -5.562   7.601  -3.863
  501    HE2  PHE  63           2HE      PHE  63  -3.316   3.984  -3.650
  502    HZ   PHE  63           HZ       PHE  63  -5.026   5.489  -2.716
  503    H    ILE  64           H        ILE  64   0.456   7.824  -7.342
  504    HA   ILE  64           HA       ILE  64   1.204   7.708  -4.715
  505    HB   ILE  64           HB       ILE  64   2.767   8.855  -7.029
  506   1HG1  ILE  64          2HG1      ILE  64   3.776   6.363  -6.174
  507   2HG1  ILE  64          1HG1      ILE  64   2.025   6.188  -6.228
  508   1HG2  ILE  64          1HG2      ILE  64   4.779   8.396  -5.657
  509   2HG2  ILE  64          2HG2      ILE  64   3.726   8.061  -4.283
  510   3HG2  ILE  64          3HG2      ILE  64   3.761   9.674  -4.995
  511   1HD1  ILE  64          1HD1      ILE  64   3.698   7.226  -8.499
  512   2HD1  ILE  64          2HD1      ILE  64   1.977   6.846  -8.528
  513   3HD1  ILE  64          3HD1      ILE  64   3.160   5.556  -8.326
  514    H    ASP  65           H        ASP  65   0.403  10.557  -6.560
  515    HA   ASP  65           HA       ASP  65   1.533  12.419  -4.698
  516   1HB   ASP  65          2HB       ASP  65   1.197  12.990  -7.078
  517   2HB   ASP  65          1HB       ASP  65  -0.545  12.867  -6.855
  518    H    PHE  66           H        PHE  66  -1.702  11.105  -5.300
  519    HA   PHE  66           HA       PHE  66  -3.132  12.716  -3.528
  520   1HB   PHE  66          2HB       PHE  66  -4.400  11.379  -5.002
  521   2HB   PHE  66          1HB       PHE  66  -3.543   9.910  -4.550
  522    HD1  PHE  66           1HD      PHE  66  -3.966   8.903  -2.300
  523    HD2  PHE  66           2HD      PHE  66  -6.354  12.050  -3.882
  524    HE1  PHE  66           1HE      PHE  66  -5.743   8.356  -0.693
  525    HE2  PHE  66           2HE      PHE  66  -8.139  11.508  -2.278
  526    HZ   PHE  66           HZ       PHE  66  -7.835   9.658  -0.679
  527    H    ILE  67           H        ILE  67  -1.357   9.701  -2.983
  528    HA   ILE  67           HA       ILE  67  -2.096   9.354  -0.283
  529    HB   ILE  67           HB       ILE  67   0.360   8.417  -1.775
  530   1HG1  ILE  67          2HG1      ILE  67  -1.039   6.194  -1.327
  531   2HG1  ILE  67          1HG1      ILE  67  -2.377   7.336  -1.292
  532   1HG2  ILE  67          1HG2      ILE  67   1.182   8.109   0.309
  533   2HG2  ILE  67          2HG2      ILE  67   0.152   6.679   0.265
  534   3HG2  ILE  67          3HG2      ILE  67  -0.412   8.148   1.061
  535   1HD1  ILE  67          1HD1      ILE  67  -0.562   7.678  -3.558
  536   2HD1  ILE  67          2HD1      ILE  67  -2.324   7.642  -3.502
  537   3HD1  ILE  67          3HD1      ILE  67  -1.412   6.133  -3.519
  538    H    LYS  68           H        LYS  68   0.598  11.061  -1.824
  539    HA   LYS  68           HA       LYS  68   1.712  11.856   0.717
  540   1HB   LYS  68          2HB       LYS  68   3.484  12.788  -0.482
  541   2HB   LYS  68          1HB       LYS  68   3.012  11.402  -1.451
  542   1HG   LYS  68          2HG       LYS  68   2.804  12.727  -3.199
  543   2HG   LYS  68          1HG       LYS  68   1.503  13.588  -2.378
  544   1HD   LYS  68          2HD       LYS  68   2.897  15.268  -1.639
  545   2HD   LYS  68          1HD       LYS  68   4.337  14.250  -1.720
  546   1HE   LYS  68          2HE       LYS  68   4.652  14.634  -3.945
  547   2HE   LYS  68          1HE       LYS  68   2.929  14.833  -4.265
  548   1HZ   LYS  68          1HZ       LYS  68   3.160  16.991  -2.966
  549   2HZ   LYS  68          2HZ       LYS  68   3.829  16.951  -4.519
  550   3HZ   LYS  68          3HZ       LYS  68   4.832  16.808  -3.163
  551    H    GLU  69           H        GLU  69  -0.794  12.938  -1.249
  552    HA   GLU  69           HA       GLU  69  -0.559  15.748  -0.739
  553   1HB   GLU  69          2HB       GLU  69  -1.767  14.668  -2.698
  554   2HB   GLU  69          1HB       GLU  69  -3.048  14.269  -1.565
  555   1HG   GLU  69          2HG       GLU  69  -3.090  16.768  -1.023
  556   2HG   GLU  69          1HG       GLU  69  -2.147  16.965  -2.499
  557    H    ASN  70           H        ASN  70  -2.378  13.054   0.615
  558    HA   ASN  70           HA       ASN  70  -3.190  14.797   2.848
  559   1HB   ASN  70          2HB       ASN  70  -4.668  12.282   2.131
  560   2HB   ASN  70          1HB       ASN  70  -5.242  13.686   3.025
  561   1HD2  ASN  70          1HD2      ASN  70  -4.117  12.689  -0.177
  562   2HD2  ASN  70          2HD2      ASN  70  -5.143  13.756  -1.065
  563    H    SER  71           H        SER  71  -0.908  12.701   2.179
  564    HA   SER  71           HA       SER  71  -0.669  11.794   4.899
  565   1HB   SER  71          2HB       SER  71  -1.656  10.005   2.810
  566   2HB   SER  71          1HB       SER  71  -0.205   9.387   3.598
  567    HG   SER  71           HG       SER  71  -1.242   9.334   5.506
  568    HA   PRO  72           HA       PRO  72   3.281  12.559   2.547
  569   1HB   PRO  72          2HB       PRO  72   3.876  14.666   4.436
  570   2HB   PRO  72          1HB       PRO  72   3.654  14.785   2.690
  571   1HG   PRO  72          2HG       PRO  72   1.913  15.832   4.525
  572   2HG   PRO  72          1HG       PRO  72   1.450  15.348   2.885
  573   1HD   PRO  72          2HD       PRO  72   1.074  13.893   5.471
  574   2HD   PRO  72          1HD       PRO  72  -0.024  14.026   4.080
  575    H    ASP  73           H        ASP  73   2.346  11.962   5.756
  576    HA   ASP  73           HA       ASP  73   5.074  11.167   6.506
  577   1HB   ASP  73          2HB       ASP  73   3.426  12.790   7.888
  578   2HB   ASP  73          1HB       ASP  73   2.983  11.234   8.583
  579    H    SER  74           H        SER  74   3.237   9.630   4.824
  580    HA   SER  74           HA       SER  74   2.683   7.326   6.561
  581   1HB   SER  74          2HB       SER  74   0.760   8.211   5.283
  582   2HB   SER  74          1HB       SER  74   1.637   7.920   3.782
  583    HG   SER  74           HG       SER  74   0.190   6.202   5.261
  584    H    VAL  75           H        VAL  75   2.538   5.487   4.322
  585    HA   VAL  75           HA       VAL  75   5.242   5.468   3.237
  586    HB   VAL  75           HB       VAL  75   4.251   3.101   4.826
  587   1HG1  VAL  75          1HG1      VAL  75   6.233   3.407   2.799
  588   2HG1  VAL  75          2HG1      VAL  75   5.820   1.967   3.728
  589   3HG1  VAL  75          3HG1      VAL  75   7.048   3.082   4.329
  590   1HG2  VAL  75          1HG2      VAL  75   4.787   4.679   6.463
  591   2HG2  VAL  75          2HG2      VAL  75   6.124   5.342   5.523
  592   3HG2  VAL  75          3HG2      VAL  75   6.277   3.754   6.275
  593    H    VAL  76           H        VAL  76   5.427   4.494   1.332
  594    HA   VAL  76           HA       VAL  76   3.080   3.009   0.327
  595    HB   VAL  76           HB       VAL  76   4.778   4.466  -1.626
  596   1HG1  VAL  76          1HG1      VAL  76   2.729   2.917  -2.027
  597   2HG1  VAL  76          2HG1      VAL  76   2.902   4.402  -2.962
  598   3HG1  VAL  76          3HG1      VAL  76   1.797   4.349  -1.589
  599   1HG2  VAL  76          1HG2      VAL  76   2.776   5.818   0.177
  600   2HG2  VAL  76          2HG2      VAL  76   3.348   6.502  -1.345
  601   3HG2  VAL  76          3HG2      VAL  76   4.481   6.218  -0.024
  602    H    ILE  77           H        ILE  77   3.593   0.958   0.081
  603    HA   ILE  77           HA       ILE  77   6.269   0.278  -0.942
  604    HB   ILE  77           HB       ILE  77   4.433  -1.507   0.661
  605   1HG1  ILE  77          2HG1      ILE  77   5.268   0.415   1.984
  606   2HG1  ILE  77          1HG1      ILE  77   5.925  -1.118   2.547
  607   1HG2  ILE  77          1HG2      ILE  77   5.753  -3.048  -0.325
  608   2HG2  ILE  77          2HG2      ILE  77   6.902  -2.555   0.919
  609   3HG2  ILE  77          3HG2      ILE  77   7.018  -1.878  -0.705
  610   1HD1  ILE  77          1HD1      ILE  77   7.934  -0.547   1.037
  611   2HD1  ILE  77          2HD1      ILE  77   7.755   0.287   2.581
  612   3HD1  ILE  77          3HD1      ILE  77   7.293   1.095   1.083
  613    H    VAL  78           H        VAL  78   4.361   1.055  -2.742
  614    HA   VAL  78           HA       VAL  78   2.604  -0.712  -3.841
  615    HB   VAL  78           HB       VAL  78   4.532   1.014  -5.411
  616   1HG1  VAL  78          1HG1      VAL  78   1.775   0.515  -6.354
  617   2HG1  VAL  78          2HG1      VAL  78   2.894  -0.842  -6.461
  618   3HG1  VAL  78          3HG1      VAL  78   3.274   0.680  -7.266
  619   1HG2  VAL  78          1HG2      VAL  78   2.020   1.620  -3.916
  620   2HG2  VAL  78          2HG2      VAL  78   2.411   2.532  -5.373
  621   3HG2  VAL  78          3HG2      VAL  78   3.525   2.535  -4.005
  622    H    ILE  79           H        ILE  79   2.790  -2.772  -4.380
  623    HA   ILE  79           HA       ILE  79   5.385  -3.783  -5.323
  624    HB   ILE  79           HB       ILE  79   3.193  -5.648  -4.527
  625   1HG1  ILE  79          2HG1      ILE  79   4.964  -4.285  -2.494
  626   2HG1  ILE  79          1HG1      ILE  79   3.280  -3.852  -2.768
  627   1HG2  ILE  79          1HG2      ILE  79   5.536  -6.492  -3.395
  628   2HG2  ILE  79          2HG2      ILE  79   6.099  -5.669  -4.848
  629   3HG2  ILE  79          3HG2      ILE  79   4.939  -6.989  -4.974
  630   1HD1  ILE  79          1HD1      ILE  79   3.186  -5.260  -0.939
  631   2HD1  ILE  79          2HD1      ILE  79   4.413  -6.349  -1.587
  632   3HD1  ILE  79          3HD1      ILE  79   2.794  -6.328  -2.285
  633    H    THR  80           H        THR  80   3.956  -6.265  -6.321
  634    HA   THR  80           HA       THR  80   3.230  -7.071  -8.311
  635    HB   THR  80           HB       THR  80   1.493  -4.920  -9.127
  636    HG1  THR  80           1HG      THR  80   1.366  -4.141  -7.116
  637   1HG2  THR  80          1HG2      THR  80  -0.133  -6.794  -8.025
  638   2HG2  THR  80          2HG2      THR  80   1.294  -7.746  -8.434
  639   3HG2  THR  80          3HG2      THR  80   0.468  -6.815  -9.684
  640    H    GLY  81           H        GLY  81   2.873  -6.448 -10.725
  641   1HA   GLY  81          2HA       GLY  81   3.495  -4.971 -12.523
  642   2HA   GLY  81          1HA       GLY  81   4.766  -4.326 -11.495
  643    H    HIS  82           H        HIS  82   3.737  -7.246 -13.222
  644    HA   HIS  82           HA       HIS  82   6.507  -8.195 -13.240
  645   1HB   HIS  82          2HB       HIS  82   5.470 -10.274 -14.244
  646   2HB   HIS  82          1HB       HIS  82   4.972  -9.898 -12.598
  647    HD1  HIS  82           1HD      HIS  82   2.513  -9.356 -12.204
  648    HD2  HIS  82           2HD      HIS  82   3.460  -9.910 -16.212
  649    HE1  HIS  82           1HE      HIS  82   0.306  -9.495 -13.403
  650    HE2  HIS  82           2HE      HIS  82   0.904  -9.916 -15.814
  651    H    GLY  83           H        GLY  83   5.593  -5.900 -14.845
  652   1HA   GLY  83          2HA       GLY  83   5.841  -6.990 -17.568
  653   2HA   GLY  83          1HA       GLY  83   5.235  -5.391 -17.164
  654    H    SER  84           H        SER  84   7.294  -4.661 -15.348
  655    HA   SER  84           HA       SER  84   9.885  -4.981 -16.347
  656   1HB   SER  84          2HB       SER  84  10.218  -2.820 -17.498
  657   2HB   SER  84          1HB       SER  84   9.055  -3.837 -18.349
  658    HG   SER  84           HG       SER  84   8.706  -1.403 -17.145
  659    H    VAL  85           H        VAL  85  11.337  -3.068 -15.600
  660    HA   VAL  85           HA       VAL  85  10.474  -2.396 -12.885
  661    HB   VAL  85           HB       VAL  85  12.896  -1.781 -12.557
  662   1HG1  VAL  85          1HG1      VAL  85  12.075  -4.572 -13.305
  663   2HG1  VAL  85          2HG1      VAL  85  12.218  -3.860 -11.697
  664   3HG1  VAL  85          3HG1      VAL  85  13.667  -4.206 -12.641
  665   1HG2  VAL  85          1HG2      VAL  85  14.447  -1.962 -14.186
  666   2HG2  VAL  85          2HG2      VAL  85  13.056  -1.743 -15.248
  667   3HG2  VAL  85          3HG2      VAL  85  13.669  -3.365 -14.919
  668    H    ASP  86           H        ASP  86   9.469  -0.933 -15.191
  669    HA   ASP  86           HA       ASP  86  10.759   1.680 -14.851
  670   1HB   ASP  86          2HB       ASP  86  10.479   0.813 -17.166
  671   2HB   ASP  86          1HB       ASP  86   8.734   0.840 -16.932
  672    H    THR  87           H        THR  87   7.969  -0.089 -13.963
  673    HA   THR  87           HA       THR  87   6.290   2.234 -13.586
  674    HB   THR  87           HB       THR  87   5.587  -0.278 -14.039
  675    HG1  THR  87           1HG      THR  87   3.658   0.456 -13.635
  676   1HG2  THR  87          1HG2      THR  87   6.655  -1.003 -11.817
  677   2HG2  THR  87          2HG2      THR  87   5.039  -1.592 -12.209
  678   3HG2  THR  87          3HG2      THR  87   5.240  -0.262 -11.068
  679    H    ALA  88           H        ALA  88   8.365   0.158 -11.691
  680    HA   ALA  88           HA       ALA  88   7.685   1.036  -9.122
  681   1HB   ALA  88          1HB       ALA  88  10.082   0.365  -8.579
  682   2HB   ALA  88          2HB       ALA  88  10.237  -0.050 -10.286
  683   3HB   ALA  88          3HB       ALA  88   9.052  -0.882  -9.282
  684    H    VAL  89           H        VAL  89  10.412   2.038 -11.162
  685    HA   VAL  89           HA       VAL  89  11.226   4.194  -9.591
  686    HB   VAL  89           HB       VAL  89  12.511   4.944 -11.482
  687   1HG1  VAL  89          1HG1      VAL  89  13.178   2.832 -10.341
  688   2HG1  VAL  89          2HG1      VAL  89  13.749   2.961 -12.005
  689   3HG1  VAL  89          3HG1      VAL  89  12.363   1.939 -11.626
  690   1HG2  VAL  89          1HG2      VAL  89  12.206   4.018 -13.732
  691   2HG2  VAL  89          2HG2      VAL  89  10.765   4.875 -13.185
  692   3HG2  VAL  89          3HG2      VAL  89  10.803   3.112 -13.166
  693    H    LYS  90           H        LYS  90   8.705   3.917 -11.999
  694    HA   LYS  90           HA       LYS  90   8.294   6.733 -12.314
  695   1HB   LYS  90          2HB       LYS  90   7.667   5.143 -14.066
  696   2HB   LYS  90          1HB       LYS  90   6.494   4.403 -12.985
  697   1HG   LYS  90          2HG       LYS  90   5.087   6.268 -13.048
  698   2HG   LYS  90          1HG       LYS  90   6.347   7.305 -13.717
  699   1HD   LYS  90          2HD       LYS  90   5.266   4.920 -15.196
  700   2HD   LYS  90          1HD       LYS  90   4.538   6.522 -15.324
  701   1HE   LYS  90          2HE       LYS  90   7.151   7.105 -15.747
  702   2HE   LYS  90          1HE       LYS  90   7.053   5.487 -16.441
  703   1HZ   LYS  90          1HZ       LYS  90   6.589   7.187 -18.091
  704   2HZ   LYS  90          2HZ       LYS  90   5.312   7.785 -17.157
  705   3HZ   LYS  90          3HZ       LYS  90   5.218   6.233 -17.825
  706    H    ALA  91           H        ALA  91   7.618   4.626  -9.797
  707    HA   ALA  91           HA       ALA  91   5.416   6.342  -8.852
  708   1HB   ALA  91          1HB       ALA  91   4.620   4.438  -7.542
  709   2HB   ALA  91          2HB       ALA  91   5.932   3.447  -8.181
  710   3HB   ALA  91          3HB       ALA  91   4.678   4.055  -9.262
  711    H    ILE  92           H        ILE  92   8.402   4.684  -7.991
  712    HA   ILE  92           HA       ILE  92   8.348   5.614  -5.267
  713    HB   ILE  92           HB       ILE  92  10.396   4.490  -4.943
  714   1HG1  ILE  92          2HG1      ILE  92  10.695   4.426  -7.951
  715   2HG1  ILE  92          1HG1      ILE  92  11.648   5.397  -6.837
  716   1HG2  ILE  92          1HG2      ILE  92   9.983   2.289  -6.289
  717   2HG2  ILE  92          2HG2      ILE  92   8.504   3.107  -6.785
  718   3HG2  ILE  92          3HG2      ILE  92   8.822   2.824  -5.077
  719   1HD1  ILE  92          1HD1      ILE  92  12.242   3.087  -5.787
  720   2HD1  ILE  92          2HD1      ILE  92  13.063   3.644  -7.246
  721   3HD1  ILE  92          3HD1      ILE  92  11.752   2.471  -7.366
  722    H    LYS  93           H        LYS  93  10.010   6.971  -4.328
  723    HA   LYS  93           HA       LYS  93  11.434   8.759  -4.228
  724   1HB   LYS  93          2HB       LYS  93  11.381   8.922  -7.242
  725   2HB   LYS  93          1HB       LYS  93  12.563   9.625  -6.149
  726   1HG   LYS  93          2HG       LYS  93  12.484   6.820  -5.694
  727   2HG   LYS  93          1HG       LYS  93  12.628   7.107  -7.429
  728   1HD   LYS  93          2HD       LYS  93  14.483   8.769  -6.795
  729   2HD   LYS  93          1HD       LYS  93  14.465   7.975  -5.218
  730   1HE   LYS  93          2HE       LYS  93  14.714   5.789  -6.533
  731   2HE   LYS  93          1HE       LYS  93  15.153   6.813  -7.899
  732   1HZ   LYS  93          1HZ       LYS  93  17.013   7.653  -6.716
  733   2HZ   LYS  93          2HZ       LYS  93  17.061   5.968  -6.566
  734   3HZ   LYS  93          3HZ       LYS  93  16.525   6.919  -5.272
  735    H    LYS  94           H        LYS  94   8.905   8.994  -6.710
  736    HA   LYS  94           HA       LYS  94   8.485  11.779  -6.400
  737   1HB   LYS  94          2HB       LYS  94   7.807  10.317  -8.368
  738   2HB   LYS  94          1HB       LYS  94   6.445   9.799  -7.385
  739   1HG   LYS  94          2HG       LYS  94   5.554  11.499  -8.676
  740   2HG   LYS  94          1HG       LYS  94   5.931  12.309  -7.154
  741   1HD   LYS  94          2HD       LYS  94   8.115  12.301  -9.118
  742   2HD   LYS  94          1HD       LYS  94   6.680  13.201  -9.613
  743   1HE   LYS  94          2HE       LYS  94   7.463  14.896  -8.401
  744   2HE   LYS  94          1HE       LYS  94   7.062  13.945  -6.972
  745   1HZ   LYS  94          1HZ       LYS  94   9.639  14.572  -8.097
  746   2HZ   LYS  94          2HZ       LYS  94   9.459  12.942  -7.686
  747   3HZ   LYS  94          3HZ       LYS  94   9.226  14.141  -6.515
  748    H    GLY  95           H        GLY  95   7.448   9.006  -4.622
  749   1HA   GLY  95          2HA       GLY  95   6.377  10.557  -2.522
  750   2HA   GLY  95          1HA       GLY  95   5.062   9.935  -3.505
  751    H    ALA  96           H        ALA  96   6.568   7.430  -4.125
  752    HA   ALA  96           HA       ALA  96   5.727   5.989  -1.788
  753   1HB   ALA  96          1HB       ALA  96   6.851   4.075  -3.302
  754   2HB   ALA  96          2HB       ALA  96   6.540   5.292  -4.539
  755   3HB   ALA  96          3HB       ALA  96   5.213   4.675  -3.556
  756    H    TYR  97           H        TYR  97   7.258   4.080  -1.145
  757    HA   TYR  97           HA       TYR  97   9.779   5.331  -0.345
  758   1HB   TYR  97          2HB       TYR  97   8.544   4.614   1.547
  759   2HB   TYR  97          1HB       TYR  97   8.153   3.069   0.802
  760    HD1  TYR  97           1HD      TYR  97  10.927   5.048   2.267
  761    HD2  TYR  97           2HD      TYR  97   9.547   1.195   1.105
  762    HE1  TYR  97           1HE      TYR  97  12.853   4.021   3.401
  763    HE2  TYR  97           2HE      TYR  97  11.467   0.158   2.236
  764    HH   TYR  97           HH       TYR  97  13.923   1.034   2.870
  765    H    GLU  98           H        GLU  98   8.579   3.072  -2.512
  766    HA   GLU  98           HA       GLU  98  10.611   2.434  -4.032
  767   1HB   GLU  98          2HB       GLU  98  11.727   0.381  -3.089
  768   2HB   GLU  98          1HB       GLU  98  12.150   1.880  -2.282
  769   1HG   GLU  98          2HG       GLU  98  11.689   0.817  -0.388
  770   2HG   GLU  98          1HG       GLU  98   9.993   0.986  -0.832
  771    H    PHE  99           H        PHE  99  10.709  -0.148  -4.615
  772    HA   PHE  99           HA       PHE  99   7.896  -1.026  -4.697
  773   1HB   PHE  99          2HB       PHE  99   9.668  -0.423  -6.839
  774   2HB   PHE  99          1HB       PHE  99   9.392  -2.160  -6.855
  775    HD1  PHE  99           1HD      PHE  99   7.747  -2.824  -8.291
  776    HD2  PHE  99           2HD      PHE  99   7.320   0.896  -6.267
  777    HE1  PHE  99           1HE      PHE  99   5.590  -2.463  -9.419
  778    HE2  PHE  99           2HE      PHE  99   5.161   1.262  -7.391
  779    HZ   PHE  99           HZ       PHE  99   4.293  -0.419  -8.967
  780    H    LEU 100           H        LEU 100   7.472  -3.031  -3.992
  781    HA   LEU 100           HA       LEU 100   9.711  -4.660  -3.080
  782   1HB   LEU 100          2HB       LEU 100   7.407  -4.015  -1.853
  783   2HB   LEU 100          1HB       LEU 100   6.912  -5.510  -2.615
  784    HG   LEU 100           HG       LEU 100   7.611  -6.349  -0.626
  785   1HD1  LEU 100          1HD1      LEU 100   9.071  -7.284  -2.419
  786   2HD1  LEU 100          2HD1      LEU 100   9.764  -7.360  -0.800
  787   3HD1  LEU 100          3HD1      LEU 100  10.311  -6.129  -1.937
  788   1HD2  LEU 100          1HD2      LEU 100   9.682  -4.163  -0.498
  789   2HD2  LEU 100          2HD2      LEU 100   9.415  -5.387   0.745
  790   3HD2  LEU 100          3HD2      LEU 100   8.150  -4.214   0.374
  791    H    GLU 101           H        GLU 101   9.526  -4.616  -5.820
  792    HA   GLU 101           HA       GLU 101   8.177  -7.100  -6.584
  793   1HB   GLU 101          2HB       GLU 101   8.545  -6.404  -8.886
  794   2HB   GLU 101          1HB       GLU 101   7.770  -5.113  -7.976
  795   1HG   GLU 101          2HG       GLU 101   9.688  -3.807  -7.953
  796   2HG   GLU 101          1HG       GLU 101  10.741  -5.174  -8.312
  797    H    LYS 102           H        LYS 102  11.282  -5.882  -5.831
  798    HA   LYS 102           HA       LYS 102  13.008  -7.319  -7.416
  799   1HB   LYS 102          2HB       LYS 102  13.172  -5.867  -4.996
  800   2HB   LYS 102          1HB       LYS 102  13.958  -7.413  -4.704
  801   1HG   LYS 102          2HG       LYS 102  15.769  -6.666  -5.725
  802   2HG   LYS 102          1HG       LYS 102  14.849  -6.500  -7.220
  803   1HD   LYS 102          2HD       LYS 102  14.681  -4.264  -7.015
  804   2HD   LYS 102          1HD       LYS 102  14.430  -4.344  -5.271
  805   1HE   LYS 102          2HE       LYS 102  16.705  -4.370  -4.817
  806   2HE   LYS 102          1HE       LYS 102  17.122  -4.933  -6.435
  807   1HZ   LYS 102          1HZ       LYS 102  16.408  -2.215  -5.549
  808   2HZ   LYS 102          2HZ       LYS 102  16.186  -2.666  -7.165
  809   3HZ   LYS 102          3HZ       LYS 102  17.729  -2.721  -6.476
  810    HA   PRO 103           HA       PRO 103  12.735 -11.143  -4.538
  811   1HB   PRO 103          2HB       PRO 103  10.990 -11.165  -2.488
  812   2HB   PRO 103          1HB       PRO 103  12.594 -10.436  -2.344
  813   1HG   PRO 103          2HG       PRO 103   9.949  -9.117  -2.818
  814   2HG   PRO 103          1HG       PRO 103  11.267  -8.624  -1.740
  815   1HD   PRO 103          2HD       PRO 103  10.847  -7.524  -4.202
  816   2HD   PRO 103          1HD       PRO 103  12.444  -7.623  -3.437
  817    H    PHE 104           H        PHE 104  10.776 -12.744  -3.700
  818    HA   PHE 104           HA       PHE 104   8.528 -12.452  -5.558
  819   1HB   PHE 104          2HB       PHE 104   8.743 -14.774  -6.290
  820   2HB   PHE 104          1HB       PHE 104  10.206 -13.870  -6.670
  821    HD1  PHE 104           1HD      PHE 104  12.272 -14.275  -5.435
  822    HD2  PHE 104           2HD      PHE 104   8.759 -16.563  -4.700
  823    HE1  PHE 104           1HE      PHE 104  13.622 -15.959  -4.254
  824    HE2  PHE 104           2HE      PHE 104  10.102 -18.250  -3.516
  825    HZ   PHE 104           HZ       PHE 104  12.536 -17.950  -3.291
  826    H    SER 105           H        SER 105   8.770 -12.121  -2.679
  827    HA   SER 105           HA       SER 105   6.677 -13.997  -1.896
  828   1HB   SER 105          2HB       SER 105   9.100 -13.512  -0.149
  829   2HB   SER 105          1HB       SER 105   7.745 -14.585   0.195
  830    HG   SER 105           HG       SER 105   9.975 -15.136  -1.128
  831    H    VAL 106           H        VAL 106   6.281 -13.318   0.674
  832    HA   VAL 106           HA       VAL 106   5.808 -10.408   0.568
  833    HB   VAL 106           HB       VAL 106   3.722 -11.680   0.374
  834   1HG1  VAL 106          1HG1      VAL 106   4.173 -12.724   3.152
  835   2HG1  VAL 106          2HG1      VAL 106   4.642 -13.643   1.722
  836   3HG1  VAL 106          3HG1      VAL 106   2.952 -13.208   1.974
  837   1HG2  VAL 106          1HG2      VAL 106   3.843 -10.437   3.112
  838   2HG2  VAL 106          2HG2      VAL 106   2.479 -10.488   1.996
  839   3HG2  VAL 106          3HG2      VAL 106   3.884  -9.488   1.626
  840    H    GLU 107           H        GLU 107   7.464 -12.845   2.195
  841    HA   GLU 107           HA       GLU 107   7.263 -11.965   4.866
  842   1HB   GLU 107          2HB       GLU 107   8.280 -14.147   3.823
  843   2HB   GLU 107          1HB       GLU 107   9.764 -13.204   3.813
  844   1HG   GLU 107          2HG       GLU 107   8.436 -12.998   6.357
  845   2HG   GLU 107          1HG       GLU 107   8.708 -14.685   5.920
  846    H    ARG 108           H        ARG 108   9.604 -11.273   2.288
  847    HA   ARG 108           HA       ARG 108  11.284  -9.572   3.742
  848   1HB   ARG 108          2HB       ARG 108  11.313 -10.540   1.219
  849   2HB   ARG 108          1HB       ARG 108  10.799  -8.889   0.899
  850   1HG   ARG 108          2HG       ARG 108  13.181  -9.421   2.624
  851   2HG   ARG 108          1HG       ARG 108  13.315  -9.464   0.865
  852   1HD   ARG 108          2HD       ARG 108  12.108  -7.137   2.336
  853   2HD   ARG 108          1HD       ARG 108  13.837  -7.253   2.011
  854    HE   ARG 108           HE       ARG 108  12.267  -7.610  -0.346
  855   1HH1  ARG 108          1HH1      ARG 108  13.592  -5.205   1.808
  856   2HH1  ARG 108          2HH1      ARG 108  13.624  -3.962   0.603
  857   1HH2  ARG 108          1HH2      ARG 108  12.309  -5.976  -1.933
  858   2HH2  ARG 108          2HH2      ARG 108  12.895  -4.399  -1.521
  859    H    PHE 109           H        PHE 109   8.219  -9.032   2.154
  860    HA   PHE 109           HA       PHE 109   8.216  -6.211   2.211
  861   1HB   PHE 109          2HB       PHE 109   6.637  -7.370   0.809
  862   2HB   PHE 109          1HB       PHE 109   5.963  -8.230   2.188
  863    HD1  PHE 109           1HD      PHE 109   6.776  -4.619   1.917
  864    HD2  PHE 109           2HD      PHE 109   3.728  -7.578   2.170
  865    HE1  PHE 109           1HE      PHE 109   5.087  -2.852   2.194
  866    HE2  PHE 109           2HE      PHE 109   2.034  -5.815   2.446
  867    HZ   PHE 109           HZ       PHE 109   2.714  -3.449   2.458
  868    H    LEU 110           H        LEU 110   7.254  -8.675   4.529
  869    HA   LEU 110           HA       LEU 110   5.913  -7.122   6.393
  870   1HB   LEU 110          2HB       LEU 110   7.046  -9.725   6.271
  871   2HB   LEU 110          1HB       LEU 110   7.471  -8.999   7.809
  872    HG   LEU 110           HG       LEU 110   4.635  -9.009   6.828
  873   1HD1  LEU 110          1HD1      LEU 110   4.521 -11.016   8.503
  874   2HD1  LEU 110          2HD1      LEU 110   6.209 -11.225   8.036
  875   3HD1  LEU 110          3HD1      LEU 110   4.943 -11.276   6.810
  876   1HD2  LEU 110          1HD2      LEU 110   4.789  -7.580   8.634
  877   2HD2  LEU 110          2HD2      LEU 110   6.045  -8.537   9.418
  878   3HD2  LEU 110          3HD2      LEU 110   4.377  -9.107   9.413
  879    H    LEU 111           H        LEU 111   9.390  -7.830   6.198
  880    HA   LEU 111           HA       LEU 111  10.208  -6.453   8.474
  881   1HB   LEU 111          2HB       LEU 111  11.613  -7.000   5.875
  882   2HB   LEU 111          1HB       LEU 111  12.406  -6.216   7.227
  883    HG   LEU 111           HG       LEU 111  11.223  -8.567   8.254
  884   1HD1  LEU 111          1HD1      LEU 111  11.305  -9.098   5.683
  885   2HD1  LEU 111          2HD1      LEU 111  11.778 -10.307   6.876
  886   3HD1  LEU 111          3HD1      LEU 111  13.012  -9.382   6.021
  887   1HD2  LEU 111          1HD2      LEU 111  13.143  -8.012   9.319
  888   2HD2  LEU 111          2HD2      LEU 111  13.928  -7.444   7.845
  889   3HD2  LEU 111          3HD2      LEU 111  13.823  -9.172   8.178
  890    H    THR 112           H        THR 112   9.828  -5.282   5.147
  891    HA   THR 112           HA       THR 112  10.782  -2.673   5.607
  892    HB   THR 112           HB       THR 112   8.794  -3.664   3.552
  893    HG1  THR 112           1HG      THR 112  11.578  -3.207   3.297
  894   1HG2  THR 112          1HG2      THR 112   9.642  -1.742   2.198
  895   2HG2  THR 112          2HG2      THR 112  10.364  -1.107   3.676
  896   3HG2  THR 112          3HG2      THR 112   8.615  -1.304   3.563
  897    H    ILE 113           H        ILE 113   7.566  -4.099   5.840
  898    HA   ILE 113           HA       ILE 113   6.067  -1.781   6.204
  899    HB   ILE 113           HB       ILE 113   5.698  -4.646   6.889
  900   1HG1  ILE 113          2HG1      ILE 113   5.025  -3.683   4.716
  901   2HG1  ILE 113          1HG1      ILE 113   3.655  -4.352   5.598
  902   1HG2  ILE 113          1HG2      ILE 113   4.966  -3.758   8.965
  903   2HG2  ILE 113          2HG2      ILE 113   3.520  -4.110   8.020
  904   3HG2  ILE 113          3HG2      ILE 113   4.091  -2.449   8.173
  905   1HD1  ILE 113          1HD1      ILE 113   4.368  -1.474   5.165
  906   2HD1  ILE 113          2HD1      ILE 113   3.214  -1.985   6.397
  907   3HD1  ILE 113          3HD1      ILE 113   2.899  -2.330   4.695
  908    H    LYS 114           H        LYS 114   7.491  -3.895   8.701
  909    HA   LYS 114           HA       LYS 114   6.711  -2.537  10.954
  910   1HB   LYS 114          2HB       LYS 114   8.023  -4.691  10.840
  911   2HB   LYS 114          1HB       LYS 114   9.463  -3.715  10.585
  912   1HG   LYS 114          2HG       LYS 114   7.761  -3.100  12.938
  913   2HG   LYS 114          1HG       LYS 114   8.753  -4.559  12.981
  914   1HD   LYS 114          2HD       LYS 114   9.759  -1.768  12.427
  915   2HD   LYS 114          1HD       LYS 114   9.914  -2.627  13.960
  916   1HE   LYS 114          2HE       LYS 114  10.938  -4.409  12.121
  917   2HE   LYS 114          1HE       LYS 114  11.495  -2.847  11.524
  918   1HZ   LYS 114          1HZ       LYS 114  12.801  -2.521  13.329
  919   2HZ   LYS 114          2HZ       LYS 114  12.814  -4.212  13.342
  920   3HZ   LYS 114          3HZ       LYS 114  11.782  -3.365  14.382
  921    H    HIS 115           H        HIS 115   9.804  -2.095   9.251
  922    HA   HIS 115           HA       HIS 115  10.660   0.156  10.633
  923   1HB   HIS 115          2HB       HIS 115  12.098  -1.145   9.120
  924   2HB   HIS 115          1HB       HIS 115  11.183  -0.551   7.738
  925    HD1  HIS 115           1HD      HIS 115  12.245   1.358   6.599
  926    HD2  HIS 115           2HD      HIS 115  13.276   1.203  10.622
  927    HE1  HIS 115           1HE      HIS 115  13.858   3.255   6.953
  928    HE2  HIS 115           2HE      HIS 115  14.532   3.090   9.375
  929    H    ALA 116           H        ALA 116   8.355  -0.143   8.014
  930    HA   ALA 116           HA       ALA 116   8.282   2.543   7.187
  931   1HB   ALA 116          1HB       ALA 116   5.673   1.465   6.972
  932   2HB   ALA 116          2HB       ALA 116   6.817   0.157   6.665
  933   3HB   ALA 116          3HB       ALA 116   6.893   1.638   5.711
  934    H    PHE 117           H        PHE 117   6.628   0.827   9.780
  935    HA   PHE 117           HA       PHE 117   4.983   3.043  10.534
  936   1HB   PHE 117          2HB       PHE 117   5.608   0.354  11.699
  937   2HB   PHE 117          1HB       PHE 117   4.782   1.556  12.686
  938    HD1  PHE 117           1HD      PHE 117   2.590   2.457  11.928
  939    HD2  PHE 117           2HD      PHE 117   4.465  -0.856  10.026
  940    HE1  PHE 117           1HE      PHE 117   0.442   1.834  10.911
  941    HE2  PHE 117           2HE      PHE 117   2.318  -1.485   9.004
  942    HZ   PHE 117           HZ       PHE 117   0.302  -0.135   9.446
  943    H    GLU 118           H        GLU 118   8.167   1.900  11.361
  944    HA   GLU 118           HA       GLU 118   8.564   3.158  13.814
  945   1HB   GLU 118          2HB       GLU 118  10.572   2.697  11.603
  946   2HB   GLU 118          1HB       GLU 118  10.968   3.075  13.274
  947   1HG   GLU 118          2HG       GLU 118   9.827   0.989  13.964
  948   2HG   GLU 118          1HG       GLU 118   9.591   0.600  12.261
  949    H    GLU 119           H        GLU 119   8.500   4.473  10.591
  950    HA   GLU 119           HA       GLU 119   9.505   7.051  11.535
  951   1HB   GLU 119          2HB       GLU 119   8.879   6.043   8.761
  952   2HB   GLU 119          1HB       GLU 119   9.427   7.675   9.118
  953   1HG   GLU 119          2HG       GLU 119  11.290   6.068  10.372
  954   2HG   GLU 119          1HG       GLU 119  10.940   5.220   8.867
  955    H    TYR 120           H        TYR 120   6.891   6.020  12.349
  956    HA   TYR 120           HA       TYR 120   5.109   7.952  11.029
  957   1HB   TYR 120          2HB       TYR 120   4.387   5.571  11.009
  958   2HB   TYR 120          1HB       TYR 120   4.363   5.593  12.770
  959    HD1  TYR 120           1HD      TYR 120   2.368   6.062  13.842
  960    HD2  TYR 120           2HD      TYR 120   2.931   7.442   9.857
  961    HE1  TYR 120           1HE      TYR 120   0.048   6.879  13.804
  962    HE2  TYR 120           2HE      TYR 120   0.614   8.262   9.808
  963    HH   TYR 120           HH       TYR 120  -1.705   7.358  11.991
  964    H    SER 121           H        SER 121   7.109   8.561  13.116
  965    HA   SER 121           HA       SER 121   5.277   9.870  14.985
  966   1HB   SER 121          2HB       SER 121   6.362   7.671  15.904
  967   2HB   SER 121          1HB       SER 121   7.807   8.668  16.064
  968    HG   SER 121           HG       SER 121   5.269   9.305  17.164
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1  -3.575   3.068  16.638
    2   2H    MET   1          2HT       MET   1  -3.049   1.464  16.327
    3   3H    MET   1          3HT       MET   1  -3.346   2.541  15.023
    4    HA   MET   1           HA       MET   1  -1.592   3.987  16.041
    5   1HB   MET   1          2HB       MET   1  -1.767   2.340  18.117
    6   2HB   MET   1          1HB       MET   1  -0.555   1.443  17.211
    7   1HG   MET   1          2HG       MET   1   1.059   2.948  17.617
    8   2HG   MET   1          1HG       MET   1  -0.039   4.321  17.485
    9   1HE   MET   1          1HE       MET   1  -0.956   1.326  19.644
   10   2HE   MET   1          2HE       MET   1  -0.306   1.694  21.242
   11   3HE   MET   1          3HE       MET   1   0.781   1.222  19.935
   12    H    LYS   2           H        LYS   2  -1.282   0.494  15.366
   13    HA   LYS   2           HA       LYS   2   0.491   1.181  13.117
   14   1HB   LYS   2          2HB       LYS   2   0.337  -1.362  14.740
   15   2HB   LYS   2          1HB       LYS   2   1.377  -1.125  13.342
   16   1HG   LYS   2          2HG       LYS   2   1.599   0.841  15.545
   17   2HG   LYS   2          1HG       LYS   2   2.228  -0.784  15.831
   18   1HD   LYS   2          2HD       LYS   2   2.996   0.295  13.234
   19   2HD   LYS   2          1HD       LYS   2   3.567   1.277  14.584
   20   1HE   LYS   2          2HE       LYS   2   5.106  -0.581  13.783
   21   2HE   LYS   2          1HE       LYS   2   4.776  -0.511  15.514
   22   1HZ   LYS   2          1HZ       LYS   2   2.938  -2.158  14.014
   23   2HZ   LYS   2          2HZ       LYS   2   3.739  -2.477  15.470
   24   3HZ   LYS   2          3HZ       LYS   2   4.535  -2.716  13.998
   25    H    ARG   3           H        ARG   3  -1.053   1.430  11.525
   26    HA   ARG   3           HA       ARG   3  -2.354  -1.049  10.675
   27   1HB   ARG   3          2HB       ARG   3  -4.377   0.211  10.044
   28   2HB   ARG   3          1HB       ARG   3  -4.085   0.211  11.778
   29   1HG   ARG   3          2HG       ARG   3  -2.976   2.453  10.225
   30   2HG   ARG   3          1HG       ARG   3  -4.727   2.389  10.431
   31   1HD   ARG   3          2HD       ARG   3  -3.740   1.819  12.951
   32   2HD   ARG   3          1HD       ARG   3  -2.650   3.065  12.348
   33    HE   ARG   3           HE       ARG   3  -5.497   3.344  12.901
   34   1HH1  ARG   3          1HH1      ARG   3  -2.568   4.780  11.646
   35   2HH1  ARG   3          2HH1      ARG   3  -3.177   6.398  11.742
   36   1HH2  ARG   3          1HH2      ARG   3  -6.292   5.470  13.024
   37   2HH2  ARG   3          2HH2      ARG   3  -5.288   6.789  12.524
   38    H    VAL   4           H        VAL   4  -2.454  -1.385   8.484
   39    HA   VAL   4           HA       VAL   4  -1.239   0.700   6.788
   40    HB   VAL   4           HB       VAL   4  -0.836  -2.268   6.423
   41   1HG1  VAL   4          1HG1      VAL   4   1.100  -1.431   5.025
   42   2HG1  VAL   4          2HG1      VAL   4   0.372   0.167   5.141
   43   3HG1  VAL   4          3HG1      VAL   4  -0.510  -1.146   4.368
   44   1HG2  VAL   4          1HG2      VAL   4   1.139  -0.311   7.592
   45   2HG2  VAL   4          2HG2      VAL   4   1.338  -2.053   7.406
   46   3HG2  VAL   4          3HG2      VAL   4   0.159  -1.418   8.554
   47    H    LEU   5           H        LEU   5  -1.729   0.420   4.452
   48    HA   LEU   5           HA       LEU   5  -4.408  -0.728   4.041
   49   1HB   LEU   5          2HB       LEU   5  -4.344   1.770   4.039
   50   2HB   LEU   5          1HB       LEU   5  -3.257   1.701   2.665
   51    HG   LEU   5           HG       LEU   5  -5.008   0.578   1.343
   52   1HD1  LEU   5          1HD1      LEU   5  -7.359   0.746   2.360
   53   2HD1  LEU   5          2HD1      LEU   5  -6.525   0.834   3.912
   54   3HD1  LEU   5          3HD1      LEU   5  -6.316  -0.579   2.877
   55   1HD2  LEU   5          1HD2      LEU   5  -6.696   2.714   1.850
   56   2HD2  LEU   5          2HD2      LEU   5  -5.343   2.690   0.721
   57   3HD2  LEU   5          3HD2      LEU   5  -5.110   3.291   2.362
   58    H    VAL   6           H        VAL   6  -4.596  -2.171   2.438
   59    HA   VAL   6           HA       VAL   6  -2.310  -2.446   0.591
   60    HB   VAL   6           HB       VAL   6  -4.205  -4.633   1.438
   61   1HG1  VAL   6          1HG1      VAL   6  -3.288  -5.150  -0.680
   62   2HG1  VAL   6          2HG1      VAL   6  -2.359  -6.076   0.499
   63   3HG1  VAL   6          3HG1      VAL   6  -1.681  -4.605  -0.199
   64   1HG2  VAL   6          1HG2      VAL   6  -3.010  -4.958   3.281
   65   2HG2  VAL   6          2HG2      VAL   6  -2.152  -3.454   2.945
   66   3HG2  VAL   6          3HG2      VAL   6  -1.509  -4.987   2.356
   67    H    VAL   7           H        VAL   7  -3.008  -1.292  -1.171
   68    HA   VAL   7           HA       VAL   7  -5.688  -1.679  -2.192
   69    HB   VAL   7           HB       VAL   7  -3.394  -0.167  -3.454
   70   1HG1  VAL   7          1HG1      VAL   7  -6.364  -0.135  -3.965
   71   2HG1  VAL   7          2HG1      VAL   7  -5.096  -0.668  -5.069
   72   3HG1  VAL   7          3HG1      VAL   7  -5.225   1.035  -4.632
   73   1HG2  VAL   7          1HG2      VAL   7  -5.410   0.618  -1.392
   74   2HG2  VAL   7          2HG2      VAL   7  -4.801   1.818  -2.533
   75   3HG2  VAL   7          3HG2      VAL   7  -3.683   0.969  -1.464
   76    H    ASP   8           H        ASP   8  -6.246  -3.291  -3.482
   77    HA   ASP   8           HA       ASP   8  -4.490  -4.162  -5.607
   78   1HB   ASP   8          2HB       ASP   8  -3.641  -5.592  -3.887
   79   2HB   ASP   8          1HB       ASP   8  -5.260  -5.995  -3.328
   80    H    ASP   9           H        ASP   9  -5.640  -4.715  -7.357
   81    HA   ASP   9           HA       ASP   9  -8.540  -4.731  -7.130
   82   1HB   ASP   9          2HB       ASP   9  -7.387  -3.346  -8.855
   83   2HB   ASP   9          1HB       ASP   9  -6.822  -4.829  -9.619
   84    H    GLU  10           H        GLU  10  -7.549  -6.987  -5.974
   85    HA   GLU  10           HA       GLU  10  -8.099  -9.091  -7.963
   86   1HB   GLU  10          2HB       GLU  10  -5.885  -8.818  -6.307
   87   2HB   GLU  10          1HB       GLU  10  -6.875 -10.015  -5.483
   88   1HG   GLU  10          2HG       GLU  10  -6.730 -10.558  -8.310
   89   2HG   GLU  10          1HG       GLU  10  -5.121 -10.439  -7.598
   90    H    GLU  11           H        GLU  11  -8.481  -8.289  -4.513
   91    HA   GLU  11           HA       GLU  11 -11.220  -9.092  -4.513
   92   1HB   GLU  11          2HB       GLU  11  -9.529 -11.207  -4.248
   93   2HB   GLU  11          1HB       GLU  11  -9.748 -10.749  -2.565
   94   1HG   GLU  11          2HG       GLU  11 -11.915 -11.386  -2.527
   95   2HG   GLU  11          1HG       GLU  11 -12.190 -10.944  -4.212
   96    H    SER  12           H        SER  12 -11.645  -9.540  -1.844
   97    HA   SER  12           HA       SER  12 -11.604  -6.974  -0.754
   98   1HB   SER  12          2HB       SER  12 -13.188  -8.640   0.024
   99   2HB   SER  12          1HB       SER  12 -11.877  -9.651   0.635
  100    HG   SER  12           HG       SER  12 -12.261  -8.589   2.417
  101    H    ILE  13           H        ILE  13  -9.657  -9.787   0.262
  102    HA   ILE  13           HA       ILE  13  -7.635  -7.896   1.283
  103    HB   ILE  13           HB       ILE  13  -7.926 -10.730   2.236
  104   1HG1  ILE  13          2HG1      ILE  13 -10.052  -9.460   2.627
  105   2HG1  ILE  13          1HG1      ILE  13  -9.250  -9.981   4.105
  106   1HG2  ILE  13          1HG2      ILE  13  -5.835  -9.904   2.829
  107   2HG2  ILE  13          2HG2      ILE  13  -6.814  -9.651   4.274
  108   3HG2  ILE  13          3HG2      ILE  13  -6.467  -8.299   3.197
  109   1HD1  ILE  13          1HD1      ILE  13  -8.410  -7.338   3.281
  110   2HD1  ILE  13          2HD1      ILE  13  -9.045  -7.895   4.828
  111   3HD1  ILE  13          3HD1      ILE  13 -10.152  -7.445   3.531
  112    H    THR  14           H        THR  14  -5.408  -8.745   1.263
  113    HA   THR  14           HA       THR  14  -4.870 -10.057  -1.279
  114    HB   THR  14           HB       THR  14  -2.515  -9.390  -0.848
  115    HG1  THR  14           1HG      THR  14  -3.554  -8.104   1.451
  116   1HG2  THR  14          1HG2      THR  14  -2.733  -7.126  -1.297
  117   2HG2  THR  14          2HG2      THR  14  -4.198  -6.975  -0.327
  118   3HG2  THR  14          3HG2      THR  14  -4.252  -7.807  -1.880
  119    H    SER  15           H        SER  15  -3.671 -11.976  -1.477
  120    HA   SER  15           HA       SER  15  -4.117 -13.892   0.530
  121   1HB   SER  15          2HB       SER  15  -2.761 -13.829  -2.106
  122   2HB   SER  15          1HB       SER  15  -2.298 -15.133  -1.012
  123    HG   SER  15           HG       SER  15  -4.025 -15.916  -2.079
  124    H    SER  16           H        SER  16  -2.823 -14.879   1.986
  125    HA   SER  16           HA       SER  16  -1.135 -15.208   3.455
  126   1HB   SER  16          2HB       SER  16   0.436 -14.154   1.123
  127   2HB   SER  16          1HB       SER  16   1.213 -14.616   2.636
  128    HG   SER  16           HG       SER  16   0.109 -16.187   0.664
  129    H    LEU  17           H        LEU  17  -2.404 -12.320   2.938
  130    HA   LEU  17           HA       LEU  17  -0.417 -10.747   4.374
  131   1HB   LEU  17          2HB       LEU  17  -2.404 -10.142   2.499
  132   2HB   LEU  17          1HB       LEU  17  -2.997  -9.462   3.997
  133    HG   LEU  17           HG       LEU  17  -0.874  -8.523   2.226
  134   1HD1  LEU  17          1HD1      LEU  17  -2.392  -6.899   2.482
  135   2HD1  LEU  17          2HD1      LEU  17  -1.444  -6.500   3.914
  136   3HD1  LEU  17          3HD1      LEU  17  -2.905  -7.477   4.066
  137   1HD2  LEU  17          1HD2      LEU  17   0.315  -7.484   4.312
  138   2HD2  LEU  17          2HD2      LEU  17   0.787  -9.075   3.721
  139   3HD2  LEU  17          3HD2      LEU  17  -0.273  -8.934   5.122
  140    H    SER  18           H        SER  18  -3.827 -11.674   4.772
  141    HA   SER  18           HA       SER  18  -4.381 -10.655   7.240
  142   1HB   SER  18          2HB       SER  18  -5.866 -12.064   5.665
  143   2HB   SER  18          1HB       SER  18  -5.234 -13.457   6.543
  144    HG   SER  18           HG       SER  18  -7.272 -12.314   7.294
  145    H    ALA  19           H        ALA  19  -3.143 -13.967   6.722
  146    HA   ALA  19           HA       ALA  19  -2.732 -14.677   9.355
  147   1HB   ALA  19          1HB       ALA  19  -2.423 -16.038   7.177
  148   2HB   ALA  19          2HB       ALA  19  -1.420 -16.426   8.575
  149   3HB   ALA  19          3HB       ALA  19  -0.755 -15.470   7.251
  150    H    ILE  20           H        ILE  20  -0.649 -12.816   7.216
  151    HA   ILE  20           HA       ILE  20   1.570 -12.650   8.975
  152    HB   ILE  20           HB       ILE  20   0.732 -10.964   6.614
  153   1HG1  ILE  20          2HG1      ILE  20   2.957 -12.979   6.964
  154   2HG1  ILE  20          1HG1      ILE  20   1.418 -13.297   6.169
  155   1HG2  ILE  20          1HG2      ILE  20   2.844 -10.498   8.592
  156   2HG2  ILE  20          2HG2      ILE  20   2.087  -9.385   7.452
  157   3HG2  ILE  20          3HG2      ILE  20   3.385 -10.452   6.914
  158   1HD1  ILE  20          1HD1      ILE  20   3.651 -11.517   5.267
  159   2HD1  ILE  20          2HD1      ILE  20   2.025 -11.405   4.591
  160   3HD1  ILE  20          3HD1      ILE  20   2.940 -12.905   4.444
  161    H    LEU  21           H        LEU  21  -0.551  -9.971   7.953
  162    HA   LEU  21           HA       LEU  21   0.103  -8.154   9.894
  163   1HB   LEU  21          2HB       LEU  21  -2.689  -8.580   8.850
  164   2HB   LEU  21          1HB       LEU  21  -2.004  -7.085   9.465
  165    HG   LEU  21           HG       LEU  21  -0.465  -8.169   7.245
  166   1HD1  LEU  21          1HD1      LEU  21  -2.023  -8.580   5.729
  167   2HD1  LEU  21          2HD1      LEU  21  -2.798  -7.030   6.042
  168   3HD1  LEU  21          3HD1      LEU  21  -3.244  -8.447   6.990
  169   1HD2  LEU  21          1HD2      LEU  21  -1.555  -5.593   8.201
  170   2HD2  LEU  21          2HD2      LEU  21  -1.217  -5.735   6.476
  171   3HD2  LEU  21          3HD2      LEU  21   0.068  -6.010   7.652
  172    H    GLU  22           H        GLU  22  -1.951 -10.962  10.182
  173    HA   GLU  22           HA       GLU  22  -3.122 -10.245  12.684
  174   1HB   GLU  22          2HB       GLU  22  -2.933 -12.821  11.149
  175   2HB   GLU  22          1HB       GLU  22  -3.667 -12.743  12.746
  176   1HG   GLU  22          2HG       GLU  22  -5.371 -11.280  11.985
  177   2HG   GLU  22          1HG       GLU  22  -4.559 -11.038  10.440
  178    H    GLU  23           H        GLU  23  -0.196 -11.862  11.690
  179    HA   GLU  23           HA       GLU  23   0.381 -12.902  14.317
  180   1HB   GLU  23          2HB       GLU  23   1.246 -14.208  12.557
  181   2HB   GLU  23          1HB       GLU  23   1.864 -12.804  11.701
  182   1HG   GLU  23          2HG       GLU  23   3.811 -12.873  12.769
  183   2HG   GLU  23          1HG       GLU  23   3.045 -13.131  14.335
  184    H    GLU  24           H        GLU  24   1.231 -10.128  12.358
  185    HA   GLU  24           HA       GLU  24   3.226  -9.173  14.203
  186   1HB   GLU  24          2HB       GLU  24   1.987  -8.047  11.711
  187   2HB   GLU  24          1HB       GLU  24   3.078  -7.099  12.712
  188   1HG   GLU  24          2HG       GLU  24   3.860  -9.788  11.652
  189   2HG   GLU  24          1HG       GLU  24   4.050  -8.320  10.694
  190    H    GLY  25           H        GLY  25  -0.149  -8.541  13.482
  191   1HA   GLY  25          2HA       GLY  25  -1.693  -7.724  15.069
  192   2HA   GLY  25          1HA       GLY  25  -0.354  -7.048  15.982
  193    H    TYR  26           H        TYR  26  -1.290  -6.697  12.574
  194    HA   TYR  26           HA       TYR  26  -1.208  -3.785  12.950
  195   1HB   TYR  26          2HB       TYR  26  -0.742  -5.562  10.574
  196   2HB   TYR  26          1HB       TYR  26  -1.138  -3.863  10.354
  197    HD1  TYR  26           1HD      TYR  26   0.374  -2.127  11.407
  198    HD2  TYR  26           2HD      TYR  26   1.450  -6.232  11.110
  199    HE1  TYR  26           1HE      TYR  26   2.733  -1.525  11.740
  200    HE2  TYR  26           2HE      TYR  26   3.814  -5.641  11.443
  201    HH   TYR  26           HH       TYR  26   5.280  -3.675  11.154
  202    H    HIS  27           H        HIS  27  -2.614  -2.841  10.898
  203    HA   HIS  27           HA       HIS  27  -5.292  -4.026  11.082
  204   1HB   HIS  27          2HB       HIS  27  -4.482  -1.598  12.291
  205   2HB   HIS  27          1HB       HIS  27  -5.475  -1.159  10.906
  206    HD1  HIS  27           1HD      HIS  27  -6.170  -4.280  12.863
  207    HD2  HIS  27           2HD      HIS  27  -7.645  -0.413  12.490
  208    HE1  HIS  27           1HE      HIS  27  -8.358  -4.273  14.102
  209    HE2  HIS  27           2HE      HIS  27  -9.186  -1.899  13.942
  210    HA   PRO  28           HA       PRO  28  -4.341  -3.133   6.693
  211   1HB   PRO  28          2HB       PRO  28  -5.083  -5.495   5.686
  212   2HB   PRO  28          1HB       PRO  28  -3.525  -5.287   6.492
  213   1HG   PRO  28          2HG       PRO  28  -6.045  -6.509   7.528
  214   2HG   PRO  28          1HG       PRO  28  -4.367  -7.022   7.772
  215   1HD   PRO  28          2HD       PRO  28  -5.864  -5.554   9.587
  216   2HD   PRO  28          1HD       PRO  28  -4.093  -5.635   9.560
  217    H    ASP  29           H        ASP  29  -5.789  -2.010   5.545
  218    HA   ASP  29           HA       ASP  29  -8.613  -2.669   5.910
  219   1HB   ASP  29          2HB       ASP  29  -7.340  -0.238   6.140
  220   2HB   ASP  29          1HB       ASP  29  -8.150  -0.145   4.579
  221    H    THR  30           H        THR  30  -6.295  -3.237   3.823
  222    HA   THR  30           HA       THR  30  -6.106  -3.385   1.512
  223    HB   THR  30           HB       THR  30  -7.350  -5.358   0.791
  224    HG1  THR  30           1HG      THR  30  -9.309  -5.331   1.629
  225   1HG2  THR  30          1HG2      THR  30  -6.105  -6.752   1.999
  226   2HG2  THR  30          2HG2      THR  30  -6.809  -6.211   3.522
  227   3HG2  THR  30          3HG2      THR  30  -5.493  -5.298   2.787
  228    H    ALA  31           H        ALA  31  -6.600  -2.260  -0.204
  229    HA   ALA  31           HA       ALA  31  -9.368  -1.345  -0.582
  230   1HB   ALA  31          1HB       ALA  31  -7.285   0.250  -0.411
  231   2HB   ALA  31          2HB       ALA  31  -8.587   0.579  -1.555
  232   3HB   ALA  31          3HB       ALA  31  -7.094  -0.176  -2.113
  233    H    LYS  32           H        LYS  32  -9.988  -1.071  -2.948
  234    HA   LYS  32           HA       LYS  32  -9.451  -3.572  -4.304
  235   1HB   LYS  32          2HB       LYS  32 -11.751  -2.949  -4.148
  236   2HB   LYS  32          1HB       LYS  32 -11.420  -1.333  -4.756
  237   1HG   LYS  32          2HG       LYS  32 -10.954  -2.177  -6.930
  238   2HG   LYS  32          1HG       LYS  32 -11.053  -3.841  -6.359
  239   1HD   LYS  32          2HD       LYS  32 -13.398  -3.633  -5.944
  240   2HD   LYS  32          1HD       LYS  32 -13.350  -1.894  -6.240
  241   1HE   LYS  32          2HE       LYS  32 -12.981  -2.198  -8.550
  242   2HE   LYS  32          1HE       LYS  32 -12.593  -3.905  -8.341
  243   1HZ   LYS  32          1HZ       LYS  32 -14.901  -3.249  -9.225
  244   2HZ   LYS  32          2HZ       LYS  32 -15.261  -2.889  -7.612
  245   3HZ   LYS  32          3HZ       LYS  32 -14.800  -4.459  -8.047
  246    H    THR  33           H        THR  33  -9.196  -0.096  -4.967
  247    HA   THR  33           HA       THR  33  -6.922  -0.539  -6.672
  248    HB   THR  33           HB       THR  33  -9.014   1.010  -8.080
  249    HG1  THR  33           1HG      THR  33  -9.110  -1.819  -8.037
  250   1HG2  THR  33          1HG2      THR  33  -6.617  -0.451  -8.735
  251   2HG2  THR  33          2HG2      THR  33  -7.488   0.772  -9.662
  252   3HG2  THR  33          3HG2      THR  33  -7.971  -0.922  -9.762
  253    H    LEU  34           H        LEU  34  -6.827   1.907  -7.958
  254    HA   LEU  34           HA       LEU  34  -6.033   3.609  -5.837
  255   1HB   LEU  34          2HB       LEU  34  -6.470   4.335  -8.735
  256   2HB   LEU  34          1HB       LEU  34  -5.523   5.239  -7.567
  257    HG   LEU  34           HG       LEU  34  -4.855   2.454  -8.524
  258   1HD1  LEU  34          1HD1      LEU  34  -2.860   3.990  -9.445
  259   2HD1  LEU  34          2HD1      LEU  34  -4.196   5.135  -9.562
  260   3HD1  LEU  34          3HD1      LEU  34  -4.290   3.583 -10.394
  261   1HD2  LEU  34          1HD2      LEU  34  -4.092   3.640  -6.199
  262   2HD2  LEU  34          2HD2      LEU  34  -2.799   4.140  -7.290
  263   3HD2  LEU  34          3HD2      LEU  34  -3.151   2.426  -7.067
  264    H    ARG  35           H        ARG  35  -8.775   3.695  -8.092
  265    HA   ARG  35           HA       ARG  35  -9.917   6.075  -7.099
  266   1HB   ARG  35          2HB       ARG  35 -11.081   3.711  -8.569
  267   2HB   ARG  35          1HB       ARG  35 -12.059   5.097  -8.104
  268   1HG   ARG  35          2HG       ARG  35  -9.586   5.294  -9.805
  269   2HG   ARG  35          1HG       ARG  35 -11.221   5.140 -10.451
  270   1HD   ARG  35          2HD       ARG  35 -11.828   7.193  -9.145
  271   2HD   ARG  35          1HD       ARG  35 -10.115   7.380  -8.768
  272    HE   ARG  35           HE       ARG  35  -9.757   8.139 -10.901
  273   1HH1  ARG  35          1HH1      ARG  35 -12.913   6.659 -10.734
  274   2HH1  ARG  35          2HH1      ARG  35 -13.385   7.193 -12.313
  275   1HH2  ARG  35          1HH2      ARG  35 -10.375   8.842 -12.976
  276   2HH2  ARG  35          2HH2      ARG  35 -11.944   8.432 -13.586
  277    H    GLU  36           H        GLU  36 -10.456   2.664  -6.317
  278    HA   GLU  36           HA       GLU  36 -12.441   3.156  -4.341
  279   1HB   GLU  36          2HB       GLU  36 -11.632   0.937  -5.655
  280   2HB   GLU  36          1HB       GLU  36 -10.793   0.703  -4.128
  281   1HG   GLU  36          2HG       GLU  36 -12.719  -0.333  -3.592
  282   2HG   GLU  36          1HG       GLU  36 -13.205   1.311  -3.178
  283    H    ALA  37           H        ALA  37  -8.942   2.961  -4.327
  284    HA   ALA  37           HA       ALA  37  -8.668   2.797  -1.488
  285   1HB   ALA  37          1HB       ALA  37  -6.282   3.587  -2.052
  286   2HB   ALA  37          2HB       ALA  37  -6.781   3.416  -3.735
  287   3HB   ALA  37          3HB       ALA  37  -6.809   2.017  -2.662
  288    H    GLU  38           H        GLU  38  -9.056   5.382  -3.787
  289    HA   GLU  38           HA       GLU  38  -8.178   7.481  -2.070
  290   1HB   GLU  38          2HB       GLU  38  -9.963   7.514  -4.508
  291   2HB   GLU  38          1HB       GLU  38  -9.383   8.958  -3.690
  292   1HG   GLU  38          2HG       GLU  38  -7.331   8.800  -4.585
  293   2HG   GLU  38          1HG       GLU  38  -7.300   7.042  -4.469
  294    H    LYS  39           H        LYS  39 -11.301   6.027  -2.849
  295    HA   LYS  39           HA       LYS  39 -12.887   7.791  -1.321
  296   1HB   LYS  39          2HB       LYS  39 -13.910   6.365  -2.982
  297   2HB   LYS  39          1HB       LYS  39 -13.335   4.922  -2.162
  298   1HG   LYS  39          2HG       LYS  39 -15.140   6.810  -0.722
  299   2HG   LYS  39          1HG       LYS  39 -15.808   5.680  -1.902
  300   1HD   LYS  39          2HD       LYS  39 -14.323   3.956  -0.550
  301   2HD   LYS  39          1HD       LYS  39 -14.529   5.151   0.732
  302   1HE   LYS  39          2HE       LYS  39 -16.915   4.973   0.601
  303   2HE   LYS  39          1HE       LYS  39 -16.808   3.955  -0.835
  304   1HZ   LYS  39          1HZ       LYS  39 -15.411   2.990   1.524
  305   2HZ   LYS  39          2HZ       LYS  39 -16.320   2.140   0.380
  306   3HZ   LYS  39          3HZ       LYS  39 -17.101   2.990   1.617
  307    H    LYS  40           H        LYS  40 -11.093   4.875  -0.545
  308    HA   LYS  40           HA       LYS  40 -12.162   4.612   2.100
  309   1HB   LYS  40          2HB       LYS  40  -9.726   3.397   0.796
  310   2HB   LYS  40          1HB       LYS  40 -10.305   2.974   2.401
  311   1HG   LYS  40          2HG       LYS  40 -12.539   2.673   0.812
  312   2HG   LYS  40          1HG       LYS  40 -11.221   2.086  -0.202
  313   1HD   LYS  40          2HD       LYS  40 -11.889   0.186   0.970
  314   2HD   LYS  40          1HD       LYS  40 -10.492   0.762   1.884
  315   1HE   LYS  40          2HE       LYS  40 -11.884   0.519   3.642
  316   2HE   LYS  40          1HE       LYS  40 -12.457   2.107   3.135
  317   1HZ   LYS  40          1HZ       LYS  40 -14.371   1.251   2.287
  318   2HZ   LYS  40          2HZ       LYS  40 -14.106   0.127   3.522
  319   3HZ   LYS  40          3HZ       LYS  40 -13.692  -0.257   1.928
  320    H    ILE  41           H        ILE  41  -9.189   5.943   0.704
  321    HA   ILE  41           HA       ILE  41  -8.056   6.625   3.244
  322    HB   ILE  41           HB       ILE  41  -7.326   7.617   0.485
  323   1HG1  ILE  41          2HG1      ILE  41  -5.772   5.591   2.055
  324   2HG1  ILE  41          1HG1      ILE  41  -7.183   5.078   1.137
  325   1HG2  ILE  41          1HG2      ILE  41  -5.774   7.743   3.066
  326   2HG2  ILE  41          2HG2      ILE  41  -6.528   9.109   2.244
  327   3HG2  ILE  41          3HG2      ILE  41  -5.189   8.249   1.481
  328   1HD1  ILE  41          1HD1      ILE  41  -6.183   5.942  -0.903
  329   2HD1  ILE  41          2HD1      ILE  41  -5.122   4.770  -0.121
  330   3HD1  ILE  41          3HD1      ILE  41  -4.781   6.496   0.011
  331    H    LYS  42           H        LYS  42 -10.174   8.190   0.974
  332    HA   LYS  42           HA       LYS  42  -9.848  10.861   1.574
  333   1HB   LYS  42          2HB       LYS  42 -12.053   9.198   0.569
  334   2HB   LYS  42          1HB       LYS  42 -12.531  10.738   1.268
  335   1HG   LYS  42          2HG       LYS  42 -11.040  11.907  -0.260
  336   2HG   LYS  42          1HG       LYS  42 -10.529  10.366  -0.950
  337   1HD   LYS  42          2HD       LYS  42 -12.158  10.745  -2.451
  338   2HD   LYS  42          1HD       LYS  42 -13.236  10.184  -1.171
  339   1HE   LYS  42          2HE       LYS  42 -13.657  12.448  -0.465
  340   2HE   LYS  42          1HE       LYS  42 -12.462  13.066  -1.605
  341   1HZ   LYS  42          1HZ       LYS  42 -14.676  11.469  -2.662
  342   2HZ   LYS  42          2HZ       LYS  42 -13.848  12.766  -3.366
  343   3HZ   LYS  42          3HZ       LYS  42 -15.008  13.053  -2.170
  344    H    GLU  43           H        GLU  43 -11.221   8.357   3.535
  345    HA   GLU  43           HA       GLU  43 -11.916  10.365   5.566
  346   1HB   GLU  43          2HB       GLU  43 -13.200   7.667   5.132
  347   2HB   GLU  43          1HB       GLU  43 -13.612   8.803   6.409
  348   1HG   GLU  43          2HG       GLU  43 -14.967   9.945   5.078
  349   2HG   GLU  43          1HG       GLU  43 -13.750  10.046   3.806
  350    H    LEU  44           H        LEU  44 -11.052   6.923   5.222
  351    HA   LEU  44           HA       LEU  44 -10.124   6.640   7.876
  352   1HB   LEU  44          2HB       LEU  44 -10.468   4.988   5.599
  353   2HB   LEU  44          1HB       LEU  44  -8.807   4.796   6.127
  354    HG   LEU  44           HG       LEU  44 -10.227   3.104   7.139
  355   1HD1  LEU  44          1HD1      LEU  44  -8.333   3.854   8.433
  356   2HD1  LEU  44          2HD1      LEU  44  -9.690   3.526   9.508
  357   3HD1  LEU  44          3HD1      LEU  44  -9.274   5.190   9.096
  358   1HD2  LEU  44          1HD2      LEU  44 -12.169   3.504   8.268
  359   2HD2  LEU  44          2HD2      LEU  44 -12.224   4.838   7.115
  360   3HD2  LEU  44          3HD2      LEU  44 -11.677   5.123   8.768
  361    H    PHE  45           H        PHE  45  -8.188   7.003   8.795
  362    HA   PHE  45           HA       PHE  45  -6.147   8.306   7.158
  363   1HB   PHE  45          2HB       PHE  45  -6.937   9.404   9.249
  364   2HB   PHE  45          1HB       PHE  45  -6.302   8.044  10.169
  365    HD1  PHE  45           1HD      PHE  45  -5.515  11.113   8.419
  366    HD2  PHE  45           2HD      PHE  45  -3.869   7.659  10.282
  367    HE1  PHE  45           1HE      PHE  45  -3.323  12.223   8.533
  368    HE2  PHE  45           2HE      PHE  45  -1.673   8.763  10.401
  369    HZ   PHE  45           HZ       PHE  45  -1.398  11.049   9.524
  370    H    PHE  46           H        PHE  46  -4.899   6.805   6.188
  371    HA   PHE  46           HA       PHE  46  -3.890   4.562   7.787
  372   1HB   PHE  46          2HB       PHE  46  -3.891   5.027   4.802
  373   2HB   PHE  46          1HB       PHE  46  -3.178   3.624   5.589
  374    HD1  PHE  46           1HD      PHE  46  -5.843   4.547   3.737
  375    HD2  PHE  46           2HD      PHE  46  -5.008   2.640   7.447
  376    HE1  PHE  46           1HE      PHE  46  -8.012   3.392   3.625
  377    HE2  PHE  46           2HE      PHE  46  -7.177   1.481   7.343
  378    HZ   PHE  46           HZ       PHE  46  -8.682   1.858   5.431
  379    HA   PRO  47           HA       PRO  47  -0.012   6.825   7.956
  380   1HB   PRO  47          2HB       PRO  47   1.365   5.029   9.428
  381   2HB   PRO  47          1HB       PRO  47   0.136   6.083  10.139
  382   1HG   PRO  47          2HG       PRO  47  -0.074   3.218   9.307
  383   2HG   PRO  47          1HG       PRO  47  -0.702   4.009  10.765
  384   1HD   PRO  47          2HD       PRO  47  -2.242   3.447   8.586
  385   2HD   PRO  47          1HD       PRO  47  -2.563   4.807   9.679
  386    H    VAL  48           H        VAL  48  -0.564   3.656   6.695
  387    HA   VAL  48           HA       VAL  48   1.723   3.956   4.914
  388    HB   VAL  48           HB       VAL  48   1.149   1.344   6.296
  389   1HG1  VAL  48          1HG1      VAL  48   3.247   2.350   4.420
  390   2HG1  VAL  48          2HG1      VAL  48   2.327   0.847   4.369
  391   3HG1  VAL  48          3HG1      VAL  48   3.621   1.049   5.549
  392   1HG2  VAL  48          1HG2      VAL  48   1.793   2.753   8.036
  393   2HG2  VAL  48          2HG2      VAL  48   2.995   3.574   7.040
  394   3HG2  VAL  48          3HG2      VAL  48   3.269   1.911   7.560
  395    H    ILE  49           H        ILE  49   1.012   3.732   2.920
  396    HA   ILE  49           HA       ILE  49  -1.360   2.096   2.371
  397    HB   ILE  49           HB       ILE  49  -0.160   4.116   0.488
  398   1HG1  ILE  49          2HG1      ILE  49  -0.780   5.143   2.725
  399   2HG1  ILE  49          1HG1      ILE  49  -1.594   5.823   1.322
  400   1HG2  ILE  49          1HG2      ILE  49  -2.552   2.413   0.550
  401   2HG2  ILE  49          2HG2      ILE  49  -1.644   3.053  -0.820
  402   3HG2  ILE  49          3HG2      ILE  49  -2.822   4.070   0.011
  403   1HD1  ILE  49          1HD1      ILE  49  -2.727   3.928   3.358
  404   2HD1  ILE  49          2HD1      ILE  49  -3.543   4.356   1.855
  405   3HD1  ILE  49          3HD1      ILE  49  -3.194   5.601   3.053
  406    H    VAL  50           H        VAL  50  -1.322   0.720   0.472
  407    HA   VAL  50           HA       VAL  50   1.343   0.165  -0.609
  408    HB   VAL  50           HB       VAL  50  -0.531  -2.059   0.198
  409   1HG1  VAL  50          1HG1      VAL  50   1.899  -3.156   0.199
  410   2HG1  VAL  50          2HG1      VAL  50   2.178  -1.873  -0.978
  411   3HG1  VAL  50          3HG1      VAL  50   0.901  -3.058  -1.251
  412   1HG2  VAL  50          1HG2      VAL  50   0.629  -2.372   2.221
  413   2HG2  VAL  50          2HG2      VAL  50   0.293  -0.642   2.150
  414   3HG2  VAL  50          3HG2      VAL  50   1.904  -1.243   1.759
  415    H    LEU  51           H        LEU  51   0.994  -1.526  -2.548
  416    HA   LEU  51           HA       LEU  51  -1.552  -1.305  -3.840
  417   1HB   LEU  51          2HB       LEU  51  -0.749   0.887  -4.382
  418   2HB   LEU  51          1HB       LEU  51   0.801   0.250  -4.895
  419    HG   LEU  51           HG       LEU  51  -0.464  -0.982  -6.729
  420   1HD1  LEU  51          1HD1      LEU  51  -2.631   0.009  -7.360
  421   2HD1  LEU  51          2HD1      LEU  51  -2.628   0.924  -5.852
  422   3HD1  LEU  51          3HD1      LEU  51  -2.693  -0.838  -5.815
  423   1HD2  LEU  51          1HD2      LEU  51  -0.058   1.964  -6.550
  424   2HD2  LEU  51          2HD2      LEU  51  -0.839   1.291  -7.980
  425   3HD2  LEU  51          3HD2      LEU  51   0.785   0.766  -7.533
  426    H    ASP  52           H        ASP  52  -1.826  -3.203  -4.705
  427    HA   ASP  52           HA       ASP  52   0.479  -4.692  -5.759
  428   1HB   ASP  52          2HB       ASP  52  -1.117  -5.624  -3.911
  429   2HB   ASP  52          1HB       ASP  52  -2.222  -5.906  -5.252
  430    H    VAL  53           H        VAL  53   0.558  -3.720  -7.787
  431    HA   VAL  53           HA       VAL  53  -1.598  -3.241  -9.485
  432    HB   VAL  53           HB       VAL  53   0.040  -3.172 -11.315
  433   1HG1  VAL  53          1HG1      VAL  53  -0.177  -1.212  -9.953
  434   2HG1  VAL  53          2HG1      VAL  53   1.531  -1.444 -10.325
  435   3HG1  VAL  53          3HG1      VAL  53   0.907  -1.881  -8.734
  436   1HG2  VAL  53          1HG2      VAL  53   1.939  -4.330 -11.286
  437   2HG2  VAL  53          2HG2      VAL  53   1.444  -5.024  -9.744
  438   3HG2  VAL  53          3HG2      VAL  53   2.436  -3.568  -9.776
  439    H    TRP  54           H        TRP  54  -2.960  -5.115  -9.278
  440    HA   TRP  54           HA       TRP  54  -2.026  -7.637 -10.332
  441   1HB   TRP  54          2HB       TRP  54  -3.624  -7.714  -8.525
  442   2HB   TRP  54          1HB       TRP  54  -4.756  -6.706  -9.417
  443    HD1  TRP  54           HD       TRP  54  -6.712  -8.109 -10.274
  444    HE1  TRP  54           1HE      TRP  54  -7.022 -10.492 -11.192
  445    HE3  TRP  54           3HE      TRP  54  -1.889  -9.742  -9.916
  446    HZ2  TRP  54           2HZ      TRP  54  -5.428 -12.769 -11.696
  447    HZ3  TRP  54           3HZ      TRP  54  -1.361 -12.037 -10.636
  448    HH2  TRP  54           HH       TRP  54  -3.096 -13.518 -11.508
  449    H    MET  55           H        MET  55  -5.076  -6.087 -11.222
  450    HA   MET  55           HA       MET  55  -4.230  -5.827 -13.986
  451   1HB   MET  55          2HB       MET  55  -5.937  -7.992 -13.013
  452   2HB   MET  55          1HB       MET  55  -6.669  -7.078 -14.322
  453   1HG   MET  55          2HG       MET  55  -4.726  -7.483 -15.720
  454   2HG   MET  55          1HG       MET  55  -3.949  -8.360 -14.404
  455   1HE   MET  55          1HE       MET  55  -5.132  -9.053 -17.645
  456   2HE   MET  55          2HE       MET  55  -5.256 -10.799 -17.434
  457   3HE   MET  55          3HE       MET  55  -3.829  -9.940 -16.853
  458    HA   PRO  56           HA       PRO  56  -7.601  -2.868 -12.461
  459   1HB   PRO  56          2HB       PRO  56  -6.199  -0.767 -11.579
  460   2HB   PRO  56          1HB       PRO  56  -6.513  -2.161 -10.538
  461   1HG   PRO  56          2HG       PRO  56  -4.041  -1.460 -12.069
  462   2HG   PRO  56          1HG       PRO  56  -4.193  -2.081 -10.416
  463   1HD   PRO  56          2HD       PRO  56  -3.589  -3.637 -12.600
  464   2HD   PRO  56          1HD       PRO  56  -4.356  -4.246 -11.121
  465    H    ASP  57           H        ASP  57  -7.424  -0.235 -13.016
  466    HA   ASP  57           HA       ASP  57  -6.206   0.016 -15.668
  467   1HB   ASP  57          2HB       ASP  57  -8.578  -0.678 -15.953
  468   2HB   ASP  57          1HB       ASP  57  -9.072   0.771 -15.080
  469    H    GLY  58           H        GLY  58  -5.055   1.133 -13.518
  470   1HA   GLY  58          2HA       GLY  58  -5.345   3.962 -14.090
  471   2HA   GLY  58          1HA       GLY  58  -5.740   3.497 -12.443
  472    H    ASP  59           H        ASP  59  -3.505   5.102 -13.766
  473    HA   ASP  59           HA       ASP  59  -1.113   3.618 -13.200
  474   1HB   ASP  59          2HB       ASP  59  -1.769   6.353 -14.157
  475   2HB   ASP  59          1HB       ASP  59  -0.210   6.139 -13.368
  476    H    GLY  60           H        GLY  60   0.291   3.853 -11.475
  477   1HA   GLY  60          2HA       GLY  60  -0.945   4.905  -9.045
  478   2HA   GLY  60          1HA       GLY  60   0.448   3.839  -9.122
  479    H    VAL  61           H        VAL  61   1.442   5.836 -11.314
  480    HA   VAL  61           HA       VAL  61   3.313   7.175  -9.789
  481    HB   VAL  61           HB       VAL  61   2.211   8.138 -12.431
  482   1HG1  VAL  61          1HG1      VAL  61   4.785   8.590 -10.958
  483   2HG1  VAL  61          2HG1      VAL  61   3.629   9.786 -11.543
  484   3HG1  VAL  61          3HG1      VAL  61   4.620   8.884 -12.688
  485   1HG2  VAL  61          1HG2      VAL  61   4.259   6.014 -11.826
  486   2HG2  VAL  61          2HG2      VAL  61   4.087   6.781 -13.405
  487   3HG2  VAL  61          3HG2      VAL  61   2.757   5.840 -12.732
  488    H    ASN  62           H        ASN  62   0.295   8.497 -11.169
  489    HA   ASN  62           HA       ASN  62   0.571  11.005  -9.882
  490   1HB   ASN  62          2HB       ASN  62  -1.722  11.324 -10.756
  491   2HB   ASN  62          1HB       ASN  62  -0.589  10.802 -11.984
  492   1HD2  ASN  62          1HD2      ASN  62  -0.852   8.842 -12.948
  493   2HD2  ASN  62          2HD2      ASN  62  -2.235   7.836 -12.699
  494    H    PHE  63           H        PHE  63  -0.283   7.992  -8.687
  495    HA   PHE  63           HA       PHE  63  -2.328   8.918  -6.860
  496   1HB   PHE  63          2HB       PHE  63  -2.397   6.631  -7.830
  497   2HB   PHE  63          1HB       PHE  63  -0.924   6.241  -6.946
  498    HD1  PHE  63           1HD      PHE  63  -4.045   8.036  -5.987
  499    HD2  PHE  63           2HD      PHE  63  -1.418   4.772  -5.250
  500    HE1  PHE  63           1HE      PHE  63  -5.391   7.403  -4.029
  501    HE2  PHE  63           2HE      PHE  63  -2.759   4.130  -3.289
  502    HZ   PHE  63           HZ       PHE  63  -4.750   5.448  -2.677
  503    H    ILE  64           H        ILE  64   1.097   8.081  -6.744
  504    HA   ILE  64           HA       ILE  64   1.537   7.908  -4.036
  505    HB   ILE  64           HB       ILE  64   3.306   9.203  -6.115
  506   1HG1  ILE  64          2HG1      ILE  64   4.382   6.765  -5.295
  507   2HG1  ILE  64          1HG1      ILE  64   2.652   6.456  -5.410
  508   1HG2  ILE  64          1HG2      ILE  64   5.153   8.824  -4.529
  509   2HG2  ILE  64          2HG2      ILE  64   3.981   8.323  -3.310
  510   3HG2  ILE  64          3HG2      ILE  64   3.969   9.979  -3.917
  511   1HD1  ILE  64          1HD1      ILE  64   4.570   7.269  -7.546
  512   2HD1  ILE  64          2HD1      ILE  64   2.843   7.574  -7.722
  513   3HD1  ILE  64          3HD1      ILE  64   3.428   5.924  -7.515
  514    H    ASP  65           H        ASP  65   0.901  10.774  -5.945
  515    HA   ASP  65           HA       ASP  65   1.579  12.597  -3.817
  516   1HB   ASP  65          2HB       ASP  65   1.579  13.007  -6.410
  517   2HB   ASP  65          1HB       ASP  65  -0.127  13.367  -6.164
  518    H    PHE  66           H        PHE  66  -1.228  10.848  -4.857
  519    HA   PHE  66           HA       PHE  66  -3.184  12.476  -3.595
  520   1HB   PHE  66          2HB       PHE  66  -3.836  10.864  -5.302
  521   2HB   PHE  66          1HB       PHE  66  -3.233   9.534  -4.318
  522    HD1  PHE  66           1HD      PHE  66  -4.433   8.846  -2.295
  523    HD2  PHE  66           2HD      PHE  66  -5.960  11.866  -4.875
  524    HE1  PHE  66           1HE      PHE  66  -6.647   8.616  -1.246
  525    HE2  PHE  66           2HE      PHE  66  -8.176  11.643  -3.831
  526    HZ   PHE  66           HZ       PHE  66  -8.522  10.017  -2.014
  527    H    ILE  67           H        ILE  67  -1.302   9.659  -2.588
  528    HA   ILE  67           HA       ILE  67  -2.501   9.256  -0.084
  529    HB   ILE  67           HB       ILE  67   0.301   8.669  -1.052
  530   1HG1  ILE  67          2HG1      ILE  67  -0.720   6.278  -0.774
  531   2HG1  ILE  67          1HG1      ILE  67  -2.262   7.126  -0.829
  532   1HG2  ILE  67          1HG2      ILE  67   0.797   8.590   1.157
  533   2HG2  ILE  67          2HG2      ILE  67   0.034   7.005   1.035
  534   3HG2  ILE  67          3HG2      ILE  67  -0.886   8.383   1.641
  535   1HD1  ILE  67          1HD1      ILE  67  -0.338   7.785  -2.961
  536   2HD1  ILE  67          2HD1      ILE  67  -2.087   7.570  -3.029
  537   3HD1  ILE  67          3HD1      ILE  67  -1.026   6.161  -2.991
  538    H    LYS  68           H        LYS  68   0.218  11.294  -1.089
  539    HA   LYS  68           HA       LYS  68   0.669  12.291   1.564
  540   1HB   LYS  68          2HB       LYS  68   2.266  13.827   0.488
  541   2HB   LYS  68          1HB       LYS  68   2.538  12.150   0.034
  542   1HG   LYS  68          2HG       LYS  68   2.740  13.170  -1.976
  543   2HG   LYS  68          1HG       LYS  68   1.024  12.771  -1.983
  544   1HD   LYS  68          2HD       LYS  68   0.636  14.929  -2.407
  545   2HD   LYS  68          1HD       LYS  68   1.130  15.247  -0.743
  546   1HE   LYS  68          2HE       LYS  68   3.337  14.954  -2.661
  547   2HE   LYS  68          1HE       LYS  68   2.291  16.347  -2.939
  548   1HZ   LYS  68          1HZ       LYS  68   2.728  17.154  -0.770
  549   2HZ   LYS  68          2HZ       LYS  68   4.228  16.755  -1.443
  550   3HZ   LYS  68          3HZ       LYS  68   3.508  15.727  -0.307
  551    H    GLU  69           H        GLU  69  -1.396  13.075  -1.056
  552    HA   GLU  69           HA       GLU  69  -1.797  15.829  -0.514
  553   1HB   GLU  69          2HB       GLU  69  -2.390  14.676  -2.654
  554   2HB   GLU  69          1HB       GLU  69  -3.729  13.910  -1.813
  555   1HG   GLU  69          2HG       GLU  69  -4.559  16.222  -1.268
  556   2HG   GLU  69          1HG       GLU  69  -3.342  16.831  -2.389
  557    H    ASN  70           H        ASN  70  -3.263  12.877   0.686
  558    HA   ASN  70           HA       ASN  70  -4.795  14.493   2.613
  559   1HB   ASN  70          2HB       ASN  70  -5.800  11.807   1.755
  560   2HB   ASN  70          1HB       ASN  70  -6.696  13.182   2.392
  561   1HD2  ASN  70          1HD2      ASN  70  -4.760  12.213  -0.406
  562   2HD2  ASN  70          2HD2      ASN  70  -5.703  13.065  -1.574
  563    H    SER  71           H        SER  71  -2.148  12.853   2.527
  564    HA   SER  71           HA       SER  71  -2.316  11.958   5.230
  565   1HB   SER  71          2HB       SER  71  -2.737  10.022   3.094
  566   2HB   SER  71          1HB       SER  71  -1.359   9.595   4.108
  567    HG   SER  71           HG       SER  71  -3.994  10.166   5.000
  568    HA   PRO  72           HA       PRO  72   1.837  13.294   3.536
  569   1HB   PRO  72          2HB       PRO  72   1.787  15.129   5.823
  570   2HB   PRO  72          1HB       PRO  72   2.070  15.480   4.117
  571   1HG   PRO  72          2HG       PRO  72  -0.195  16.217   5.378
  572   2HG   PRO  72          1HG       PRO  72  -0.169  15.760   3.666
  573   1HD   PRO  72          2HD       PRO  72  -1.041  14.165   6.042
  574   2HD   PRO  72          1HD       PRO  72  -1.769  14.270   4.426
  575    H    ASP  73           H        ASP  73   0.548  12.351   6.560
  576    HA   ASP  73           HA       ASP  73   3.185  11.697   7.638
  577   1HB   ASP  73          2HB       ASP  73   1.298  12.876   8.966
  578   2HB   ASP  73          1HB       ASP  73   0.607  11.262   9.100
  579    H    SER  74           H        SER  74   1.845  10.230   5.409
  580    HA   SER  74           HA       SER  74   1.642   7.586   6.681
  581   1HB   SER  74          2HB       SER  74  -0.415   8.298   5.518
  582   2HB   SER  74          1HB       SER  74   0.502   8.475   4.023
  583    HG   SER  74           HG       SER  74  -0.648   6.297   4.959
  584    H    VAL  75           H        VAL  75   1.954   5.997   4.411
  585    HA   VAL  75           HA       VAL  75   4.464   6.778   3.165
  586    HB   VAL  75           HB       VAL  75   4.295   4.187   4.701
  587   1HG1  VAL  75          1HG1      VAL  75   6.199   5.398   2.753
  588   2HG1  VAL  75          2HG1      VAL  75   5.708   3.717   2.954
  589   3HG1  VAL  75          3HG1      VAL  75   6.865   4.437   4.074
  590   1HG2  VAL  75          1HG2      VAL  75   4.571   5.807   6.355
  591   2HG2  VAL  75          2HG2      VAL  75   5.573   6.829   5.325
  592   3HG2  VAL  75          3HG2      VAL  75   6.224   5.324   5.975
  593    H    VAL  76           H        VAL  76   4.623   6.097   1.165
  594    HA   VAL  76           HA       VAL  76   2.616   4.193   0.190
  595    HB   VAL  76           HB       VAL  76   4.368   6.037  -1.434
  596   1HG1  VAL  76          1HG1      VAL  76   3.706   4.583  -3.031
  597   2HG1  VAL  76          2HG1      VAL  76   2.225   5.537  -2.974
  598   3HG1  VAL  76          3HG1      VAL  76   2.326   4.013  -2.091
  599   1HG2  VAL  76          1HG2      VAL  76   1.813   6.467  -0.026
  600   2HG2  VAL  76          2HG2      VAL  76   1.896   7.066  -1.682
  601   3HG2  VAL  76          3HG2      VAL  76   3.066   7.620  -0.484
  602    H    ILE  77           H        ILE  77   3.236   2.163   0.010
  603    HA   ILE  77           HA       ILE  77   6.047   1.519  -0.448
  604    HB   ILE  77           HB       ILE  77   3.725  -0.315   0.184
  605   1HG1  ILE  77          2HG1      ILE  77   4.273   1.258   2.010
  606   2HG1  ILE  77          1HG1      ILE  77   4.653  -0.407   2.437
  607   1HG2  ILE  77          1HG2      ILE  77   5.303  -1.660  -0.885
  608   2HG2  ILE  77          2HG2      ILE  77   5.684  -1.853   0.826
  609   3HG2  ILE  77          3HG2      ILE  77   6.664  -0.787  -0.181
  610   1HD1  ILE  77          1HD1      ILE  77   7.032   0.284   1.526
  611   2HD1  ILE  77          2HD1      ILE  77   6.533   0.621   3.182
  612   3HD1  ILE  77          3HD1      ILE  77   6.458   1.893   1.962
  613    H    VAL  78           H        VAL  78   2.923   0.316  -1.711
  614    HA   VAL  78           HA       VAL  78   2.295  -0.426  -3.773
  615    HB   VAL  78           HB       VAL  78   4.514   1.412  -4.710
  616   1HG1  VAL  78          1HG1      VAL  78   2.193   0.231  -6.240
  617   2HG1  VAL  78          2HG1      VAL  78   3.891  -0.200  -6.433
  618   3HG1  VAL  78          3HG1      VAL  78   3.340   1.420  -6.859
  619   1HG2  VAL  78          1HG2      VAL  78   1.680   2.181  -4.975
  620   2HG2  VAL  78          2HG2      VAL  78   3.091   3.158  -4.569
  621   3HG2  VAL  78          3HG2      VAL  78   2.324   2.159  -3.333
  622    H    ILE  79           H        ILE  79   2.668  -2.501  -4.142
  623    HA   ILE  79           HA       ILE  79   5.397  -3.340  -4.881
  624    HB   ILE  79           HB       ILE  79   3.491  -5.321  -3.725
  625   1HG1  ILE  79          2HG1      ILE  79   5.184  -3.515  -1.994
  626   2HG1  ILE  79          1HG1      ILE  79   3.447  -3.323  -2.206
  627   1HG2  ILE  79          1HG2      ILE  79   5.306  -6.581  -3.918
  628   2HG2  ILE  79          2HG2      ILE  79   6.100  -5.577  -2.704
  629   3HG2  ILE  79          3HG2      ILE  79   6.263  -5.186  -4.415
  630   1HD1  ILE  79          1HD1      ILE  79   3.469  -4.520  -0.283
  631   2HD1  ILE  79          2HD1      ILE  79   4.961  -5.368  -0.694
  632   3HD1  ILE  79          3HD1      ILE  79   3.439  -5.847  -1.444
  633    H    THR  80           H        THR  80   5.169  -5.667  -6.000
  634    HA   THR  80           HA       THR  80   4.401  -6.920  -7.747
  635    HB   THR  80           HB       THR  80   1.892  -5.273  -7.880
  636    HG1  THR  80           1HG      THR  80   2.591  -7.191  -5.924
  637   1HG2  THR  80          1HG2      THR  80   1.152  -6.901  -9.170
  638   2HG2  THR  80          2HG2      THR  80   1.469  -8.081  -7.899
  639   3HG2  THR  80          3HG2      THR  80   2.727  -7.687  -9.070
  640    H    GLY  81           H        GLY  81   4.196  -6.777 -10.057
  641   1HA   GLY  81          2HA       GLY  81   4.100  -4.203 -11.338
  642   2HA   GLY  81          1HA       GLY  81   5.718  -4.889 -11.299
  643    H    HIS  82           H        HIS  82   3.709  -4.335 -13.499
  644    HA   HIS  82           HA       HIS  82   3.803  -7.022 -14.705
  645   1HB   HIS  82          2HB       HIS  82   1.480  -6.100 -14.068
  646   2HB   HIS  82          1HB       HIS  82   1.703  -4.982 -15.409
  647    HD1  HIS  82           1HD      HIS  82   1.154  -8.609 -14.653
  648    HD2  HIS  82           2HD      HIS  82   1.458  -6.102 -17.952
  649    HE1  HIS  82           1HE      HIS  82   0.386  -9.983 -16.614
  650    HE2  HIS  82           2HE      HIS  82   0.663  -8.472 -18.612
  651    H    GLY  83           H        GLY  83   5.852  -5.072 -14.892
  652   1HA   GLY  83          2HA       GLY  83   6.033  -4.889 -17.766
  653   2HA   GLY  83          1HA       GLY  83   5.906  -3.328 -16.970
  654    H    SER  84           H        SER  84   7.619  -6.289 -16.012
  655    HA   SER  84           HA       SER  84   9.807  -6.705 -15.558
  656   1HB   SER  84          2HB       SER  84   9.908  -4.723 -17.732
  657   2HB   SER  84          1HB       SER  84  11.367  -4.793 -16.743
  658    HG   SER  84           HG       SER  84  11.005  -6.315 -18.670
  659    H    VAL  85           H        VAL  85  10.079  -3.175 -15.833
  660    HA   VAL  85           HA       VAL  85   9.831  -2.565 -13.116
  661    HB   VAL  85           HB       VAL  85  11.822  -3.925 -12.787
  662   1HG1  VAL  85          1HG1      VAL  85  12.616  -3.317 -15.221
  663   2HG1  VAL  85          2HG1      VAL  85  13.775  -3.751 -13.965
  664   3HG1  VAL  85          3HG1      VAL  85  13.510  -2.056 -14.372
  665   1HG2  VAL  85          1HG2      VAL  85  12.640  -1.037 -12.557
  666   2HG2  VAL  85          2HG2      VAL  85  13.102  -2.388 -11.521
  667   3HG2  VAL  85          3HG2      VAL  85  11.445  -1.786 -11.497
  668    H    ASP  86           H        ASP  86   8.744  -0.842 -14.168
  669    HA   ASP  86           HA       ASP  86  10.552   1.328 -14.944
  670   1HB   ASP  86          2HB       ASP  86   9.729   0.324 -17.039
  671   2HB   ASP  86          1HB       ASP  86   8.069   0.567 -16.502
  672    H    THR  87           H        THR  87   7.038   0.664 -14.541
  673    HA   THR  87           HA       THR  87   6.255   3.175 -13.748
  674    HB   THR  87           HB       THR  87   4.836   1.051 -14.121
  675    HG1  THR  87           1HG      THR  87   3.191   1.916 -12.778
  676   1HG2  THR  87          1HG2      THR  87   5.783  -0.371 -12.392
  677   2HG2  THR  87          2HG2      THR  87   4.069  -0.078 -12.100
  678   3HG2  THR  87          3HG2      THR  87   5.283   0.783 -11.155
  679    H    ALA  88           H        ALA  88   7.984   0.751 -11.965
  680    HA   ALA  88           HA       ALA  88   7.668   1.698  -9.353
  681   1HB   ALA  88          1HB       ALA  88   9.905   0.215 -10.712
  682   2HB   ALA  88          2HB       ALA  88   8.661  -0.431  -9.647
  683   3HB   ALA  88          3HB       ALA  88   9.932   0.602  -8.994
  684    H    VAL  89           H        VAL  89  10.377   2.233 -11.583
  685    HA   VAL  89           HA       VAL  89  11.645   4.208 -10.057
  686    HB   VAL  89           HB       VAL  89  12.915   4.733 -12.081
  687   1HG1  VAL  89          1HG1      VAL  89  12.975   2.416 -10.723
  688   2HG1  VAL  89          2HG1      VAL  89  14.086   2.802 -12.037
  689   3HG1  VAL  89          3HG1      VAL  89  12.664   1.807 -12.349
  690   1HG2  VAL  89          1HG2      VAL  89  12.313   4.186 -14.210
  691   2HG2  VAL  89          2HG2      VAL  89  10.704   4.350 -13.506
  692   3HG2  VAL  89          3HG2      VAL  89  11.420   2.751 -13.706
  693    H    LYS  90           H        LYS  90   8.883   4.355 -12.117
  694    HA   LYS  90           HA       LYS  90   9.049   7.221 -12.515
  695   1HB   LYS  90          2HB       LYS  90   8.171   5.814 -14.309
  696   2HB   LYS  90          1HB       LYS  90   6.895   5.235 -13.248
  697   1HG   LYS  90          2HG       LYS  90   5.917   7.436 -13.149
  698   2HG   LYS  90          1HG       LYS  90   7.247   8.102 -14.097
  699   1HD   LYS  90          2HD       LYS  90   5.571   5.861 -15.170
  700   2HD   LYS  90          1HD       LYS  90   5.021   7.534 -15.288
  701   1HE   LYS  90          2HE       LYS  90   7.577   7.755 -16.176
  702   2HE   LYS  90          1HE       LYS  90   7.162   6.135 -16.736
  703   1HZ   LYS  90          1HZ       LYS  90   6.351   7.295 -18.472
  704   2HZ   LYS  90          2HZ       LYS  90   6.122   8.716 -17.581
  705   3HZ   LYS  90          3HZ       LYS  90   4.992   7.461 -17.478
  706    H    ALA  91           H        ALA  91   7.837   5.121 -10.129
  707    HA   ALA  91           HA       ALA  91   6.025   7.222  -9.137
  708   1HB   ALA  91          1HB       ALA  91   5.233   5.093  -7.723
  709   2HB   ALA  91          2HB       ALA  91   5.827   4.275  -9.168
  710   3HB   ALA  91          3HB       ALA  91   4.568   5.502  -9.304
  711    H    ILE  92           H        ILE  92   8.672   5.072  -8.313
  712    HA   ILE  92           HA       ILE  92   8.645   5.699  -5.527
  713    HB   ILE  92           HB       ILE  92  10.595   4.409  -5.301
  714   1HG1  ILE  92          2HG1      ILE  92  11.023   4.675  -8.285
  715   2HG1  ILE  92          1HG1      ILE  92  11.965   5.483  -7.035
  716   1HG2  ILE  92          1HG2      ILE  92  10.016   2.553  -7.234
  717   2HG2  ILE  92          2HG2      ILE  92   8.507   3.455  -7.098
  718   3HG2  ILE  92          3HG2      ILE  92   9.211   2.696  -5.672
  719   1HD1  ILE  92          1HD1      ILE  92  13.279   3.673  -7.679
  720   2HD1  ILE  92          2HD1      ILE  92  11.899   2.577  -7.748
  721   3HD1  ILE  92          3HD1      ILE  92  12.507   3.134  -6.189
  722    H    LYS  93           H        LYS  93   9.929   7.240  -8.322
  723    HA   LYS  93           HA       LYS  93  11.790   8.852  -6.755
  724   1HB   LYS  93          2HB       LYS  93  11.215   8.783  -9.720
  725   2HB   LYS  93          1HB       LYS  93  12.406   9.830  -8.962
  726   1HG   LYS  93          2HG       LYS  93  13.044   7.297  -8.036
  727   2HG   LYS  93          1HG       LYS  93  12.602   7.049  -9.727
  728   1HD   LYS  93          2HD       LYS  93  14.695   7.679 -10.203
  729   2HD   LYS  93          1HD       LYS  93  14.160   9.316  -9.821
  730   1HE   LYS  93          2HE       LYS  93  14.716   8.492  -7.352
  731   2HE   LYS  93          1HE       LYS  93  15.814   7.431  -8.235
  732   1HZ   LYS  93          1HZ       LYS  93  17.179   9.191  -8.063
  733   2HZ   LYS  93          2HZ       LYS  93  15.923  10.304  -7.850
  734   3HZ   LYS  93          3HZ       LYS  93  16.324   9.767  -9.405
  735    H    LYS  94           H        LYS  94   8.684   8.965  -6.802
  736    HA   LYS  94           HA       LYS  94   8.501  11.873  -7.223
  737   1HB   LYS  94          2HB       LYS  94   6.581   9.676  -7.831
  738   2HB   LYS  94          1HB       LYS  94   5.959  11.267  -7.416
  739   1HG   LYS  94          2HG       LYS  94   8.011  11.611  -9.340
  740   2HG   LYS  94          1HG       LYS  94   6.933  10.337  -9.910
  741   1HD   LYS  94          2HD       LYS  94   5.009  11.841  -9.519
  742   2HD   LYS  94          1HD       LYS  94   6.134  13.118  -9.049
  743   1HE   LYS  94          2HE       LYS  94   5.610  13.540 -11.305
  744   2HE   LYS  94          1HE       LYS  94   7.213  12.805 -11.324
  745   1HZ   LYS  94          1HZ       LYS  94   6.164  11.625 -12.955
  746   2HZ   LYS  94          2HZ       LYS  94   4.646  11.694 -12.211
  747   3HZ   LYS  94          3HZ       LYS  94   5.828  10.633 -11.628
  748    H    GLY  95           H        GLY  95   8.069   9.251  -5.025
  749   1HA   GLY  95          2HA       GLY  95   7.973  10.741  -2.731
  750   2HA   GLY  95          1HA       GLY  95   6.295  10.619  -3.233
  751    H    ALA  96           H        ALA  96   6.899   7.890  -4.403
  752    HA   ALA  96           HA       ALA  96   5.972   6.337  -2.307
  753   1HB   ALA  96          1HB       ALA  96   5.819   4.760  -3.867
  754   2HB   ALA  96          2HB       ALA  96   7.560   4.772  -4.152
  755   3HB   ALA  96          3HB       ALA  96   6.521   5.926  -4.988
  756    H    TYR  97           H        TYR  97   7.220   4.237  -1.641
  757    HA   TYR  97           HA       TYR  97   9.760   5.123  -0.449
  758   1HB   TYR  97          2HB       TYR  97   7.990   4.618   1.155
  759   2HB   TYR  97          1HB       TYR  97   7.807   3.009   0.472
  760    HD1  TYR  97           1HD      TYR  97  10.561   5.145   1.844
  761    HD2  TYR  97           2HD      TYR  97   8.765   1.292   1.664
  762    HE1  TYR  97           1HE      TYR  97  12.245   4.290   3.421
  763    HE2  TYR  97           2HE      TYR  97  10.443   0.428   3.239
  764    HH   TYR  97           HH       TYR  97  12.657   0.946   4.039
  765    H    GLU  98           H        GLU  98   9.365   3.951  -3.112
  766    HA   GLU  98           HA       GLU  98  10.740   2.697  -4.461
  767   1HB   GLU  98          2HB       GLU  98  12.610   1.695  -3.674
  768   2HB   GLU  98          1HB       GLU  98  12.220   2.602  -2.223
  769   1HG   GLU  98          2HG       GLU  98  10.856   0.394  -1.664
  770   2HG   GLU  98          1HG       GLU  98  12.048  -0.310  -2.754
  771    H    PHE  99           H        PHE  99  10.252   0.938  -5.656
  772    HA   PHE  99           HA       PHE  99   7.888  -0.505  -4.991
  773   1HB   PHE  99          2HB       PHE  99   9.573  -0.122  -7.307
  774   2HB   PHE  99          1HB       PHE  99   9.135  -1.815  -7.137
  775    HD1  PHE  99           1HD      PHE  99   7.373  -2.402  -8.470
  776    HD2  PHE  99           2HD      PHE  99   7.366   1.437  -6.634
  777    HE1  PHE  99           1HE      PHE  99   5.183  -1.926  -9.485
  778    HE2  PHE  99           2HE      PHE  99   5.175   1.920  -7.646
  779    HZ   PHE  99           HZ       PHE  99   4.082   0.237  -9.072
  780    H    LEU 100           H        LEU 100   8.199  -1.754  -3.184
  781    HA   LEU 100           HA       LEU 100  10.398  -3.309  -2.546
  782   1HB   LEU 100          2HB       LEU 100   8.686  -2.840  -0.947
  783   2HB   LEU 100          1HB       LEU 100   7.472  -3.639  -1.925
  784    HG   LEU 100           HG       LEU 100   8.449  -5.801  -1.463
  785   1HD1  LEU 100          1HD1      LEU 100  10.595  -6.019  -0.949
  786   2HD1  LEU 100          2HD1      LEU 100  10.305  -5.210   0.591
  787   3HD1  LEU 100          3HD1      LEU 100  10.762  -4.268  -0.828
  788   1HD2  LEU 100          1HD2      LEU 100   8.451  -5.318   1.238
  789   2HD2  LEU 100          2HD2      LEU 100   7.029  -5.630   0.243
  790   3HD2  LEU 100          3HD2      LEU 100   7.514  -3.970   0.595
  791    H    GLU 101           H        GLU 101  10.925  -5.479  -2.842
  792    HA   GLU 101           HA       GLU 101   9.977  -6.616  -5.330
  793   1HB   GLU 101          2HB       GLU 101  12.358  -6.806  -3.714
  794   2HB   GLU 101          1HB       GLU 101  11.760  -8.412  -4.101
  795   1HG   GLU 101          2HG       GLU 101  11.587  -7.391  -6.523
  796   2HG   GLU 101          1HG       GLU 101  12.814  -6.293  -5.891
  797    H    LYS 102           H        LYS 102   9.483  -8.963  -5.455
  798    HA   LYS 102           HA       LYS 102   8.550 -10.339  -3.135
  799   1HB   LYS 102          2HB       LYS 102   6.757  -8.566  -3.648
  800   2HB   LYS 102          1HB       LYS 102   6.382  -9.538  -5.065
  801   1HG   LYS 102          2HG       LYS 102   6.501 -11.004  -2.517
  802   2HG   LYS 102          1HG       LYS 102   5.190  -9.833  -2.672
  803   1HD   LYS 102          2HD       LYS 102   4.900 -10.984  -5.027
  804   2HD   LYS 102          1HD       LYS 102   5.710 -12.326  -4.217
  805   1HE   LYS 102          2HE       LYS 102   4.003 -12.531  -2.617
  806   2HE   LYS 102          1HE       LYS 102   3.334 -10.947  -3.007
  807   1HZ   LYS 102          1HZ       LYS 102   1.880 -12.219  -4.147
  808   2HZ   LYS 102          2HZ       LYS 102   2.961 -13.504  -4.350
  809   3HZ   LYS 102          3HZ       LYS 102   3.068 -12.142  -5.348
  810    HA   PRO 103           HA       PRO 103   9.297 -12.764  -7.098
  811   1HB   PRO 103          2HB       PRO 103  11.759 -13.717  -6.637
  812   2HB   PRO 103          1HB       PRO 103  11.504 -12.107  -7.322
  813   1HG   PRO 103          2HG       PRO 103  12.132 -12.887  -4.501
  814   2HG   PRO 103          1HG       PRO 103  12.800 -11.561  -5.469
  815   1HD   PRO 103          2HD       PRO 103  10.805 -11.243  -3.616
  816   2HD   PRO 103          1HD       PRO 103  11.029 -10.180  -5.019
  817    H    PHE 104           H        PHE 104   8.930 -13.294  -3.844
  818    HA   PHE 104           HA       PHE 104   8.722 -16.193  -4.271
  819   1HB   PHE 104          2HB       PHE 104  10.600 -14.988  -2.607
  820   2HB   PHE 104          1HB       PHE 104   9.329 -15.516  -1.508
  821    HD1  PHE 104           1HD      PHE 104  11.290 -16.799  -4.411
  822    HD2  PHE 104           2HD      PHE 104   9.448 -17.650  -0.671
  823    HE1  PHE 104           1HE      PHE 104  12.175 -19.093  -4.502
  824    HE2  PHE 104           2HE      PHE 104  10.329 -19.945  -0.754
  825    HZ   PHE 104           HZ       PHE 104  11.694 -20.669  -2.671
  826    H    SER 105           H        SER 105   7.973 -13.881  -1.650
  827    HA   SER 105           HA       SER 105   5.145 -14.252  -2.003
  828   1HB   SER 105          2HB       SER 105   5.670 -16.312  -0.798
  829   2HB   SER 105          1HB       SER 105   6.483 -15.386   0.464
  830    HG   SER 105           HG       SER 105   4.611 -15.132   1.356
  831    H    VAL 106           H        VAL 106   4.040 -13.329   0.158
  832    HA   VAL 106           HA       VAL 106   4.855 -10.590   0.276
  833    HB   VAL 106           HB       VAL 106   2.500 -11.175   0.327
  834   1HG1  VAL 106          1HG1      VAL 106   1.806 -12.083   2.758
  835   2HG1  VAL 106          2HG1      VAL 106   3.365 -12.884   2.564
  836   3HG1  VAL 106          3HG1      VAL 106   2.095 -13.129   1.368
  837   1HG2  VAL 106          1HG2      VAL 106   3.404  -9.946   2.930
  838   2HG2  VAL 106          2HG2      VAL 106   1.786  -9.822   2.241
  839   3HG2  VAL 106          3HG2      VAL 106   3.157  -9.096   1.406
  840    H    GLU 107           H        GLU 107   5.671 -13.376   2.103
  841    HA   GLU 107           HA       GLU 107   6.017 -12.530   4.665
  842   1HB   GLU 107          2HB       GLU 107   6.562 -14.791   3.756
  843   2HB   GLU 107          1HB       GLU 107   8.053 -14.123   3.104
  844   1HG   GLU 107          2HG       GLU 107   8.555 -13.402   5.495
  845   2HG   GLU 107          1HG       GLU 107   7.262 -14.508   5.958
  846    H    ARG 108           H        ARG 108   7.960 -11.704   1.855
  847    HA   ARG 108           HA       ARG 108  10.033 -10.384   3.307
  848   1HB   ARG 108          2HB       ARG 108   9.833 -11.253   0.763
  849   2HB   ARG 108          1HB       ARG 108   9.456  -9.554   0.518
  850   1HG   ARG 108          2HG       ARG 108  11.681  -9.501   2.157
  851   2HG   ARG 108          1HG       ARG 108  11.999 -10.837   1.047
  852   1HD   ARG 108          2HD       ARG 108  11.089  -9.014  -0.697
  853   2HD   ARG 108          1HD       ARG 108  11.769  -7.935   0.521
  854    HE   ARG 108           HE       ARG 108  13.211  -9.527  -1.338
  855   1HH1  ARG 108          1HH1      ARG 108  13.330  -8.286   1.922
  856   2HH1  ARG 108          2HH1      ARG 108  15.060  -8.305   1.999
  857   1HH2  ARG 108          1HH2      ARG 108  15.486  -9.554  -1.237
  858   2HH2  ARG 108          2HH2      ARG 108  16.284  -9.026   0.206
  859    H    PHE 109           H        PHE 109   6.987  -9.434   1.857
  860    HA   PHE 109           HA       PHE 109   7.251  -6.657   1.968
  861   1HB   PHE 109          2HB       PHE 109   5.409  -7.551   0.755
  862   2HB   PHE 109          1HB       PHE 109   4.852  -8.479   2.140
  863    HD1  PHE 109           1HD      PHE 109   5.557  -4.903   1.318
  864    HD2  PHE 109           2HD      PHE 109   2.954  -7.719   3.161
  865    HE1  PHE 109           1HE      PHE 109   4.019  -3.081   1.916
  866    HE2  PHE 109           2HE      PHE 109   1.408  -5.902   3.762
  867    HZ   PHE 109           HZ       PHE 109   1.940  -3.579   3.141
  868    H    LEU 110           H        LEU 110   6.559  -9.017   4.430
  869    HA   LEU 110           HA       LEU 110   5.431  -7.534   6.448
  870   1HB   LEU 110          2HB       LEU 110   6.466 -10.039   6.213
  871   2HB   LEU 110          1HB       LEU 110   7.577  -9.302   7.347
  872    HG   LEU 110           HG       LEU 110   4.636  -9.081   7.828
  873   1HD1  LEU 110          1HD1      LEU 110   4.658 -11.167   9.066
  874   2HD1  LEU 110          2HD1      LEU 110   6.331 -11.457   8.586
  875   3HD1  LEU 110          3HD1      LEU 110   5.052 -11.456   7.371
  876   1HD2  LEU 110          1HD2      LEU 110   7.149  -8.705   9.308
  877   2HD2  LEU 110          2HD2      LEU 110   5.851  -9.488  10.207
  878   3HD2  LEU 110          3HD2      LEU 110   5.591  -7.899   9.488
  879    H    LEU 111           H        LEU 111   8.847  -7.788   5.597
  880    HA   LEU 111           HA       LEU 111   9.906  -6.314   7.720
  881   1HB   LEU 111          2HB       LEU 111  10.930  -6.530   4.889
  882   2HB   LEU 111          1HB       LEU 111  11.858  -5.962   6.264
  883    HG   LEU 111           HG       LEU 111  11.018  -8.419   7.139
  884   1HD1  LEU 111          1HD1      LEU 111  11.296  -8.485   4.162
  885   2HD1  LEU 111          2HD1      LEU 111  10.100  -9.271   5.192
  886   3HD1  LEU 111          3HD1      LEU 111  11.754  -9.881   5.137
  887   1HD2  LEU 111          1HD2      LEU 111  13.321  -7.241   7.051
  888   2HD2  LEU 111          2HD2      LEU 111  13.542  -8.149   5.555
  889   3HD2  LEU 111          3HD2      LEU 111  13.258  -9.003   7.073
  890    H    THR 112           H        THR 112   9.305  -5.166   4.392
  891    HA   THR 112           HA       THR 112   9.867  -2.521   4.653
  892    HB   THR 112           HB       THR 112   7.544  -3.724   3.137
  893    HG1  THR 112           1HG      THR 112  10.240  -3.201   2.456
  894   1HG2  THR 112          1HG2      THR 112   8.945  -1.155   2.479
  895   2HG2  THR 112          2HG2      THR 112   7.447  -1.217   3.409
  896   3HG2  THR 112          3HG2      THR 112   7.483  -1.826   1.754
  897    H    ILE 113           H        ILE 113   6.914  -4.128   5.707
  898    HA   ILE 113           HA       ILE 113   5.375  -1.893   6.356
  899    HB   ILE 113           HB       ILE 113   5.468  -4.626   7.636
  900   1HG1  ILE 113          2HG1      ILE 113   4.748  -4.504   5.269
  901   2HG1  ILE 113          1HG1      ILE 113   3.454  -5.037   6.337
  902   1HG2  ILE 113          1HG2      ILE 113   3.925  -2.228   8.380
  903   2HG2  ILE 113          2HG2      ILE 113   4.408  -3.619   9.351
  904   3HG2  ILE 113          3HG2      ILE 113   3.015  -3.736   8.276
  905   1HD1  ILE 113          1HD1      ILE 113   3.086  -2.329   6.270
  906   2HD1  ILE 113          2HD1      ILE 113   2.215  -3.514   5.296
  907   3HD1  ILE 113          3HD1      ILE 113   3.625  -2.690   4.630
  908    H    LYS 114           H        LYS 114   7.025  -3.898   8.793
  909    HA   LYS 114           HA       LYS 114   6.963  -2.044  10.857
  910   1HB   LYS 114          2HB       LYS 114   7.485  -4.321  11.335
  911   2HB   LYS 114          1HB       LYS 114   8.875  -4.301  10.267
  912   1HG   LYS 114          2HG       LYS 114   8.809  -2.471  12.624
  913   2HG   LYS 114          1HG       LYS 114   9.174  -4.179  12.858
  914   1HD   LYS 114          2HD       LYS 114  10.716  -2.129  11.290
  915   2HD   LYS 114          1HD       LYS 114  11.265  -3.133  12.626
  916   1HE   LYS 114          2HE       LYS 114  10.722  -3.940   9.782
  917   2HE   LYS 114          1HE       LYS 114  12.234  -4.047  10.681
  918   1HZ   LYS 114          1HZ       LYS 114  11.642  -6.150  11.051
  919   2HZ   LYS 114          2HZ       LYS 114  10.041  -5.894  10.571
  920   3HZ   LYS 114          3HZ       LYS 114  10.515  -5.543  12.157
  921    H    HIS 115           H        HIS 115   8.925  -2.109   8.046
  922    HA   HIS 115           HA       HIS 115  10.971  -0.359   9.122
  923   1HB   HIS 115          2HB       HIS 115  10.527  -1.772   6.547
  924   2HB   HIS 115          1HB       HIS 115  11.534  -0.328   6.532
  925    HD1  HIS 115           1HD      HIS 115  13.397  -0.498   8.713
  926    HD2  HIS 115           2HD      HIS 115  12.062  -3.962   6.846
  927    HE1  HIS 115           1HE      HIS 115  15.120  -2.253   9.238
  928    HE2  HIS 115           2HE      HIS 115  14.249  -4.360   8.167
  929    H    ALA 116           H        ALA 116   7.985  -0.134   7.402
  930    HA   ALA 116           HA       ALA 116   8.435   2.533   6.405
  931   1HB   ALA 116          1HB       ALA 116   5.705   1.361   6.616
  932   2HB   ALA 116          2HB       ALA 116   6.860   0.632   5.501
  933   3HB   ALA 116          3HB       ALA 116   6.422   2.331   5.328
  934    H    PHE 117           H        PHE 117   6.993   1.054   9.220
  935    HA   PHE 117           HA       PHE 117   5.669   3.440  10.117
  936   1HB   PHE 117          2HB       PHE 117   6.176   0.730  11.309
  937   2HB   PHE 117          1HB       PHE 117   5.540   2.038  12.301
  938    HD1  PHE 117           1HD      PHE 117   3.375   3.132  11.598
  939    HD2  PHE 117           2HD      PHE 117   4.778  -0.513   9.908
  940    HE1  PHE 117           1HE      PHE 117   1.101   2.628  10.808
  941    HE2  PHE 117           2HE      PHE 117   2.508  -1.023   9.117
  942    HZ   PHE 117           HZ       PHE 117   0.664   0.550   9.565
  943    H    GLU 118           H        GLU 118   8.857   2.173  10.351
  944    HA   GLU 118           HA       GLU 118   9.486   3.975  12.583
  945   1HB   GLU 118          2HB       GLU 118  11.102   1.705  11.418
  946   2HB   GLU 118          1HB       GLU 118  11.579   2.696  12.790
  947   1HG   GLU 118          2HG       GLU 118   9.020   1.718  13.387
  948   2HG   GLU 118          1HG       GLU 118   9.927   0.361  12.722
  949    H    GLU 119           H        GLU 119   9.933   3.554   9.196
  950    HA   GLU 119           HA       GLU 119  12.188   5.408   9.130
  951   1HB   GLU 119          2HB       GLU 119  10.846   3.798   6.962
  952   2HB   GLU 119          1HB       GLU 119  12.161   4.927   6.670
  953   1HG   GLU 119          2HG       GLU 119  12.693   2.942   8.758
  954   2HG   GLU 119          1HG       GLU 119  12.466   2.278   7.141
  955    H    TYR 120           H        TYR 120   9.624   6.394   9.988
  956    HA   TYR 120           HA       TYR 120   9.448   8.671   8.263
  957   1HB   TYR 120          2HB       TYR 120   7.891   6.641   7.414
  958   2HB   TYR 120          1HB       TYR 120   6.794   7.392   8.568
  959    HD1  TYR 120           1HD      TYR 120   5.331   8.944   7.698
  960    HD2  TYR 120           2HD      TYR 120   9.142   8.485   5.866
  961    HE1  TYR 120           1HE      TYR 120   4.721  10.634   6.019
  962    HE2  TYR 120           2HE      TYR 120   8.543  10.175   4.183
  963    HH   TYR 120           HH       TYR 120   6.351  11.078   3.179
  964    H    SER 121           H        SER 121  10.087   8.219  10.994
  965    HA   SER 121           HA       SER 121   8.387  10.174  12.201
  966   1HB   SER 121          2HB       SER 121   7.225   7.827  12.434
  967   2HB   SER 121          1HB       SER 121   8.413   7.588  13.714
  968    HG   SER 121           HG       SER 121   7.294   8.868  14.938
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1  -3.282   3.075  15.730
    2   2H    MET   1          2HT       MET   1  -3.221   2.499  17.344
    3   3H    MET   1          3HT       MET   1  -3.001   1.412  16.034
    4    HA   MET   1           HA       MET   1  -1.230   3.700  16.508
    5   1HB   MET   1          2HB       MET   1  -1.555   1.899  18.415
    6   2HB   MET   1          1HB       MET   1  -0.548   0.915  17.362
    7   1HG   MET   1          2HG       MET   1   0.939   1.911  18.854
    8   2HG   MET   1          1HG       MET   1   1.091   2.854  17.372
    9   1HE   MET   1          1HE       MET   1  -0.934   2.364  20.397
   10   2HE   MET   1          2HE       MET   1  -1.920   3.827  20.408
   11   3HE   MET   1          3HE       MET   1  -0.467   3.735  21.404
   12    H    LYS   2           H        LYS   2  -1.448   0.302  15.431
   13    HA   LYS   2           HA       LYS   2   0.280   1.021  13.153
   14   1HB   LYS   2          2HB       LYS   2   0.012  -1.719  14.393
   15   2HB   LYS   2          1HB       LYS   2   1.168  -1.214  13.169
   16   1HG   LYS   2          2HG       LYS   2   1.182   0.220  15.767
   17   2HG   LYS   2          1HG       LYS   2   1.827  -1.422  15.715
   18   1HD   LYS   2          2HD       LYS   2   2.729   0.335  13.537
   19   2HD   LYS   2          1HD       LYS   2   3.258   0.818  15.151
   20   1HE   LYS   2          2HE       LYS   2   3.948  -1.642  15.433
   21   2HE   LYS   2          1HE       LYS   2   3.796  -1.741  13.679
   22   1HZ   LYS   2          1HZ       LYS   2   6.054  -1.254  14.246
   23   2HZ   LYS   2          2HZ       LYS   2   5.595   0.062  15.206
   24   3HZ   LYS   2          3HZ       LYS   2   5.385   0.124  13.529
   25    H    ARG   3           H        ARG   3  -0.871   1.155  11.349
   26    HA   ARG   3           HA       ARG   3  -2.716  -1.006  10.677
   27   1HB   ARG   3          2HB       ARG   3  -3.584   1.836  10.225
   28   2HB   ARG   3          1HB       ARG   3  -4.557   0.372  10.195
   29   1HG   ARG   3          2HG       ARG   3  -5.211   1.215  12.198
   30   2HG   ARG   3          1HG       ARG   3  -3.825   0.263  12.733
   31   1HD   ARG   3          2HD       ARG   3  -2.793   2.085  13.474
   32   2HD   ARG   3          1HD       ARG   3  -2.963   2.872  11.906
   33    HE   ARG   3           HE       ARG   3  -4.591   3.282  14.243
   34   1HH1  ARG   3          1HH1      ARG   3  -4.447   3.545  10.765
   35   2HH1  ARG   3          2HH1      ARG   3  -5.666   4.772  10.683
   36   1HH2  ARG   3          1HH2      ARG   3  -6.194   4.897  14.135
   37   2HH2  ARG   3          2HH2      ARG   3  -6.656   5.540  12.596
   38    H    VAL   4           H        VAL   4  -2.522  -1.616   8.602
   39    HA   VAL   4           HA       VAL   4  -1.139   0.229   6.763
   40    HB   VAL   4           HB       VAL   4  -0.929  -2.784   6.721
   41   1HG1  VAL   4          1HG1      VAL   4   0.860  -0.825   5.322
   42   2HG1  VAL   4          2HG1      VAL   4  -0.637  -1.391   4.583
   43   3HG1  VAL   4          3HG1      VAL   4   0.631  -2.543   5.001
   44   1HG2  VAL   4          1HG2      VAL   4   1.040  -0.738   7.753
   45   2HG2  VAL   4          2HG2      VAL   4   1.359  -2.462   7.570
   46   3HG2  VAL   4          3HG2      VAL   4   0.148  -1.907   8.726
   47    H    LEU   5           H        LEU   5  -1.874   0.350   4.649
   48    HA   LEU   5           HA       LEU   5  -4.505  -0.884   4.190
   49   1HB   LEU   5          2HB       LEU   5  -4.352   1.615   4.217
   50   2HB   LEU   5          1HB       LEU   5  -3.322   1.517   2.801
   51    HG   LEU   5           HG       LEU   5  -5.192   0.412   1.575
   52   1HD1  LEU   5          1HD1      LEU   5  -6.730  -0.518   2.921
   53   2HD1  LEU   5          2HD1      LEU   5  -7.456   1.087   2.888
   54   3HD1  LEU   5          3HD1      LEU   5  -6.421   0.617   4.235
   55   1HD2  LEU   5          1HD2      LEU   5  -6.680   2.555   1.651
   56   2HD2  LEU   5          2HD2      LEU   5  -5.031   2.643   1.033
   57   3HD2  LEU   5          3HD2      LEU   5  -5.388   3.179   2.675
   58    H    VAL   6           H        VAL   6  -4.903  -2.107   2.429
   59    HA   VAL   6           HA       VAL   6  -2.628  -2.603   0.611
   60    HB   VAL   6           HB       VAL   6  -4.826  -4.589   1.131
   61   1HG1  VAL   6          1HG1      VAL   6  -3.677  -5.275  -0.744
   62   2HG1  VAL   6          2HG1      VAL   6  -2.794  -6.110   0.534
   63   3HG1  VAL   6          3HG1      VAL   6  -2.138  -4.631  -0.168
   64   1HG2  VAL   6          1HG2      VAL   6  -3.472  -5.664   2.802
   65   2HG2  VAL   6          2HG2      VAL   6  -3.745  -3.990   3.281
   66   3HG2  VAL   6          3HG2      VAL   6  -2.193  -4.468   2.594
   67    H    VAL   7           H        VAL   7  -2.929  -2.077  -1.455
   68    HA   VAL   7           HA       VAL   7  -5.695  -1.845  -2.453
   69    HB   VAL   7           HB       VAL   7  -3.261  -0.371  -3.481
   70   1HG1  VAL   7          1HG1      VAL   7  -6.107  -0.516  -4.325
   71   2HG1  VAL   7          2HG1      VAL   7  -4.642  -0.388  -5.298
   72   3HG1  VAL   7          3HG1      VAL   7  -5.270   1.030  -4.460
   73   1HG2  VAL   7          1HG2      VAL   7  -5.549   0.877  -1.997
   74   2HG2  VAL   7          2HG2      VAL   7  -3.946   1.535  -2.322
   75   3HG2  VAL   7          3HG2      VAL   7  -4.144   0.235  -1.146
   76    H    ASP   8           H        ASP   8  -6.176  -3.581  -3.653
   77    HA   ASP   8           HA       ASP   8  -4.510  -4.261  -5.905
   78   1HB   ASP   8          2HB       ASP   8  -3.452  -5.536  -4.061
   79   2HB   ASP   8          1HB       ASP   8  -4.991  -6.330  -3.750
   80    H    ASP   9           H        ASP   9  -5.525  -5.886  -7.302
   81    HA   ASP   9           HA       ASP   9  -8.415  -5.595  -7.234
   82   1HB   ASP   9          2HB       ASP   9  -7.033  -5.206  -9.317
   83   2HB   ASP   9          1HB       ASP   9  -6.758  -6.945  -9.368
   84    H    GLU  10           H        GLU  10  -7.723  -7.161  -5.174
   85    HA   GLU  10           HA       GLU  10  -8.234  -9.919  -6.065
   86   1HB   GLU  10          2HB       GLU  10  -6.743  -8.754  -3.766
   87   2HB   GLU  10          1HB       GLU  10  -7.566 -10.286  -3.509
   88   1HG   GLU  10          2HG       GLU  10  -6.034 -10.251  -5.972
   89   2HG   GLU  10          1HG       GLU  10  -5.042  -9.935  -4.550
   90    H    GLU  11           H        GLU  11  -9.307 -11.123  -3.972
   91    HA   GLU  11           HA       GLU  11 -11.661  -9.523  -3.217
   92   1HB   GLU  11          2HB       GLU  11 -11.998 -11.270  -5.091
   93   2HB   GLU  11          1HB       GLU  11 -11.840 -12.465  -3.811
   94   1HG   GLU  11          2HG       GLU  11 -13.675 -10.802  -2.724
   95   2HG   GLU  11          1HG       GLU  11 -14.054 -10.646  -4.439
   96    H    SER  12           H        SER  12 -12.283  -9.646  -1.136
   97    HA   SER  12           HA       SER  12 -12.205 -10.101   1.090
   98   1HB   SER  12          2HB       SER  12 -13.176 -12.233   0.444
   99   2HB   SER  12          1HB       SER  12 -11.580 -12.879   0.064
  100    HG   SER  12           HG       SER  12 -12.248 -11.919   2.639
  101    H    ILE  13           H        ILE  13 -10.225  -8.704   0.987
  102    HA   ILE  13           HA       ILE  13  -8.137  -8.178   1.672
  103    HB   ILE  13           HB       ILE  13  -8.286 -10.852   2.988
  104   1HG1  ILE  13          2HG1      ILE  13 -10.187  -9.355   3.546
  105   2HG1  ILE  13          1HG1      ILE  13  -9.184  -9.758   4.937
  106   1HG2  ILE  13          1HG2      ILE  13  -6.044 -10.203   3.123
  107   2HG2  ILE  13          2HG2      ILE  13  -6.736  -9.725   4.672
  108   3HG2  ILE  13          3HG2      ILE  13  -6.468  -8.516   3.417
  109   1HD1  ILE  13          1HD1      ILE  13  -8.015  -7.566   4.593
  110   2HD1  ILE  13          2HD1      ILE  13  -9.703  -7.460   5.090
  111   3HD1  ILE  13          3HD1      ILE  13  -9.261  -7.176   3.407
  112    H    THR  14           H        THR  14  -5.835  -8.889   1.591
  113    HA   THR  14           HA       THR  14  -5.372 -10.383  -0.861
  114    HB   THR  14           HB       THR  14  -3.049  -9.520  -0.660
  115    HG1  THR  14           1HG      THR  14  -4.021  -8.072   1.570
  116   1HG2  THR  14          1HG2      THR  14  -3.491  -7.444  -1.450
  117   2HG2  THR  14          2HG2      THR  14  -4.692  -7.101  -0.206
  118   3HG2  THR  14          3HG2      THR  14  -5.108  -8.135  -1.572
  119    H    SER  15           H        SER  15  -5.051 -12.497  -0.721
  120    HA   SER  15           HA       SER  15  -4.782 -14.060   1.468
  121   1HB   SER  15          2HB       SER  15  -3.553 -14.492  -1.259
  122   2HB   SER  15          1HB       SER  15  -3.656 -15.743  -0.020
  123    HG   SER  15           HG       SER  15  -5.809 -14.377  -1.268
  124    H    SER  16           H        SER  16  -3.258 -14.719   2.860
  125    HA   SER  16           HA       SER  16  -1.179 -15.112   3.763
  126   1HB   SER  16          2HB       SER  16   0.152 -13.278   1.792
  127   2HB   SER  16          1HB       SER  16   0.824 -14.666   2.649
  128    HG   SER  16           HG       SER  16  -0.469 -14.565   0.261
  129    H    LEU  17           H        LEU  17  -2.057 -11.833   2.766
  130    HA   LEU  17           HA       LEU  17  -0.455 -10.499   4.667
  131   1HB   LEU  17          2HB       LEU  17  -2.372  -9.806   2.674
  132   2HB   LEU  17          1HB       LEU  17  -2.835  -9.003   4.156
  133    HG   LEU  17           HG       LEU  17  -0.806  -8.286   2.256
  134   1HD1  LEU  17          1HD1      LEU  17  -1.415  -6.258   2.909
  135   2HD1  LEU  17          2HD1      LEU  17  -1.051  -6.598   4.600
  136   3HD1  LEU  17          3HD1      LEU  17  -2.615  -7.057   3.926
  137   1HD2  LEU  17          1HD2      LEU  17   1.011  -7.716   3.804
  138   2HD2  LEU  17          2HD2      LEU  17   0.786  -9.458   3.658
  139   3HD2  LEU  17          3HD2      LEU  17   0.191  -8.610   5.083
  140    H    SER  18           H        SER  18  -3.900 -11.378   4.717
  141    HA   SER  18           HA       SER  18  -4.660 -10.359   7.139
  142   1HB   SER  18          2HB       SER  18  -5.887 -11.912   5.325
  143   2HB   SER  18          1HB       SER  18  -5.598 -13.121   6.576
  144    HG   SER  18           HG       SER  18  -6.561 -11.457   8.030
  145    H    ALA  19           H        ALA  19  -3.604 -13.749   6.741
  146    HA   ALA  19           HA       ALA  19  -3.408 -14.414   9.408
  147   1HB   ALA  19          1HB       ALA  19  -3.237 -16.091   7.699
  148   2HB   ALA  19          2HB       ALA  19  -1.779 -16.147   8.689
  149   3HB   ALA  19          3HB       ALA  19  -1.736 -15.387   7.098
  150    H    ILE  20           H        ILE  20  -0.980 -12.864   7.359
  151    HA   ILE  20           HA       ILE  20   1.118 -12.889   9.251
  152    HB   ILE  20           HB       ILE  20   0.604 -11.137   6.850
  153   1HG1  ILE  20          2HG1      ILE  20   2.677 -13.285   7.257
  154   2HG1  ILE  20          1HG1      ILE  20   1.086 -13.603   6.576
  155   1HG2  ILE  20          1HG2      ILE  20   2.821 -11.058   8.840
  156   2HG2  ILE  20          2HG2      ILE  20   2.002  -9.733   8.012
  157   3HG2  ILE  20          3HG2      ILE  20   3.170 -10.728   7.143
  158   1HD1  ILE  20          1HD1      ILE  20   3.252 -13.050   5.107
  159   2HD1  ILE  20          2HD1      ILE  20   2.608 -11.423   5.326
  160   3HD1  ILE  20          3HD1      ILE  20   1.607 -12.676   4.595
  161    H    LEU  21           H        LEU  21  -0.628  -9.988   8.119
  162    HA   LEU  21           HA       LEU  21   0.113  -8.254  10.099
  163   1HB   LEU  21          2HB       LEU  21  -2.631  -8.402   8.864
  164   2HB   LEU  21          1HB       LEU  21  -1.891  -6.988   9.595
  165    HG   LEU  21           HG       LEU  21  -0.251  -8.113   7.472
  166   1HD1  LEU  21          1HD1      LEU  21  -1.687  -8.354   5.813
  167   2HD1  LEU  21          2HD1      LEU  21  -2.384  -6.764   6.121
  168   3HD1  LEU  21          3HD1      LEU  21  -3.006  -8.180   6.969
  169   1HD2  LEU  21          1HD2      LEU  21  -0.515  -5.729   8.736
  170   2HD2  LEU  21          2HD2      LEU  21  -1.372  -5.416   7.225
  171   3HD2  LEU  21          3HD2      LEU  21   0.305  -5.962   7.192
  172    H    GLU  22           H        GLU  22  -2.261 -10.810  10.275
  173    HA   GLU  22           HA       GLU  22  -3.473  -9.972  12.712
  174   1HB   GLU  22          2HB       GLU  22  -3.424 -12.590  11.235
  175   2HB   GLU  22          1HB       GLU  22  -4.258 -12.396  12.771
  176   1HG   GLU  22          2HG       GLU  22  -5.818 -10.911  11.871
  177   2HG   GLU  22          1HG       GLU  22  -4.829 -10.598  10.445
  178    H    GLU  23           H        GLU  23  -0.689 -11.919  11.883
  179    HA   GLU  23           HA       GLU  23  -0.327 -12.893  14.579
  180   1HB   GLU  23          2HB       GLU  23   0.395 -14.399  12.918
  181   2HB   GLU  23          1HB       GLU  23   1.217 -13.141  12.009
  182   1HG   GLU  23          2HG       GLU  23   3.105 -13.358  13.176
  183   2HG   GLU  23          1HG       GLU  23   2.255 -13.530  14.711
  184    H    GLU  24           H        GLU  24   0.949 -10.375  12.500
  185    HA   GLU  24           HA       GLU  24   3.064  -9.610  14.269
  186   1HB   GLU  24          2HB       GLU  24   1.814  -8.005  12.034
  187   2HB   GLU  24          1HB       GLU  24   3.383  -7.727  12.775
  188   1HG   GLU  24          2HG       GLU  24   2.601 -10.153  11.174
  189   2HG   GLU  24          1HG       GLU  24   3.583  -8.806  10.599
  190    H    GLY  25           H        GLY  25  -0.287  -8.729  13.859
  191   1HA   GLY  25          2HA       GLY  25  -1.609  -7.723  15.519
  192   2HA   GLY  25          1HA       GLY  25  -0.144  -7.165  16.313
  193    H    TYR  26           H        TYR  26  -1.919  -6.709  13.263
  194    HA   TYR  26           HA       TYR  26  -1.458  -3.812  13.529
  195   1HB   TYR  26          2HB       TYR  26  -1.054  -5.562  11.116
  196   2HB   TYR  26          1HB       TYR  26  -1.385  -3.848  10.945
  197    HD1  TYR  26           1HD      TYR  26   0.334  -2.278  11.122
  198    HD2  TYR  26           2HD      TYR  26   0.997  -6.257  12.468
  199    HE1  TYR  26           1HE      TYR  26   2.725  -1.782  11.387
  200    HE2  TYR  26           2HE      TYR  26   3.392  -5.773  12.734
  201    HH   TYR  26           HH       TYR  26   5.062  -4.220  11.919
  202    H    HIS  27           H        HIS  27  -2.823  -2.780  11.578
  203    HA   HIS  27           HA       HIS  27  -5.536  -3.916  11.705
  204   1HB   HIS  27          2HB       HIS  27  -4.738  -1.504  12.838
  205   2HB   HIS  27          1HB       HIS  27  -5.443  -1.019  11.300
  206    HD1  HIS  27           1HD      HIS  27  -6.756  -3.923  13.294
  207    HD2  HIS  27           2HD      HIS  27  -7.770   0.005  12.396
  208    HE1  HIS  27           1HE      HIS  27  -9.106  -3.625  14.140
  209    HE2  HIS  27           2HE      HIS  27  -9.730  -1.269  13.504
  210    HA   PRO  28           HA       PRO  28  -4.230  -3.470   7.337
  211   1HB   PRO  28          2HB       PRO  28  -4.851  -5.947   6.526
  212   2HB   PRO  28          1HB       PRO  28  -3.358  -5.598   7.406
  213   1HG   PRO  28          2HG       PRO  28  -5.904  -6.805   8.392
  214   2HG   PRO  28          1HG       PRO  28  -4.231  -7.212   8.812
  215   1HD   PRO  28          2HD       PRO  28  -5.919  -5.629  10.338
  216   2HD   PRO  28          1HD       PRO  28  -4.150  -5.630  10.452
  217    H    ASP  29           H        ASP  29  -5.429  -2.895   5.644
  218    HA   ASP  29           HA       ASP  29  -8.245  -3.672   5.510
  219   1HB   ASP  29          2HB       ASP  29  -8.224  -1.472   6.602
  220   2HB   ASP  29          1HB       ASP  29  -7.238  -0.822   5.295
  221    H    THR  30           H        THR  30  -8.900  -4.077   3.428
  222    HA   THR  30           HA       THR  30  -6.947  -3.425   1.326
  223    HB   THR  30           HB       THR  30  -7.323  -5.521   0.280
  224    HG1  THR  30           1HG      THR  30  -9.503  -5.730   2.059
  225   1HG2  THR  30          1HG2      THR  30  -6.507  -7.061   1.798
  226   2HG2  THR  30          2HG2      THR  30  -7.380  -6.341   3.150
  227   3HG2  THR  30          3HG2      THR  30  -5.980  -5.517   2.467
  228    H    ALA  31           H        ALA  31  -7.648  -2.443  -0.443
  229    HA   ALA  31           HA       ALA  31 -10.501  -1.836  -0.631
  230   1HB   ALA  31          1HB       ALA  31  -8.905   0.040  -0.610
  231   2HB   ALA  31          2HB       ALA  31  -9.839  -0.019  -2.105
  232   3HB   ALA  31          3HB       ALA  31  -8.168  -0.585  -2.084
  233    H    LYS  32           H        LYS  32  -9.199  -1.299  -3.626
  234    HA   LYS  32           HA       LYS  32  -9.346  -3.973  -4.669
  235   1HB   LYS  32          2HB       LYS  32 -11.414  -2.009  -5.657
  236   2HB   LYS  32          1HB       LYS  32 -11.273  -3.717  -6.053
  237   1HG   LYS  32          2HG       LYS  32 -11.843  -4.279  -3.726
  238   2HG   LYS  32          1HG       LYS  32 -12.047  -2.560  -3.383
  239   1HD   LYS  32          2HD       LYS  32 -14.024  -2.437  -4.490
  240   2HD   LYS  32          1HD       LYS  32 -13.542  -3.629  -5.698
  241   1HE   LYS  32          2HE       LYS  32 -15.048  -4.908  -4.593
  242   2HE   LYS  32          1HE       LYS  32 -13.660  -5.219  -3.550
  243   1HZ   LYS  32          1HZ       LYS  32 -16.083  -3.730  -3.009
  244   2HZ   LYS  32          2HZ       LYS  32 -14.664  -2.997  -2.451
  245   3HZ   LYS  32          3HZ       LYS  32 -15.063  -4.562  -1.947
  246    H    THR  33           H        THR  33  -9.339  -0.511  -5.337
  247    HA   THR  33           HA       THR  33  -7.144  -0.852  -7.188
  248    HB   THR  33           HB       THR  33  -8.239   0.375  -9.012
  249    HG1  THR  33           1HG      THR  33  -9.816   1.546  -8.106
  250   1HG2  THR  33          1HG2      THR  33  -9.875  -2.011  -8.188
  251   2HG2  THR  33          2HG2      THR  33  -8.372  -2.055  -9.110
  252   3HG2  THR  33          3HG2      THR  33  -9.808  -1.297  -9.801
  253    H    LEU  34           H        LEU  34  -6.581   1.475  -8.081
  254    HA   LEU  34           HA       LEU  34  -5.910   3.047  -5.874
  255   1HB   LEU  34          2HB       LEU  34  -6.059   3.751  -8.804
  256   2HB   LEU  34          1HB       LEU  34  -5.380   4.815  -7.586
  257    HG   LEU  34           HG       LEU  34  -4.327   2.028  -7.984
  258   1HD1  LEU  34          1HD1      LEU  34  -2.675   2.859  -9.502
  259   2HD1  LEU  34          2HD1      LEU  34  -3.291   4.505  -9.349
  260   3HD1  LEU  34          3HD1      LEU  34  -4.267   3.268 -10.140
  261   1HD2  LEU  34          1HD2      LEU  34  -3.269   2.694  -6.119
  262   2HD2  LEU  34          2HD2      LEU  34  -3.619   4.398  -6.406
  263   3HD2  LEU  34          3HD2      LEU  34  -2.265   3.625  -7.230
  264    H    ARG  35           H        ARG  35  -8.649   3.229  -8.075
  265    HA   ARG  35           HA       ARG  35  -9.648   5.713  -7.131
  266   1HB   ARG  35          2HB       ARG  35 -10.533   3.583  -8.926
  267   2HB   ARG  35          1HB       ARG  35 -11.859   4.298  -8.019
  268   1HG   ARG  35          2HG       ARG  35 -11.575   6.374  -8.979
  269   2HG   ARG  35          1HG       ARG  35  -9.892   6.060  -9.406
  270   1HD   ARG  35          2HD       ARG  35 -11.019   5.966 -11.446
  271   2HD   ARG  35          1HD       ARG  35 -10.825   4.275 -10.989
  272    HE   ARG  35           HE       ARG  35 -13.308   5.806 -11.035
  273   1HH1  ARG  35          1HH1      ARG  35 -11.687   2.797 -10.299
  274   2HH1  ARG  35          2HH1      ARG  35 -13.154   1.880 -10.255
  275   1HH2  ARG  35          1HH2      ARG  35 -15.230   4.594 -10.973
  276   2HH2  ARG  35          2HH2      ARG  35 -15.162   2.897 -10.636
  277    H    GLU  36           H        GLU  36 -10.321   2.334  -6.326
  278    HA   GLU  36           HA       GLU  36 -12.322   2.836  -4.404
  279   1HB   GLU  36          2HB       GLU  36 -11.028   0.573  -5.498
  280   2HB   GLU  36          1HB       GLU  36 -10.819   0.470  -3.756
  281   1HG   GLU  36          2HG       GLU  36 -12.798  -0.615  -3.963
  282   2HG   GLU  36          1HG       GLU  36 -13.393   1.032  -3.761
  283    H    ALA  37           H        ALA  37  -8.808   2.685  -4.236
  284    HA   ALA  37           HA       ALA  37  -8.574   2.658  -1.421
  285   1HB   ALA  37          1HB       ALA  37  -6.489   4.088  -2.948
  286   2HB   ALA  37          2HB       ALA  37  -6.804   2.424  -3.440
  287   3HB   ALA  37          3HB       ALA  37  -6.342   2.779  -1.775
  288    H    GLU  38           H        GLU  38  -8.418   5.364  -3.749
  289    HA   GLU  38           HA       GLU  38  -8.068   7.448  -1.994
  290   1HB   GLU  38          2HB       GLU  38  -9.730   7.341  -4.509
  291   2HB   GLU  38          1HB       GLU  38  -9.370   8.831  -3.650
  292   1HG   GLU  38          2HG       GLU  38  -6.915   8.183  -3.935
  293   2HG   GLU  38          1HG       GLU  38  -7.499   7.020  -5.125
  294    H    LYS  39           H        LYS  39 -11.102   5.865  -2.908
  295    HA   LYS  39           HA       LYS  39 -12.863   7.509  -1.503
  296   1HB   LYS  39          2HB       LYS  39 -13.621   5.796  -3.079
  297   2HB   LYS  39          1HB       LYS  39 -13.048   4.531  -2.001
  298   1HG   LYS  39          2HG       LYS  39 -15.002   6.477  -0.915
  299   2HG   LYS  39          1HG       LYS  39 -15.583   5.283  -2.077
  300   1HD   LYS  39          2HD       LYS  39 -14.376   3.560  -0.600
  301   2HD   LYS  39          1HD       LYS  39 -14.336   4.838   0.617
  302   1HE   LYS  39          2HE       LYS  39 -16.626   4.849   0.876
  303   2HE   LYS  39          1HE       LYS  39 -16.915   4.184  -0.730
  304   1HZ   LYS  39          1HZ       LYS  39 -15.784   2.678   1.566
  305   2HZ   LYS  39          2HZ       LYS  39 -16.117   2.047   0.033
  306   3HZ   LYS  39          3HZ       LYS  39 -17.383   2.577   1.024
  307    H    LYS  40           H        LYS  40 -11.067   4.644  -0.451
  308    HA   LYS  40           HA       LYS  40 -12.088   4.683   2.211
  309   1HB   LYS  40          2HB       LYS  40  -9.898   3.227   0.796
  310   2HB   LYS  40          1HB       LYS  40  -9.984   3.172   2.550
  311   1HG   LYS  40          2HG       LYS  40 -12.576   2.638   1.529
  312   2HG   LYS  40          1HG       LYS  40 -11.420   1.632   0.654
  313   1HD   LYS  40          2HD       LYS  40 -10.702   0.558   2.590
  314   2HD   LYS  40          1HD       LYS  40 -11.309   1.840   3.642
  315   1HE   LYS  40          2HE       LYS  40 -13.625   1.100   2.611
  316   2HE   LYS  40          1HE       LYS  40 -12.761  -0.413   2.345
  317   1HZ   LYS  40          1HZ       LYS  40 -14.023  -0.115   4.527
  318   2HZ   LYS  40          2HZ       LYS  40 -12.753   0.902   4.990
  319   3HZ   LYS  40          3HZ       LYS  40 -12.445  -0.719   4.612
  320    H    ILE  41           H        ILE  41  -9.075   5.756   0.703
  321    HA   ILE  41           HA       ILE  41  -7.869   6.652   3.115
  322    HB   ILE  41           HB       ILE  41  -7.233   7.560   0.311
  323   1HG1  ILE  41          2HG1      ILE  41  -5.805   5.359   1.781
  324   2HG1  ILE  41          1HG1      ILE  41  -7.245   5.011   0.831
  325   1HG2  ILE  41          1HG2      ILE  41  -5.695   7.623   2.896
  326   2HG2  ILE  41          2HG2      ILE  41  -6.174   8.985   1.883
  327   3HG2  ILE  41          3HG2      ILE  41  -4.943   7.855   1.318
  328   1HD1  ILE  41          1HD1      ILE  41  -6.037   6.168  -1.093
  329   2HD1  ILE  41          2HD1      ILE  41  -5.464   4.575  -0.602
  330   3HD1  ILE  41          3HD1      ILE  41  -4.586   6.021  -0.101
  331    H    LYS  42           H        LYS  42 -10.283   8.005   1.097
  332    HA   LYS  42           HA       LYS  42  -9.828  10.736   1.369
  333   1HB   LYS  42          2HB       LYS  42 -11.622   9.424   0.016
  334   2HB   LYS  42          1HB       LYS  42 -12.599   9.624   1.463
  335   1HG   LYS  42          2HG       LYS  42 -11.373  12.113   0.677
  336   2HG   LYS  42          1HG       LYS  42 -12.322  11.417  -0.636
  337   1HD   LYS  42          2HD       LYS  42 -13.547  11.412   2.062
  338   2HD   LYS  42          1HD       LYS  42 -13.390  12.974   1.254
  339   1HE   LYS  42          2HE       LYS  42 -14.483  10.691  -0.305
  340   2HE   LYS  42          1HE       LYS  42 -15.516  11.427   0.920
  341   1HZ   LYS  42          1HZ       LYS  42 -15.350  12.309  -1.578
  342   2HZ   LYS  42          2HZ       LYS  42 -14.151  13.268  -0.867
  343   3HZ   LYS  42          3HZ       LYS  42 -15.734  13.309  -0.270
  344    H    GLU  43           H        GLU  43 -10.812   8.425   3.719
  345    HA   GLU  43           HA       GLU  43 -11.315  10.604   5.625
  346   1HB   GLU  43          2HB       GLU  43 -12.598   7.874   5.740
  347   2HB   GLU  43          1HB       GLU  43 -12.961   9.266   6.752
  348   1HG   GLU  43          2HG       GLU  43 -14.293  10.211   5.211
  349   2HG   GLU  43          1HG       GLU  43 -13.280   9.694   3.863
  350    H    LEU  44           H        LEU  44 -10.679   7.092   5.665
  351    HA   LEU  44           HA       LEU  44  -9.416   7.005   8.136
  352   1HB   LEU  44          2HB       LEU  44  -9.736   5.249   5.857
  353   2HB   LEU  44          1HB       LEU  44  -8.156   5.048   6.589
  354    HG   LEU  44           HG       LEU  44  -9.786   3.464   7.500
  355   1HD1  LEU  44          1HD1      LEU  44  -8.930   3.570   9.582
  356   2HD1  LEU  44          2HD1      LEU  44  -9.390   5.258   9.804
  357   3HD1  LEU  44          3HD1      LEU  44  -7.943   4.852   8.881
  358   1HD2  LEU  44          1HD2      LEU  44 -11.667   4.197   8.814
  359   2HD2  LEU  44          2HD2      LEU  44 -11.777   4.905   7.202
  360   3HD2  LEU  44          3HD2      LEU  44 -11.231   5.888   8.561
  361    H    PHE  45           H        PHE  45  -7.439   7.494   8.876
  362    HA   PHE  45           HA       PHE  45  -5.545   8.680   6.987
  363   1HB   PHE  45          2HB       PHE  45  -6.256   9.961   9.017
  364   2HB   PHE  45          1HB       PHE  45  -5.472   8.736  10.010
  365    HD1  PHE  45           1HD      PHE  45  -4.876  11.345   7.464
  366    HD2  PHE  45           2HD      PHE  45  -3.147   8.771  10.378
  367    HE1  PHE  45           1HE      PHE  45  -2.746  12.560   7.266
  368    HE2  PHE  45           2HE      PHE  45  -1.013   9.981  10.187
  369    HZ   PHE  45           HZ       PHE  45  -0.810  11.878   8.628
  370    H    PHE  46           H        PHE  46  -5.378   6.189   6.437
  371    HA   PHE  46           HA       PHE  46  -3.934   4.446   8.064
  372   1HB   PHE  46          2HB       PHE  46  -4.192   4.686   5.076
  373   2HB   PHE  46          1HB       PHE  46  -3.206   3.431   5.813
  374    HD1  PHE  46           1HD      PHE  46  -6.328   4.140   4.501
  375    HD2  PHE  46           2HD      PHE  46  -4.491   2.103   7.754
  376    HE1  PHE  46           1HE      PHE  46  -8.323   2.720   4.731
  377    HE2  PHE  46           2HE      PHE  46  -6.482   0.676   7.988
  378    HZ   PHE  46           HZ       PHE  46  -8.402   0.985   6.478
  379    HA   PRO  47           HA       PRO  47   0.053   6.493   8.014
  380   1HB   PRO  47          2HB       PRO  47   1.453   4.559   9.309
  381   2HB   PRO  47          1HB       PRO  47   0.372   5.680  10.144
  382   1HG   PRO  47          2HG       PRO  47  -0.101   2.856   9.308
  383   2HG   PRO  47          1HG       PRO  47  -0.570   3.672  10.808
  384   1HD   PRO  47          2HD       PRO  47  -2.302   3.226   8.754
  385   2HD   PRO  47          1HD       PRO  47  -2.445   4.603   9.862
  386    H    VAL  48           H        VAL  48  -0.534   3.219   6.918
  387    HA   VAL  48           HA       VAL  48   1.660   3.522   4.988
  388    HB   VAL  48           HB       VAL  48   0.858   0.903   6.242
  389   1HG1  VAL  48          1HG1      VAL  48   3.084   1.773   4.421
  390   2HG1  VAL  48          2HG1      VAL  48   1.897   0.491   4.174
  391   3HG1  VAL  48          3HG1      VAL  48   3.175   0.290   5.373
  392   1HG2  VAL  48          1HG2      VAL  48   1.723   2.135   8.034
  393   2HG2  VAL  48          2HG2      VAL  48   2.958   2.894   7.028
  394   3HG2  VAL  48          3HG2      VAL  48   3.088   1.185   7.444
  395    H    ILE  49           H        ILE  49   1.221   3.015   2.929
  396    HA   ILE  49           HA       ILE  49  -1.310   1.666   2.277
  397    HB   ILE  49           HB       ILE  49  -0.351   4.036   0.694
  398   1HG1  ILE  49          2HG1      ILE  49  -0.827   4.675   3.095
  399   2HG1  ILE  49          1HG1      ILE  49  -1.801   5.504   1.885
  400   1HG2  ILE  49          1HG2      ILE  49  -3.046   2.707   0.913
  401   2HG2  ILE  49          2HG2      ILE  49  -1.887   2.487  -0.398
  402   3HG2  ILE  49          3HG2      ILE  49  -2.636   4.063  -0.138
  403   1HD1  ILE  49          1HD1      ILE  49  -2.595   3.610   3.988
  404   2HD1  ILE  49          2HD1      ILE  49  -3.425   3.445   2.442
  405   3HD1  ILE  49          3HD1      ILE  49  -3.462   4.982   3.301
  406    H    VAL  50           H        VAL  50  -0.484  -0.218   1.371
  407    HA   VAL  50           HA       VAL  50   1.723   0.054  -0.529
  408    HB   VAL  50           HB       VAL  50   0.544  -2.425   0.741
  409   1HG1  VAL  50          1HG1      VAL  50   3.245  -2.572  -0.361
  410   2HG1  VAL  50          2HG1      VAL  50   1.999  -2.282  -1.575
  411   3HG1  VAL  50          3HG1      VAL  50   1.891  -3.690  -0.519
  412   1HG2  VAL  50          1HG2      VAL  50   3.151  -2.104   1.628
  413   2HG2  VAL  50          2HG2      VAL  50   1.680  -1.805   2.552
  414   3HG2  VAL  50          3HG2      VAL  50   2.468  -0.481   1.695
  415    H    LEU  51           H        LEU  51   1.412  -0.214  -2.654
  416    HA   LEU  51           HA       LEU  51  -1.275  -0.862  -3.588
  417   1HB   LEU  51          2HB       LEU  51  -0.031   1.135  -4.449
  418   2HB   LEU  51          1HB       LEU  51   1.114   0.037  -5.195
  419    HG   LEU  51           HG       LEU  51  -0.652  -0.875  -6.623
  420   1HD1  LEU  51          1HD1      LEU  51  -2.690  -0.769  -5.642
  421   2HD1  LEU  51          2HD1      LEU  51  -2.787   0.736  -6.556
  422   3HD1  LEU  51          3HD1      LEU  51  -2.352   0.768  -4.847
  423   1HD2  LEU  51          1HD2      LEU  51  -0.061   2.043  -6.594
  424   2HD2  LEU  51          2HD2      LEU  51  -1.248   1.427  -7.744
  425   3HD2  LEU  51          3HD2      LEU  51   0.402   0.807  -7.763
  426    H    ASP  52           H        ASP  52  -1.490  -2.294  -5.496
  427    HA   ASP  52           HA       ASP  52   0.575  -4.278  -5.890
  428   1HB   ASP  52          2HB       ASP  52  -1.240  -4.753  -3.877
  429   2HB   ASP  52          1HB       ASP  52  -1.970  -5.578  -5.248
  430    H    VAL  53           H        VAL  53   0.216  -2.997  -7.928
  431    HA   VAL  53           HA       VAL  53  -2.114  -3.224  -9.462
  432    HB   VAL  53           HB       VAL  53  -0.511  -1.608 -10.155
  433   1HG1  VAL  53          1HG1      VAL  53   1.738  -2.082 -10.823
  434   2HG1  VAL  53          2HG1      VAL  53   1.474  -3.816 -10.644
  435   3HG1  VAL  53          3HG1      VAL  53   1.475  -2.772  -9.225
  436   1HG2  VAL  53          1HG2      VAL  53  -0.453  -1.955 -12.444
  437   2HG2  VAL  53          2HG2      VAL  53  -1.760  -3.017 -11.921
  438   3HG2  VAL  53          3HG2      VAL  53  -0.169  -3.688 -12.275
  439    H    TRP  54           H        TRP  54  -2.772  -5.421  -9.094
  440    HA   TRP  54           HA       TRP  54  -1.174  -7.545 -10.254
  441   1HB   TRP  54          2HB       TRP  54  -2.309  -8.073  -8.206
  442   2HB   TRP  54          1HB       TRP  54  -3.850  -7.515  -8.845
  443    HD1  TRP  54           HD       TRP  54  -5.392  -9.375  -9.689
  444    HE1  TRP  54           1HE      TRP  54  -5.095 -11.824 -10.426
  445    HE3  TRP  54           3HE      TRP  54  -0.300  -9.685  -9.437
  446    HZ2  TRP  54           2HZ      TRP  54  -2.979 -13.648 -10.844
  447    HZ3  TRP  54           3HZ      TRP  54   0.785 -11.816 -10.020
  448    HH2  TRP  54           HH       TRP  54  -0.529 -13.755 -10.709
  449    H    MET  55           H        MET  55  -4.659  -7.493 -10.614
  450    HA   MET  55           HA       MET  55  -4.556  -8.278 -13.315
  451   1HB   MET  55          2HB       MET  55  -6.689  -7.458 -11.413
  452   2HB   MET  55          1HB       MET  55  -7.078  -7.423 -13.127
  453   1HG   MET  55          2HG       MET  55  -5.938  -9.856 -12.943
  454   2HG   MET  55          1HG       MET  55  -6.628  -9.704 -11.328
  455   1HE   MET  55          1HE       MET  55  -9.147 -12.019 -13.215
  456   2HE   MET  55          2HE       MET  55  -7.680 -11.960 -12.238
  457   3HE   MET  55          3HE       MET  55  -7.575 -11.833 -13.994
  458    HA   PRO  56           HA       PRO  56  -5.897  -3.712 -14.313
  459   1HB   PRO  56          2HB       PRO  56  -5.268  -1.848 -12.424
  460   2HB   PRO  56          1HB       PRO  56  -6.840  -2.652 -12.512
  461   1HG   PRO  56          2HG       PRO  56  -4.489  -3.277 -10.764
  462   2HG   PRO  56          1HG       PRO  56  -6.211  -3.201 -10.338
  463   1HD   PRO  56          2HD       PRO  56  -4.965  -5.538 -10.767
  464   2HD   PRO  56          1HD       PRO  56  -6.655  -5.286 -11.246
  465    H    ASP  57           H        ASP  57  -4.493  -1.457 -14.265
  466    HA   ASP  57           HA       ASP  57  -1.704  -2.315 -14.680
  467   1HB   ASP  57          2HB       ASP  57  -3.233  -0.172 -16.169
  468   2HB   ASP  57          1HB       ASP  57  -1.557  -0.628 -16.455
  469    H    GLY  58           H        GLY  58  -3.814  -0.002 -13.192
  470   1HA   GLY  58          2HA       GLY  58  -3.409   1.696 -11.705
  471   2HA   GLY  58          1HA       GLY  58  -1.846   0.941 -11.430
  472    H    ASP  59           H        ASP  59  -0.041   1.631 -12.631
  473    HA   ASP  59           HA       ASP  59   1.307   3.282 -13.448
  474   1HB   ASP  59          2HB       ASP  59  -0.184   2.355 -15.463
  475   2HB   ASP  59          1HB       ASP  59  -0.739   4.027 -15.478
  476    H    GLY  60           H        GLY  60  -0.574   4.079 -11.374
  477   1HA   GLY  60          2HA       GLY  60  -1.424   6.761 -12.089
  478   2HA   GLY  60          1HA       GLY  60  -1.657   5.971 -10.538
  479    H    VAL  61           H        VAL  61   0.888   7.372 -12.594
  480    HA   VAL  61           HA       VAL  61   2.860   7.610 -10.645
  481    HB   VAL  61           HB       VAL  61   2.352   9.436 -12.999
  482   1HG1  VAL  61          1HG1      VAL  61   4.670   9.072 -11.151
  483   2HG1  VAL  61          2HG1      VAL  61   3.904  10.562 -11.703
  484   3HG1  VAL  61          3HG1      VAL  61   4.916   9.628 -12.807
  485   1HG2  VAL  61          1HG2      VAL  61   4.299   7.160 -12.949
  486   2HG2  VAL  61          2HG2      VAL  61   3.603   7.999 -14.335
  487   3HG2  VAL  61          3HG2      VAL  61   2.610   6.896 -13.381
  488    H    ASN  62           H        ASN  62   0.203   9.773 -11.513
  489    HA   ASN  62           HA       ASN  62   0.982  11.867  -9.772
  490   1HB   ASN  62          2HB       ASN  62  -1.272  12.719 -10.342
  491   2HB   ASN  62          1HB       ASN  62  -0.316  12.315 -11.752
  492   1HD2  ASN  62          1HD2      ASN  62  -1.037  10.799 -13.133
  493   2HD2  ASN  62          2HD2      ASN  62  -2.525   9.942 -12.950
  494    H    PHE  63           H        PHE  63  -0.467   8.844  -9.241
  495    HA   PHE  63           HA       PHE  63  -2.313   9.472  -7.209
  496   1HB   PHE  63          2HB       PHE  63  -2.263   7.287  -8.358
  497   2HB   PHE  63          1HB       PHE  63  -0.735   6.914  -7.563
  498    HD1  PHE  63           1HD      PHE  63  -4.127   8.129  -6.600
  499    HD2  PHE  63           2HD      PHE  63  -0.871   5.529  -5.734
  500    HE1  PHE  63           1HE      PHE  63  -5.352   7.246  -4.663
  501    HE2  PHE  63           2HE      PHE  63  -2.094   4.642  -3.791
  502    HZ   PHE  63           HZ       PHE  63  -4.341   5.504  -3.254
  503    H    ILE  64           H        ILE  64   1.129   8.619  -7.071
  504    HA   ILE  64           HA       ILE  64   1.503   8.355  -4.368
  505    HB   ILE  64           HB       ILE  64   3.390   9.826  -6.210
  506   1HG1  ILE  64          2HG1      ILE  64   4.302   7.229  -5.943
  507   2HG1  ILE  64          1HG1      ILE  64   2.559   7.024  -6.090
  508   1HG2  ILE  64          1HG2      ILE  64   5.122   8.949  -4.672
  509   2HG2  ILE  64          2HG2      ILE  64   3.839   8.350  -3.622
  510   3HG2  ILE  64          3HG2      ILE  64   4.013  10.082  -3.900
  511   1HD1  ILE  64          1HD1      ILE  64   3.976   8.795  -8.015
  512   2HD1  ILE  64          2HD1      ILE  64   2.511   7.836  -8.229
  513   3HD1  ILE  64          3HD1      ILE  64   4.087   7.046  -8.200
  514    H    ASP  65           H        ASP  65   0.845  11.267  -6.159
  515    HA   ASP  65           HA       ASP  65   1.597  13.049  -4.035
  516   1HB   ASP  65          2HB       ASP  65   1.241  13.398  -6.705
  517   2HB   ASP  65          1HB       ASP  65  -0.293  14.015  -6.099
  518    H    PHE  66           H        PHE  66  -1.316  11.407  -5.059
  519    HA   PHE  66           HA       PHE  66  -3.175  12.938  -3.596
  520   1HB   PHE  66          2HB       PHE  66  -4.101  11.501  -5.222
  521   2HB   PHE  66          1HB       PHE  66  -3.169  10.119  -4.661
  522    HD1  PHE  66           1HD      PHE  66  -3.806   8.997  -2.526
  523    HD2  PHE  66           2HD      PHE  66  -6.229  11.990  -4.337
  524    HE1  PHE  66           1HE      PHE  66  -5.723   8.263  -1.170
  525    HE2  PHE  66           2HE      PHE  66  -8.149  11.262  -2.983
  526    HZ   PHE  66           HZ       PHE  66  -7.897   9.396  -1.396
  527    H    ILE  67           H        ILE  67  -1.311  10.034  -2.802
  528    HA   ILE  67           HA       ILE  67  -2.377   9.603  -0.242
  529    HB   ILE  67           HB       ILE  67   0.369   8.921  -1.311
  530   1HG1  ILE  67          2HG1      ILE  67  -0.879   6.575  -1.199
  531   2HG1  ILE  67          1HG1      ILE  67  -2.305   7.595  -1.369
  532   1HG2  ILE  67          1HG2      ILE  67   0.812   8.595   0.881
  533   2HG2  ILE  67          2HG2      ILE  67  -0.071   7.091   0.613
  534   3HG2  ILE  67          3HG2      ILE  67  -0.893   8.482   1.320
  535   1HD1  ILE  67          1HD1      ILE  67  -0.322   8.373  -3.279
  536   2HD1  ILE  67          2HD1      ILE  67  -1.962   7.779  -3.542
  537   3HD1  ILE  67          3HD1      ILE  67  -0.624   6.640  -3.388
  538    H    LYS  68           H        LYS  68   0.408  11.518  -1.335
  539    HA   LYS  68           HA       LYS  68   1.052  12.358   1.334
  540   1HB   LYS  68          2HB       LYS  68   2.706  13.819   0.262
  541   2HB   LYS  68          1HB       LYS  68   2.821  12.165  -0.326
  542   1HG   LYS  68          2HG       LYS  68   2.948  13.243  -2.290
  543   2HG   LYS  68          1HG       LYS  68   1.196  13.108  -2.166
  544   1HD   LYS  68          2HD       LYS  68   1.046  15.323  -2.313
  545   2HD   LYS  68          1HD       LYS  68   1.921  15.455  -0.787
  546   1HE   LYS  68          2HE       LYS  68   4.034  15.500  -1.961
  547   2HE   LYS  68          1HE       LYS  68   3.217  15.238  -3.502
  548   1HZ   LYS  68          1HZ       LYS  68   1.959  17.409  -2.709
  549   2HZ   LYS  68          2HZ       LYS  68   3.410  17.477  -3.576
  550   3HZ   LYS  68          3HZ       LYS  68   3.418  17.662  -1.893
  551    H    GLU  69           H        GLU  69  -1.049  13.426  -1.171
  552    HA   GLU  69           HA       GLU  69  -1.249  16.161  -0.535
  553   1HB   GLU  69          2HB       GLU  69  -2.167  15.036  -2.597
  554   2HB   GLU  69          1HB       GLU  69  -3.465  14.409  -1.593
  555   1HG   GLU  69          2HG       GLU  69  -3.916  16.851  -0.982
  556   2HG   GLU  69          1HG       GLU  69  -2.894  17.244  -2.363
  557    H    ASN  70           H        ASN  70  -2.885  13.299   0.680
  558    HA   ASN  70           HA       ASN  70  -4.015  14.928   2.858
  559   1HB   ASN  70          2HB       ASN  70  -5.344  12.377   2.057
  560   2HB   ASN  70          1HB       ASN  70  -6.043  13.831   2.761
  561   1HD2  ASN  70          1HD2      ASN  70  -4.521  12.632  -0.203
  562   2HD2  ASN  70          2HD2      ASN  70  -5.470  13.588  -1.284
  563    H    SER  71           H        SER  71  -1.534  13.122   2.405
  564    HA   SER  71           HA       SER  71  -1.401  12.118   5.051
  565   1HB   SER  71          2HB       SER  71  -2.736  10.406   3.353
  566   2HB   SER  71          1HB       SER  71  -1.087   9.791   3.292
  567    HG   SER  71           HG       SER  71  -2.906   9.784   5.367
  568    HA   PRO  72           HA       PRO  72   2.620  12.735   2.839
  569   1HB   PRO  72          2HB       PRO  72   3.298  14.900   4.555
  570   2HB   PRO  72          1HB       PRO  72   2.856  14.979   2.850
  571   1HG   PRO  72          2HG       PRO  72   1.352  15.986   4.967
  572   2HG   PRO  72          1HG       PRO  72   0.757  15.684   3.328
  573   1HD   PRO  72          2HD       PRO  72   0.447  14.041   5.795
  574   2HD   PRO  72          1HD       PRO  72  -0.677  14.270   4.438
  575    H    ASP  73           H        ASP  73   1.600  12.066   5.973
  576    HA   ASP  73           HA       ASP  73   4.317  11.603   6.956
  577   1HB   ASP  73          2HB       ASP  73   2.345  12.795   8.252
  578   2HB   ASP  73          1HB       ASP  73   1.935  11.133   8.668
  579    H    SER  74           H        SER  74   1.984   9.926   5.320
  580    HA   SER  74           HA       SER  74   2.323   7.411   6.721
  581   1HB   SER  74          2HB       SER  74   0.968   6.911   4.336
  582   2HB   SER  74          1HB       SER  74   0.243   7.160   5.922
  583    HG   SER  74           HG       SER  74  -0.192   9.219   5.421
  584    H    VAL  75           H        VAL  75   2.358   5.555   4.749
  585    HA   VAL  75           HA       VAL  75   4.845   6.086   3.261
  586    HB   VAL  75           HB       VAL  75   4.119   3.490   4.637
  587   1HG1  VAL  75          1HG1      VAL  75   6.208   4.269   2.695
  588   2HG1  VAL  75          2HG1      VAL  75   5.451   2.703   2.987
  589   3HG1  VAL  75          3HG1      VAL  75   6.735   3.273   4.052
  590   1HG2  VAL  75          1HG2      VAL  75   4.982   5.692   5.911
  591   2HG2  VAL  75          2HG2      VAL  75   6.530   5.000   5.425
  592   3HG2  VAL  75          3HG2      VAL  75   5.409   4.053   6.403
  593    H    VAL  76           H        VAL  76   5.048   5.070   1.244
  594    HA   VAL  76           HA       VAL  76   2.625   3.725   0.250
  595    HB   VAL  76           HB       VAL  76   4.304   5.486  -1.510
  596   1HG1  VAL  76          1HG1      VAL  76   2.983   4.358  -2.951
  597   2HG1  VAL  76          2HG1      VAL  76   1.805   5.587  -2.487
  598   3HG1  VAL  76          3HG1      VAL  76   1.769   3.997  -1.725
  599   1HG2  VAL  76          1HG2      VAL  76   2.041   6.288   0.293
  600   2HG2  VAL  76          2HG2      VAL  76   2.422   7.183  -1.178
  601   3HG2  VAL  76          3HG2      VAL  76   3.624   7.044   0.105
  602    H    ILE  77           H        ILE  77   3.332   1.652   0.193
  603    HA   ILE  77           HA       ILE  77   5.922   1.087  -1.071
  604    HB   ILE  77           HB       ILE  77   4.193  -0.966   0.274
  605   1HG1  ILE  77          2HG1      ILE  77   4.575   0.984   1.818
  606   2HG1  ILE  77          1HG1      ILE  77   5.240  -0.543   2.388
  607   1HG2  ILE  77          1HG2      ILE  77   6.169  -1.588  -1.159
  608   2HG2  ILE  77          2HG2      ILE  77   6.185  -2.216   0.488
  609   3HG2  ILE  77          3HG2      ILE  77   7.188  -0.828   0.064
  610   1HD1  ILE  77          1HD1      ILE  77   7.386   0.455   1.110
  611   2HD1  ILE  77          2HD1      ILE  77   7.036   0.729   2.816
  612   3HD1  ILE  77          3HD1      ILE  77   6.596   1.946   1.620
  613    H    VAL  78           H        VAL  78   4.829   1.683  -3.163
  614    HA   VAL  78           HA       VAL  78   2.790   0.041  -4.249
  615    HB   VAL  78           HB       VAL  78   4.858   1.633  -5.774
  616   1HG1  VAL  78          1HG1      VAL  78   2.041   1.032  -6.621
  617   2HG1  VAL  78          2HG1      VAL  78   3.366  -0.077  -6.968
  618   3HG1  VAL  78          3HG1      VAL  78   3.402   1.567  -7.606
  619   1HG2  VAL  78          1HG2      VAL  78   2.367   2.453  -4.344
  620   2HG2  VAL  78          2HG2      VAL  78   2.861   3.307  -5.806
  621   3HG2  VAL  78          3HG2      VAL  78   3.938   3.251  -4.410
  622    H    ILE  79           H        ILE  79   2.861  -1.858  -5.301
  623    HA   ILE  79           HA       ILE  79   5.433  -2.929  -6.204
  624    HB   ILE  79           HB       ILE  79   3.635  -4.794  -4.721
  625   1HG1  ILE  79          2HG1      ILE  79   5.714  -3.071  -3.366
  626   2HG1  ILE  79          1HG1      ILE  79   3.976  -2.844  -3.219
  627   1HG2  ILE  79          1HG2      ILE  79   6.111  -5.550  -4.102
  628   2HG2  ILE  79          2HG2      ILE  79   6.459  -4.690  -5.602
  629   3HG2  ILE  79          3HG2      ILE  79   5.319  -6.036  -5.599
  630   1HD1  ILE  79          1HD1      ILE  79   3.727  -4.609  -1.827
  631   2HD1  ILE  79          2HD1      ILE  79   5.401  -4.205  -1.446
  632   3HD1  ILE  79          3HD1      ILE  79   5.042  -5.521  -2.567
  633    H    THR  80           H        THR  80   4.965  -5.182  -7.303
  634    HA   THR  80           HA       THR  80   3.845  -6.459  -8.831
  635    HB   THR  80           HB       THR  80   1.415  -4.743  -8.912
  636    HG1  THR  80           1HG      THR  80   0.794  -5.925  -6.899
  637   1HG2  THR  80          1HG2      THR  80   0.240  -6.812  -8.886
  638   2HG2  THR  80          2HG2      THR  80   1.712  -7.701  -8.492
  639   3HG2  THR  80          3HG2      THR  80   1.545  -6.926 -10.068
  640    H    GLY  81           H        GLY  81   3.552  -6.424 -11.075
  641   1HA   GLY  81          2HA       GLY  81   3.003  -4.359 -12.760
  642   2HA   GLY  81          1HA       GLY  81   4.694  -4.110 -12.355
  643    H    HIS  82           H        HIS  82   2.399  -6.364 -13.791
  644    HA   HIS  82           HA       HIS  82   4.196  -8.322 -14.650
  645   1HB   HIS  82          2HB       HIS  82   1.728  -7.481 -16.172
  646   2HB   HIS  82          1HB       HIS  82   2.473  -9.076 -16.119
  647    HD1  HIS  82           1HD      HIS  82   2.641  -9.784 -13.274
  648    HD2  HIS  82           2HD      HIS  82  -0.569  -7.613 -14.772
  649    HE1  HIS  82           1HE      HIS  82   0.774 -10.125 -11.628
  650    HE2  HIS  82           2HE      HIS  82  -1.128  -8.726 -12.505
  651    H    GLY  83           H        GLY  83   5.967  -7.971 -15.816
  652   1HA   GLY  83          2HA       GLY  83   7.375  -7.194 -17.456
  653   2HA   GLY  83          1HA       GLY  83   5.950  -7.210 -18.482
  654    H    SER  84           H        SER  84   7.205  -5.227 -15.791
  655    HA   SER  84           HA       SER  84   7.405  -2.891 -17.404
  656   1HB   SER  84          2HB       SER  84   4.965  -3.265 -15.698
  657   2HB   SER  84          1HB       SER  84   5.635  -1.649 -15.928
  658    HG   SER  84           HG       SER  84   5.540  -2.230 -18.264
  659    H    VAL  85           H        VAL  85   9.358  -2.429 -16.558
  660    HA   VAL  85           HA       VAL  85   9.566  -2.163 -13.633
  661    HB   VAL  85           HB       VAL  85  11.140  -3.772 -14.667
  662   1HG1  VAL  85          1HG1      VAL  85  11.381  -2.615 -16.831
  663   2HG1  VAL  85          2HG1      VAL  85  12.934  -3.013 -16.096
  664   3HG1  VAL  85          3HG1      VAL  85  12.326  -1.358 -16.032
  665   1HG2  VAL  85          1HG2      VAL  85  11.771  -1.603 -12.912
  666   2HG2  VAL  85          2HG2      VAL  85  13.196  -2.019 -13.865
  667   3HG2  VAL  85          3HG2      VAL  85  12.386  -3.256 -12.904
  668    H    ASP  86           H        ASP  86   8.413  -0.169 -15.431
  669    HA   ASP  86           HA       ASP  86  10.379   2.002 -15.082
  670   1HB   ASP  86          2HB       ASP  86   9.220   3.185 -16.902
  671   2HB   ASP  86          1HB       ASP  86   9.819   1.618 -17.439
  672    H    THR  87           H        THR  87   7.031   0.998 -14.615
  673    HA   THR  87           HA       THR  87   6.021   3.458 -13.703
  674    HB   THR  87           HB       THR  87   4.818   1.173 -14.260
  675    HG1  THR  87           1HG      THR  87   3.863   3.238 -13.653
  676   1HG2  THR  87          1HG2      THR  87   5.924   0.200 -12.063
  677   2HG2  THR  87          2HG2      THR  87   4.304  -0.266 -12.583
  678   3HG2  THR  87          3HG2      THR  87   4.510   0.948 -11.321
  679    H    ALA  88           H        ALA  88   7.928   0.982 -12.184
  680    HA   ALA  88           HA       ALA  88   7.577   1.689  -9.492
  681   1HB   ALA  88          1HB       ALA  88   9.910   0.437 -10.930
  682   2HB   ALA  88          2HB       ALA  88   8.634  -0.387 -10.037
  683   3HB   ALA  88          3HB       ALA  88   9.813   0.602  -9.178
  684    H    VAL  89           H        VAL  89  10.250   2.497 -11.685
  685    HA   VAL  89           HA       VAL  89  11.434   4.407  -9.997
  686    HB   VAL  89           HB       VAL  89  12.725   5.108 -11.935
  687   1HG1  VAL  89          1HG1      VAL  89  12.852   2.707 -10.785
  688   2HG1  VAL  89          2HG1      VAL  89  13.925   3.187 -12.098
  689   3HG1  VAL  89          3HG1      VAL  89  12.505   2.198 -12.437
  690   1HG2  VAL  89          1HG2      VAL  89  12.272   4.352 -14.167
  691   2HG2  VAL  89          2HG2      VAL  89  10.812   5.117 -13.537
  692   3HG2  VAL  89          3HG2      VAL  89  10.927   3.358 -13.608
  693    H    LYS  90           H        LYS  90   8.710   4.566 -12.116
  694    HA   LYS  90           HA       LYS  90   8.704   7.482 -12.154
  695   1HB   LYS  90          2HB       LYS  90   8.082   6.015 -14.154
  696   2HB   LYS  90          1HB       LYS  90   6.587   5.677 -13.293
  697   1HG   LYS  90          2HG       LYS  90   6.038   8.048 -13.282
  698   2HG   LYS  90          1HG       LYS  90   7.552   8.409 -14.115
  699   1HD   LYS  90          2HD       LYS  90   5.717   6.421 -15.349
  700   2HD   LYS  90          1HD       LYS  90   5.263   8.124 -15.424
  701   1HE   LYS  90          2HE       LYS  90   6.650   8.403 -17.133
  702   2HE   LYS  90          1HE       LYS  90   8.004   7.960 -16.095
  703   1HZ   LYS  90          1HZ       LYS  90   7.335   6.613 -18.281
  704   2HZ   LYS  90          2HZ       LYS  90   6.425   5.756 -17.142
  705   3HZ   LYS  90          3HZ       LYS  90   8.101   5.896 -16.955
  706    H    ALA  91           H        ALA  91   8.346   5.923  -9.671
  707    HA   ALA  91           HA       ALA  91   5.996   7.303  -8.705
  708   1HB   ALA  91          1HB       ALA  91   5.154   5.143  -7.634
  709   2HB   ALA  91          2HB       ALA  91   6.168   4.307  -8.810
  710   3HB   ALA  91          3HB       ALA  91   4.862   5.358  -9.359
  711    H    ILE  92           H        ILE  92   8.642   5.055  -8.025
  712    HA   ILE  92           HA       ILE  92   8.636   5.454  -5.220
  713    HB   ILE  92           HB       ILE  92  10.644   4.216  -5.134
  714   1HG1  ILE  92          2HG1      ILE  92  10.979   4.743  -8.097
  715   2HG1  ILE  92          1HG1      ILE  92  11.938   5.467  -6.808
  716   1HG2  ILE  92          1HG2      ILE  92  10.087   2.469  -7.124
  717   2HG2  ILE  92          2HG2      ILE  92   8.572   3.365  -7.037
  718   3HG2  ILE  92          3HG2      ILE  92   9.201   2.558  -5.603
  719   1HD1  ILE  92          1HD1      ILE  92  12.903   3.359  -6.249
  720   2HD1  ILE  92          2HD1      ILE  92  13.046   3.583  -7.993
  721   3HD1  ILE  92          3HD1      ILE  92  11.808   2.511  -7.339
  722    H    LYS  93           H        LYS  93   9.892   7.294  -7.841
  723    HA   LYS  93           HA       LYS  93  11.658   8.815  -6.072
  724   1HB   LYS  93          2HB       LYS  93  12.143   7.994  -8.558
  725   2HB   LYS  93          1HB       LYS  93  11.338   9.508  -8.952
  726   1HG   LYS  93          2HG       LYS  93  12.981  10.614  -7.357
  727   2HG   LYS  93          1HG       LYS  93  13.873   9.093  -7.405
  728   1HD   LYS  93          2HD       LYS  93  14.911   9.984  -9.182
  729   2HD   LYS  93          1HD       LYS  93  13.435   9.574 -10.058
  730   1HE   LYS  93          2HE       LYS  93  12.776  11.725 -10.218
  731   2HE   LYS  93          1HE       LYS  93  13.375  12.135  -8.611
  732   1HZ   LYS  93          1HZ       LYS  93  15.305  11.603 -10.760
  733   2HZ   LYS  93          2HZ       LYS  93  15.456  12.605  -9.405
  734   3HZ   LYS  93          3HZ       LYS  93  14.516  13.099 -10.721
  735    H    LYS  94           H        LYS  94   8.690   8.906  -5.947
  736    HA   LYS  94           HA       LYS  94   8.415  11.812  -6.260
  737   1HB   LYS  94          2HB       LYS  94   7.239  10.724  -8.120
  738   2HB   LYS  94          1HB       LYS  94   6.304   9.773  -6.974
  739   1HG   LYS  94          2HG       LYS  94   5.085  11.622  -6.248
  740   2HG   LYS  94          1HG       LYS  94   6.257  12.767  -6.905
  741   1HD   LYS  94          2HD       LYS  94   4.829  10.910  -8.755
  742   2HD   LYS  94          1HD       LYS  94   3.985  12.331  -8.137
  743   1HE   LYS  94          2HE       LYS  94   6.063  13.637  -8.902
  744   2HE   LYS  94          1HE       LYS  94   6.449  12.196  -9.842
  745   1HZ   LYS  94          1HZ       LYS  94   4.364  14.173 -10.250
  746   2HZ   LYS  94          2HZ       LYS  94   3.907  12.568 -10.526
  747   3HZ   LYS  94          3HZ       LYS  94   5.205  13.234 -11.380
  748    H    GLY  95           H        GLY  95   8.617   9.469  -4.073
  749   1HA   GLY  95          2HA       GLY  95   8.039  10.513  -1.798
  750   2HA   GLY  95          1HA       GLY  95   6.394  10.452  -2.411
  751    H    ALA  96           H        ALA  96   7.104   7.837  -3.798
  752    HA   ALA  96           HA       ALA  96   6.078   6.116  -1.844
  753   1HB   ALA  96          1HB       ALA  96   5.802   4.796  -3.604
  754   2HB   ALA  96          2HB       ALA  96   7.547   4.612  -3.782
  755   3HB   ALA  96          3HB       ALA  96   6.716   5.947  -4.579
  756    H    TYR  97           H        TYR  97   7.396   3.870  -1.581
  757    HA   TYR  97           HA       TYR  97   9.950   4.618  -0.313
  758   1HB   TYR  97          2HB       TYR  97   8.044   3.997   1.210
  759   2HB   TYR  97          1HB       TYR  97   8.113   2.380   0.520
  760    HD1  TYR  97           1HD      TYR  97  10.101   4.881   2.409
  761    HD2  TYR  97           2HD      TYR  97   9.642   0.792   1.332
  762    HE1  TYR  97           1HE      TYR  97  11.826   4.261   4.047
  763    HE2  TYR  97           2HE      TYR  97  11.364   0.160   2.967
  764    HH   TYR  97           HH       TYR  97  12.246   1.535   5.337
  765    H    GLU  98           H        GLU  98   9.490   3.664  -3.039
  766    HA   GLU  98           HA       GLU  98  10.823   2.461  -4.475
  767   1HB   GLU  98          2HB       GLU  98  12.587   1.212  -3.781
  768   2HB   GLU  98          1HB       GLU  98  12.282   2.065  -2.280
  769   1HG   GLU  98          2HG       GLU  98  10.700  -0.068  -1.898
  770   2HG   GLU  98          1HG       GLU  98  11.911  -0.784  -2.961
  771    H    PHE  99           H        PHE  99  10.685   0.418  -5.588
  772    HA   PHE  99           HA       PHE  99   8.063  -0.784  -5.193
  773   1HB   PHE  99          2HB       PHE  99   9.748  -0.199  -7.441
  774   2HB   PHE  99          1HB       PHE  99   9.351  -1.912  -7.445
  775    HD1  PHE  99           1HD      PHE  99   7.551   1.280  -6.724
  776    HD2  PHE  99           2HD      PHE  99   7.562  -2.459  -8.757
  777    HE1  PHE  99           1HE      PHE  99   5.355   1.807  -7.699
  778    HE2  PHE  99           2HE      PHE  99   5.367  -1.936  -9.738
  779    HZ   PHE  99           HZ       PHE  99   4.260   0.198  -9.207
  780    H    LEU 100           H        LEU 100   8.091  -2.371  -3.704
  781    HA   LEU 100           HA       LEU 100  10.242  -4.030  -3.069
  782   1HB   LEU 100          2HB       LEU 100   8.077  -3.612  -1.789
  783   2HB   LEU 100          1HB       LEU 100   7.344  -4.808  -2.837
  784    HG   LEU 100           HG       LEU 100   8.694  -6.552  -1.954
  785   1HD1  LEU 100          1HD1      LEU 100  10.831  -5.988  -1.551
  786   2HD1  LEU 100          2HD1      LEU 100  10.248  -5.627   0.073
  787   3HD1  LEU 100          3HD1      LEU 100  10.417  -4.332  -1.111
  788   1HD2  LEU 100          1HD2      LEU 100   8.174  -5.069   0.557
  789   2HD2  LEU 100          2HD2      LEU 100   7.725  -6.711   0.094
  790   3HD2  LEU 100          3HD2      LEU 100   6.812  -5.337  -0.531
  791    H    GLU 101           H        GLU 101  10.406  -6.386  -3.429
  792    HA   GLU 101           HA       GLU 101  10.518  -7.016  -6.142
  793   1HB   GLU 101          2HB       GLU 101  10.600  -8.742  -3.674
  794   2HB   GLU 101          1HB       GLU 101  10.795  -9.410  -5.289
  795   1HG   GLU 101          2HG       GLU 101  12.626  -7.514  -5.462
  796   2HG   GLU 101          1HG       GLU 101  12.622  -7.692  -3.707
  797    H    LYS 102           H        LYS 102   8.937  -9.625  -4.594
  798    HA   LYS 102           HA       LYS 102   6.248  -9.055  -5.071
  799   1HB   LYS 102          2HB       LYS 102   5.827 -10.243  -7.159
  800   2HB   LYS 102          1HB       LYS 102   6.931  -8.902  -7.430
  801   1HG   LYS 102          2HG       LYS 102   8.329 -10.306  -8.410
  802   2HG   LYS 102          1HG       LYS 102   8.541 -11.130  -6.864
  803   1HD   LYS 102          2HD       LYS 102   7.402 -12.913  -7.571
  804   2HD   LYS 102          1HD       LYS 102   6.069 -11.914  -8.150
  805   1HE   LYS 102          2HE       LYS 102   7.132 -13.260  -9.936
  806   2HE   LYS 102          1HE       LYS 102   7.197 -11.524 -10.238
  807   1HZ   LYS 102          1HZ       LYS 102   9.303 -12.670 -10.719
  808   2HZ   LYS 102          2HZ       LYS 102   9.427 -13.116  -9.092
  809   3HZ   LYS 102          3HZ       LYS 102   9.474 -11.482  -9.527
  810    HA   PRO 103           HA       PRO 103   7.744 -13.091  -2.976
  811   1HB   PRO 103          2HB       PRO 103   6.538 -12.410  -0.572
  812   2HB   PRO 103          1HB       PRO 103   8.254 -12.212  -0.941
  813   1HG   PRO 103          2HG       PRO 103   6.047 -10.200  -1.043
  814   2HG   PRO 103          1HG       PRO 103   7.719 -10.006  -0.484
  815   1HD   PRO 103          2HD       PRO 103   6.942  -9.103  -2.879
  816   2HD   PRO 103          1HD       PRO 103   8.549  -9.824  -2.646
  817    H    PHE 104           H        PHE 104   6.350 -14.781  -2.213
  818    HA   PHE 104           HA       PHE 104   3.742 -14.686  -3.437
  819   1HB   PHE 104          2HB       PHE 104   5.579 -16.685  -3.015
  820   2HB   PHE 104          1HB       PHE 104   4.364 -17.035  -1.791
  821    HD1  PHE 104           1HD      PHE 104   5.236 -17.258  -5.247
  822    HD2  PHE 104           2HD      PHE 104   1.952 -17.273  -2.539
  823    HE1  PHE 104           1HE      PHE 104   3.834 -18.331  -6.960
  824    HE2  PHE 104           2HE      PHE 104   0.544 -18.348  -4.248
  825    HZ   PHE 104           HZ       PHE 104   1.484 -18.877  -6.461
  826    H    SER 105           H        SER 105   4.949 -15.331  -0.144
  827    HA   SER 105           HA       SER 105   2.253 -14.896   0.901
  828   1HB   SER 105          2HB       SER 105   3.341 -16.874   1.742
  829   2HB   SER 105          1HB       SER 105   4.773 -15.951   2.198
  830    HG   SER 105           HG       SER 105   3.085 -16.491   3.871
  831    H    VAL 106           H        VAL 106   4.610 -12.905   0.055
  832    HA   VAL 106           HA       VAL 106   5.245 -10.803   0.605
  833    HB   VAL 106           HB       VAL 106   3.682  -9.358   1.461
  834   1HG1  VAL 106          1HG1      VAL 106   1.623 -11.424   1.024
  835   2HG1  VAL 106          2HG1      VAL 106   2.788 -11.182  -0.277
  836   3HG1  VAL 106          3HG1      VAL 106   1.811  -9.830   0.295
  837   1HG2  VAL 106          1HG2      VAL 106   1.869 -10.989   2.987
  838   2HG2  VAL 106          2HG2      VAL 106   2.756  -9.545   3.473
  839   3HG2  VAL 106          3HG2      VAL 106   3.505 -11.131   3.623
  840    H    GLU 107           H        GLU 107   5.873 -13.259   2.473
  841    HA   GLU 107           HA       GLU 107   6.259 -12.461   5.067
  842   1HB   GLU 107          2HB       GLU 107   6.810 -14.701   3.903
  843   2HB   GLU 107          1HB       GLU 107   8.389 -13.986   3.607
  844   1HG   GLU 107          2HG       GLU 107   7.995 -13.506   6.277
  845   2HG   GLU 107          1HG       GLU 107   7.262 -15.093   6.046
  846    H    ARG 108           H        ARG 108   8.387 -11.871   2.288
  847    HA   ARG 108           HA       ARG 108  10.373 -10.464   3.742
  848   1HB   ARG 108          2HB       ARG 108  10.379 -11.490   1.304
  849   2HB   ARG 108          1HB       ARG 108   9.848  -9.875   0.857
  850   1HG   ARG 108          2HG       ARG 108  12.152  -9.783   0.616
  851   2HG   ARG 108          1HG       ARG 108  11.876  -9.055   2.199
  852   1HD   ARG 108          2HD       ARG 108  12.623 -10.963   3.332
  853   2HD   ARG 108          1HD       ARG 108  12.464 -11.981   1.902
  854    HE   ARG 108           HE       ARG 108  14.561 -11.341   1.261
  855   1HH1  ARG 108          1HH1      ARG 108  13.400  -9.099   3.671
  856   2HH1  ARG 108          2HH1      ARG 108  14.915  -8.274   3.813
  857   1HH2  ARG 108          1HH2      ARG 108  16.555 -10.256   1.448
  858   2HH2  ARG 108          2HH2      ARG 108  16.706  -8.929   2.551
  859    H    PHE 109           H        PHE 109   7.423  -9.543   2.090
  860    HA   PHE 109           HA       PHE 109   7.734  -6.757   2.106
  861   1HB   PHE 109          2HB       PHE 109   5.978  -7.637   0.779
  862   2HB   PHE 109          1HB       PHE 109   5.319  -8.564   2.118
  863    HD1  PHE 109           1HD      PHE 109   6.252  -4.970   1.829
  864    HD2  PHE 109           2HD      PHE 109   3.171  -7.824   2.512
  865    HE1  PHE 109           1HE      PHE 109   4.675  -3.146   2.312
  866    HE2  PHE 109           2HE      PHE 109   1.588  -6.004   2.996
  867    HZ   PHE 109           HZ       PHE 109   2.339  -3.664   2.898
  868    H    LEU 110           H        LEU 110   6.906  -9.016   4.608
  869    HA   LEU 110           HA       LEU 110   5.655  -7.332   6.449
  870   1HB   LEU 110          2HB       LEU 110   6.362  -9.955   6.365
  871   2HB   LEU 110          1HB       LEU 110   7.429  -9.331   7.609
  872    HG   LEU 110           HG       LEU 110   4.427  -9.035   7.610
  873   1HD1  LEU 110          1HD1      LEU 110   4.625 -10.626   9.556
  874   2HD1  LEU 110          2HD1      LEU 110   6.265 -10.961   8.997
  875   3HD1  LEU 110          3HD1      LEU 110   4.887 -11.318   7.955
  876   1HD2  LEU 110          1HD2      LEU 110   6.514  -7.718   9.075
  877   2HD2  LEU 110          2HD2      LEU 110   5.528  -8.689  10.170
  878   3HD2  LEU 110          3HD2      LEU 110   4.770  -7.469   9.147
  879    H    LEU 111           H        LEU 111   9.080  -8.079   5.978
  880    HA   LEU 111           HA       LEU 111  10.147  -6.748   8.159
  881   1HB   LEU 111          2HB       LEU 111  11.245  -7.170   5.393
  882   2HB   LEU 111          1HB       LEU 111  12.184  -6.450   6.688
  883    HG   LEU 111           HG       LEU 111  11.574  -8.628   7.990
  884   1HD1  LEU 111          1HD1      LEU 111  10.671  -9.204   5.253
  885   2HD1  LEU 111          2HD1      LEU 111  10.191  -9.929   6.786
  886   3HD1  LEU 111          3HD1      LEU 111  11.679 -10.446   5.994
  887   1HD2  LEU 111          1HD2      LEU 111  13.811  -8.448   7.670
  888   2HD2  LEU 111          2HD2      LEU 111  13.650  -8.101   5.948
  889   3HD2  LEU 111          3HD2      LEU 111  13.505  -9.760   6.531
  890    H    THR 112           H        THR 112   9.769  -5.459   4.852
  891    HA   THR 112           HA       THR 112  10.615  -2.879   5.308
  892    HB   THR 112           HB       THR 112   8.408  -3.812   3.462
  893    HG1  THR 112           1HG      THR 112  10.138  -4.818   2.730
  894   1HG2  THR 112          1HG2      THR 112   8.676  -1.880   2.181
  895   2HG2  THR 112          2HG2      THR 112  10.134  -1.399   3.048
  896   3HG2  THR 112          3HG2      THR 112   8.563  -1.305   3.844
  897    H    ILE 113           H        ILE 113   7.213  -3.942   5.309
  898    HA   ILE 113           HA       ILE 113   5.797  -1.811   5.951
  899    HB   ILE 113           HB       ILE 113   5.620  -4.541   7.190
  900   1HG1  ILE 113          2HG1      ILE 113   5.038  -4.238   4.809
  901   2HG1  ILE 113          1HG1      ILE 113   3.648  -4.732   5.772
  902   1HG2  ILE 113          1HG2      ILE 113   4.160  -2.104   7.998
  903   2HG2  ILE 113          2HG2      ILE 113   4.537  -3.561   8.917
  904   3HG2  ILE 113          3HG2      ILE 113   3.195  -3.563   7.772
  905   1HD1  ILE 113          1HD1      ILE 113   3.533  -1.977   5.824
  906   2HD1  ILE 113          2HD1      ILE 113   2.565  -3.051   4.813
  907   3HD1  ILE 113          3HD1      ILE 113   4.055  -2.350   4.181
  908    H    LYS 114           H        LYS 114   7.208  -3.681   8.648
  909    HA   LYS 114           HA       LYS 114   6.729  -1.847  10.658
  910   1HB   LYS 114          2HB       LYS 114   7.716  -4.166  10.897
  911   2HB   LYS 114          1HB       LYS 114   9.266  -3.466  10.453
  912   1HG   LYS 114          2HG       LYS 114   7.724  -2.284  12.712
  913   2HG   LYS 114          1HG       LYS 114   8.621  -3.784  12.958
  914   1HD   LYS 114          2HD       LYS 114  10.587  -2.718  12.984
  915   2HD   LYS 114          1HD       LYS 114  10.180  -1.770  11.552
  916   1HE   LYS 114          2HE       LYS 114  10.558  -0.311  13.455
  917   2HE   LYS 114          1HE       LYS 114   8.869  -0.239  12.952
  918   1HZ   LYS 114          1HZ       LYS 114   8.678  -0.441  15.213
  919   2HZ   LYS 114          2HZ       LYS 114  10.038  -1.436  15.367
  920   3HZ   LYS 114          3HZ       LYS 114   8.593  -2.067  14.755
  921    H    HIS 115           H        HIS 115   9.714  -2.200   8.800
  922    HA   HIS 115           HA       HIS 115  11.058   0.052   9.665
  923   1HB   HIS 115          2HB       HIS 115  11.292  -1.805   7.487
  924   2HB   HIS 115          1HB       HIS 115  11.678  -0.176   6.943
  925    HD1  HIS 115           1HD      HIS 115  12.589  -2.299   9.979
  926    HD2  HIS 115           2HD      HIS 115  14.307   0.324   7.252
  927    HE1  HIS 115           1HE      HIS 115  15.019  -2.166  10.612
  928    HE2  HIS 115           2HE      HIS 115  16.020  -0.508   9.002
  929    H    ALA 116           H        ALA 116   8.363  -0.189   7.462
  930    HA   ALA 116           HA       ALA 116   8.671   2.410   6.309
  931   1HB   ALA 116          1HB       ALA 116   5.975   1.668   6.119
  932   2HB   ALA 116          2HB       ALA 116   6.899   0.170   6.014
  933   3HB   ALA 116          3HB       ALA 116   7.229   1.489   4.893
  934    H    PHE 117           H        PHE 117   6.928   1.087   9.064
  935    HA   PHE 117           HA       PHE 117   5.376   3.383   9.632
  936   1HB   PHE 117          2HB       PHE 117   6.162   0.929  11.147
  937   2HB   PHE 117          1HB       PHE 117   5.431   2.271  12.022
  938    HD1  PHE 117           1HD      PHE 117   3.122   2.884  11.656
  939    HD2  PHE 117           2HD      PHE 117   4.895  -0.345   9.525
  940    HE1  PHE 117           1HE      PHE 117   0.890   2.115  10.975
  941    HE2  PHE 117           2HE      PHE 117   2.669  -1.118   8.841
  942    HZ   PHE 117           HZ       PHE 117   0.659   0.113   9.561
  943    H    GLU 118           H        GLU 118   8.700   2.770   9.988
  944    HA   GLU 118           HA       GLU 118   9.361   4.160  12.302
  945   1HB   GLU 118          2HB       GLU 118  10.784   2.790  10.538
  946   2HB   GLU 118          1HB       GLU 118  11.143   4.405   9.944
  947   1HG   GLU 118          2HG       GLU 118  11.986   5.040  12.130
  948   2HG   GLU 118          1HG       GLU 118  11.588   3.442  12.759
  949    H    GLU 119           H        GLU 119   8.171   5.350   9.309
  950    HA   GLU 119           HA       GLU 119   9.148   8.051   9.785
  951   1HB   GLU 119          2HB       GLU 119   7.331   7.099   7.569
  952   2HB   GLU 119          1HB       GLU 119   8.255   8.594   7.623
  953   1HG   GLU 119          2HG       GLU 119  10.329   7.139   7.694
  954   2HG   GLU 119          1HG       GLU 119   9.271   5.794   7.276
  955    H    TYR 120           H        TYR 120   7.506   7.207  11.819
  956    HA   TYR 120           HA       TYR 120   5.237   9.023  11.491
  957   1HB   TYR 120          2HB       TYR 120   4.579   6.556  11.156
  958   2HB   TYR 120          1HB       TYR 120   4.872   6.379  12.883
  959    HD1  TYR 120           1HD      TYR 120   3.351   7.310  14.501
  960    HD2  TYR 120           2HD      TYR 120   2.728   7.949  10.341
  961    HE1  TYR 120           1HE      TYR 120   1.076   8.116  14.972
  962    HE2  TYR 120           2HE      TYR 120   0.453   8.758  10.801
  963    HH   TYR 120           HH       TYR 120  -1.252   8.586  12.518
  964    H    SER 121           H        SER 121   7.938   8.766  12.977
  965    HA   SER 121           HA       SER 121   6.913   9.265  15.690
  966   1HB   SER 121          2HB       SER 121   9.392   8.014  14.651
  967   2HB   SER 121          1HB       SER 121   9.581   9.043  16.070
  968    HG   SER 121           HG       SER 121   8.974   6.643  16.253
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1   1.914   3.828  14.124
    2   2H    MET   1          2HT       MET   1   1.326   3.098  15.562
    3   3H    MET   1          3HT       MET   1   1.639   4.786  15.519
    4    HA   MET   1           HA       MET   1  -0.618   4.640  15.349
    5   1HB   MET   1          2HB       MET   1   0.732   4.885  12.667
    6   2HB   MET   1          1HB       MET   1  -0.994   5.159  12.855
    7   1HG   MET   1          2HG       MET   1  -0.708   7.133  13.905
    8   2HG   MET   1          1HG       MET   1   0.766   6.613  14.719
    9   1HE   MET   1          1HE       MET   1  -0.060   9.213  13.649
   10   2HE   MET   1          2HE       MET   1   0.458   9.716  12.040
   11   3HE   MET   1          3HE       MET   1   1.605   9.728  13.379
   12    H    LYS   2           H        LYS   2   0.965   2.216  13.351
   13    HA   LYS   2           HA       LYS   2   0.316   0.165  12.627
   14   1HB   LYS   2          2HB       LYS   2  -1.919   0.500  14.633
   15   2HB   LYS   2          1HB       LYS   2  -1.450  -1.010  13.864
   16   1HG   LYS   2          2HG       LYS   2   0.349   0.626  15.637
   17   2HG   LYS   2          1HG       LYS   2  -0.609  -0.752  16.178
   18   1HD   LYS   2          2HD       LYS   2   0.746  -2.266  15.163
   19   2HD   LYS   2          1HD       LYS   2   1.125  -1.185  13.820
   20   1HE   LYS   2          2HE       LYS   2   2.812  -0.116  14.985
   21   2HE   LYS   2          1HE       LYS   2   2.151  -0.565  16.557
   22   1HZ   LYS   2          1HZ       LYS   2   2.783  -2.888  16.041
   23   2HZ   LYS   2          2HZ       LYS   2   4.107  -1.844  16.158
   24   3HZ   LYS   2          3HZ       LYS   2   3.554  -2.343  14.639
   25    H    ARG   3           H        ARG   3  -1.843  -1.051  11.847
   26    HA   ARG   3           HA       ARG   3  -3.595  -1.156  10.408
   27   1HB   ARG   3          2HB       ARG   3  -3.830   1.835  10.684
   28   2HB   ARG   3          1HB       ARG   3  -5.047   0.725  10.075
   29   1HG   ARG   3          2HG       ARG   3  -5.876   0.842  12.145
   30   2HG   ARG   3          1HG       ARG   3  -4.592  -0.301  12.542
   31   1HD   ARG   3          2HD       ARG   3  -3.406   1.230  13.683
   32   2HD   ARG   3          1HD       ARG   3  -3.799   2.526  12.556
   33    HE   ARG   3           HE       ARG   3  -5.967   1.666  14.273
   34   1HH1  ARG   3          1HH1      ARG   3  -3.331   3.913  13.818
   35   2HH1  ARG   3          2HH1      ARG   3  -3.987   5.091  14.904
   36   1HH2  ARG   3          1HH2      ARG   3  -6.825   3.216  15.698
   37   2HH2  ARG   3          2HH2      ARG   3  -5.968   4.696  15.971
   38    H    VAL   4           H        VAL   4  -3.002  -1.684   8.427
   39    HA   VAL   4           HA       VAL   4  -1.649   0.348   6.770
   40    HB   VAL   4           HB       VAL   4  -1.325  -2.653   6.557
   41   1HG1  VAL   4          1HG1      VAL   4  -0.257  -0.333   5.010
   42   2HG1  VAL   4          2HG1      VAL   4  -0.893  -1.871   4.429
   43   3HG1  VAL   4          3HG1      VAL   4   0.708  -1.800   5.166
   44   1HG2  VAL   4          1HG2      VAL   4   0.666  -0.633   7.589
   45   2HG2  VAL   4          2HG2      VAL   4   0.867  -2.383   7.509
   46   3HG2  VAL   4          3HG2      VAL   4  -0.313  -1.681   8.615
   47    H    LEU   5           H        LEU   5  -2.096   0.198   4.440
   48    HA   LEU   5           HA       LEU   5  -4.819  -0.819   3.958
   49   1HB   LEU   5          2HB       LEU   5  -4.603   1.624   3.850
   50   2HB   LEU   5          1HB       LEU   5  -3.379   1.462   2.606
   51    HG   LEU   5           HG       LEU   5  -5.060   0.430   1.113
   52   1HD1  LEU   5          1HD1      LEU   5  -7.499   0.973   1.971
   53   2HD1  LEU   5          2HD1      LEU   5  -6.738   0.728   3.543
   54   3HD1  LEU   5          3HD1      LEU   5  -6.707  -0.559   2.339
   55   1HD2  LEU   5          1HD2      LEU   5  -6.378   2.939   1.930
   56   2HD2  LEU   5          2HD2      LEU   5  -5.750   2.442   0.358
   57   3HD2  LEU   5          3HD2      LEU   5  -4.649   3.043   1.597
   58    H    VAL   6           H        VAL   6  -5.108  -2.341   2.466
   59    HA   VAL   6           HA       VAL   6  -2.887  -2.887   0.603
   60    HB   VAL   6           HB       VAL   6  -4.962  -4.868   1.543
   61   1HG1  VAL   6          1HG1      VAL   6  -4.138  -5.602  -0.523
   62   2HG1  VAL   6          2HG1      VAL   6  -3.171  -6.474   0.668
   63   3HG1  VAL   6          3HG1      VAL   6  -2.497  -5.070  -0.158
   64   1HG2  VAL   6          1HG2      VAL   6  -3.459  -5.706   3.121
   65   2HG2  VAL   6          2HG2      VAL   6  -3.334  -3.956   3.306
   66   3HG2  VAL   6          3HG2      VAL   6  -2.093  -4.841   2.416
   67    H    VAL   7           H        VAL   7  -3.599  -1.591  -1.096
   68    HA   VAL   7           HA       VAL   7  -6.293  -1.905  -2.127
   69    HB   VAL   7           HB       VAL   7  -3.996  -0.355  -3.339
   70   1HG1  VAL   7          1HG1      VAL   7  -6.961  -0.372  -3.830
   71   2HG1  VAL   7          2HG1      VAL   7  -5.659  -0.674  -4.980
   72   3HG1  VAL   7          3HG1      VAL   7  -5.915   0.951  -4.345
   73   1HG2  VAL   7          1HG2      VAL   7  -6.172   0.656  -1.513
   74   2HG2  VAL   7          2HG2      VAL   7  -4.883   1.610  -2.246
   75   3HG2  VAL   7          3HG2      VAL   7  -4.495   0.385  -1.038
   76    H    ASP   8           H        ASP   8  -6.818  -3.538  -3.435
   77    HA   ASP   8           HA       ASP   8  -5.089  -4.272  -5.631
   78   1HB   ASP   8          2HB       ASP   8  -4.160  -5.645  -3.826
   79   2HB   ASP   8          1HB       ASP   8  -5.759  -6.293  -3.478
   80    H    ASP   9           H        ASP   9  -6.164  -5.377  -7.282
   81    HA   ASP   9           HA       ASP   9  -8.996  -5.004  -7.320
   82   1HB   ASP   9          2HB       ASP   9  -7.645  -4.732  -9.341
   83   2HB   ASP   9          1HB       ASP   9  -7.193  -6.433  -9.283
   84    H    GLU  10           H        GLU  10  -7.262  -8.011  -8.116
   85    HA   GLU  10           HA       GLU  10  -9.510  -9.545  -7.096
   86   1HB   GLU  10          2HB       GLU  10  -8.132  -9.961  -9.288
   87   2HB   GLU  10          1HB       GLU  10  -7.022 -10.788  -8.204
   88   1HG   GLU  10          2HG       GLU  10  -9.744 -11.612  -7.730
   89   2HG   GLU  10          1HG       GLU  10  -9.289 -11.838  -9.419
   90    H    GLU  11           H        GLU  11  -8.879 -11.648  -5.911
   91    HA   GLU  11           HA       GLU  11  -7.447 -10.852  -3.523
   92   1HB   GLU  11          2HB       GLU  11  -9.675 -12.322  -3.860
   93   2HB   GLU  11          1HB       GLU  11  -8.486 -13.616  -3.798
   94   1HG   GLU  11          2HG       GLU  11  -8.171 -13.382  -1.603
   95   2HG   GLU  11          1HG       GLU  11  -8.149 -11.621  -1.697
   96    H    SER  12           H        SER  12  -5.481 -10.790  -5.117
   97    HA   SER  12           HA       SER  12  -4.243 -13.395  -5.484
   98   1HB   SER  12          2HB       SER  12  -3.139 -10.655  -6.144
   99   2HB   SER  12          1HB       SER  12  -2.515 -12.206  -6.704
  100    HG   SER  12           HG       SER  12  -4.514 -12.505  -7.801
  101    H    ILE  13           H        ILE  13  -3.076 -10.305  -4.132
  102    HA   ILE  13           HA       ILE  13  -1.180 -11.715  -2.462
  103    HB   ILE  13           HB       ILE  13  -1.773  -8.756  -2.540
  104   1HG1  ILE  13          2HG1      ILE  13  -1.092  -9.638  -4.753
  105   2HG1  ILE  13          1HG1      ILE  13   0.113  -8.555  -4.065
  106   1HG2  ILE  13          1HG2      ILE  13   0.142 -10.439  -1.078
  107   2HG2  ILE  13          2HG2      ILE  13  -0.504  -8.844  -0.687
  108   3HG2  ILE  13          3HG2      ILE  13   0.827  -8.999  -1.833
  109   1HD1  ILE  13          1HD1      ILE  13   0.718 -11.214  -3.260
  110   2HD1  ILE  13          2HD1      ILE  13   1.656 -10.119  -4.275
  111   3HD1  ILE  13          3HD1      ILE  13   0.457 -11.188  -5.004
  112    H    THR  14           H        THR  14  -4.061  -9.701  -2.004
  113    HA   THR  14           HA       THR  14  -4.135  -9.411   0.707
  114    HB   THR  14           HB       THR  14  -6.666  -9.554   0.467
  115    HG1  THR  14           1HG      THR  14  -6.028  -9.858  -2.275
  116   1HG2  THR  14          1HG2      THR  14  -5.945  -7.388   0.246
  117   2HG2  THR  14          2HG2      THR  14  -6.713  -7.668  -1.317
  118   3HG2  THR  14          3HG2      THR  14  -4.957  -7.746  -1.170
  119    H    SER  15           H        SER  15  -4.887 -12.319  -1.125
  120    HA   SER  15           HA       SER  15  -6.042 -13.787   0.991
  121   1HB   SER  15          2HB       SER  15  -5.337 -15.788  -0.468
  122   2HB   SER  15          1HB       SER  15  -6.456 -14.622  -1.171
  123    HG   SER  15           HG       SER  15  -3.669 -14.847  -1.626
  124    H    SER  16           H        SER  16  -2.719 -13.268  -0.004
  125    HA   SER  16           HA       SER  16  -1.795 -15.146   2.053
  126   1HB   SER  16          2HB       SER  16  -0.803 -15.497  -0.133
  127   2HB   SER  16          1HB       SER  16  -0.308 -13.807  -0.216
  128    HG   SER  16           HG       SER  16   1.101 -14.181   1.507
  129    H    LEU  17           H        LEU  17  -0.880 -11.919   0.834
  130    HA   LEU  17           HA       LEU  17   0.750 -11.089   2.865
  131   1HB   LEU  17          2HB       LEU  17   0.565  -9.680   0.999
  132   2HB   LEU  17          1HB       LEU  17  -1.180  -9.593   1.120
  133    HG   LEU  17           HG       LEU  17   0.223  -7.519   1.767
  134   1HD1  LEU  17          1HD1      LEU  17  -1.557  -6.748   2.937
  135   2HD1  LEU  17          2HD1      LEU  17  -1.654  -8.183   3.957
  136   3HD1  LEU  17          3HD1      LEU  17  -2.280  -8.229   2.309
  137   1HD2  LEU  17          1HD2      LEU  17   1.290  -7.442   3.792
  138   2HD2  LEU  17          2HD2      LEU  17   1.605  -9.118   3.342
  139   3HD2  LEU  17          3HD2      LEU  17   0.315  -8.738   4.478
  140    H    SER  18           H        SER  18  -2.767 -10.448   2.738
  141    HA   SER  18           HA       SER  18  -3.141  -9.158   5.082
  142   1HB   SER  18          2HB       SER  18  -4.927  -9.880   3.429
  143   2HB   SER  18          1HB       SER  18  -4.948 -11.439   4.254
  144    HG   SER  18           HG       SER  18  -5.376 -10.177   6.211
  145    H    ALA  19           H        ALA  19  -3.116 -12.724   4.813
  146    HA   ALA  19           HA       ALA  19  -3.389 -13.362   7.487
  147   1HB   ALA  19          1HB       ALA  19  -3.426 -15.238   6.193
  148   2HB   ALA  19          2HB       ALA  19  -1.758 -15.326   6.757
  149   3HB   ALA  19          3HB       ALA  19  -2.113 -14.681   5.156
  150    H    ILE  20           H        ILE  20  -0.557 -12.332   5.713
  151    HA   ILE  20           HA       ILE  20   1.331 -12.785   7.801
  152    HB   ILE  20           HB       ILE  20   1.478 -11.079   5.316
  153   1HG1  ILE  20          2HG1      ILE  20   3.119 -13.512   5.723
  154   2HG1  ILE  20          1HG1      ILE  20   1.403 -13.733   5.392
  155   1HG2  ILE  20          1HG2      ILE  20   3.485 -11.572   7.474
  156   2HG2  ILE  20          2HG2      ILE  20   3.045 -10.060   6.680
  157   3HG2  ILE  20          3HG2      ILE  20   4.004 -11.262   5.816
  158   1HD1  ILE  20          1HD1      ILE  20   3.493 -13.216   3.567
  159   2HD1  ILE  20          2HD1      ILE  20   2.422 -11.815   3.571
  160   3HD1  ILE  20          3HD1      ILE  20   1.772 -13.419   3.238
  161    H    LEU  21           H        LEU  21   0.440  -9.671   6.330
  162    HA   LEU  21           HA       LEU  21   1.406  -8.055   8.348
  163   1HB   LEU  21          2HB       LEU  21   0.782  -6.458   6.944
  164   2HB   LEU  21          1HB       LEU  21   0.182  -7.721   5.909
  165    HG   LEU  21           HG       LEU  21  -1.447  -5.967   6.166
  166   1HD1  LEU  21          1HD1      LEU  21  -1.826  -8.693   6.507
  167   2HD1  LEU  21          2HD1      LEU  21  -3.042  -7.502   6.046
  168   3HD1  LEU  21          3HD1      LEU  21  -2.840  -7.943   7.740
  169   1HD2  LEU  21          1HD2      LEU  21  -2.110  -6.505   8.937
  170   2HD2  LEU  21          2HD2      LEU  21  -1.871  -4.966   8.110
  171   3HD2  LEU  21          3HD2      LEU  21  -0.485  -5.845   8.753
  172    H    GLU  22           H        GLU  22  -1.567  -9.854   8.224
  173    HA   GLU  22           HA       GLU  22  -2.752  -8.471  10.441
  174   1HB   GLU  22          2HB       GLU  22  -3.918  -9.760   8.512
  175   2HB   GLU  22          1HB       GLU  22  -3.614 -11.178   9.509
  176   1HG   GLU  22          2HG       GLU  22  -4.706  -9.218  11.191
  177   2HG   GLU  22          1HG       GLU  22  -5.667  -9.216   9.715
  178    H    GLU  23           H        GLU  23  -0.586 -11.126   9.976
  179    HA   GLU  23           HA       GLU  23  -1.042 -12.320  12.549
  180   1HB   GLU  23          2HB       GLU  23  -0.279 -13.804  10.869
  181   2HB   GLU  23          1HB       GLU  23   1.007 -12.712  10.373
  182   1HG   GLU  23          2HG       GLU  23   2.431 -13.530  11.870
  183   2HG   GLU  23          1HG       GLU  23   1.220 -13.542  13.152
  184    H    GLU  24           H        GLU  24   1.274 -10.095  11.089
  185    HA   GLU  24           HA       GLU  24   3.140  -9.945  13.136
  186   1HB   GLU  24          2HB       GLU  24   2.526  -8.491  10.775
  187   2HB   GLU  24          1HB       GLU  24   2.812  -7.341  12.074
  188   1HG   GLU  24          2HG       GLU  24   4.688  -9.566  11.322
  189   2HG   GLU  24          1HG       GLU  24   4.830  -7.900  10.763
  190    H    GLY  25           H        GLY  25   0.122  -8.146  12.721
  191   1HA   GLY  25          2HA       GLY  25  -1.097  -7.805  14.881
  192   2HA   GLY  25          1HA       GLY  25   0.424  -7.160  15.472
  193    H    TYR  26           H        TYR  26  -1.688  -6.687  12.643
  194    HA   TYR  26           HA       TYR  26  -1.603  -3.795  13.173
  195   1HB   TYR  26          2HB       TYR  26  -1.258  -5.155  10.500
  196   2HB   TYR  26          1HB       TYR  26  -1.495  -3.426  10.703
  197    HD1  TYR  26           1HD      TYR  26   0.902  -5.864  10.171
  198    HD2  TYR  26           2HD      TYR  26   0.226  -2.371  12.501
  199    HE1  TYR  26           1HE      TYR  26   3.328  -5.570  10.419
  200    HE2  TYR  26           2HE      TYR  26   2.651  -2.064  12.754
  201    HH   TYR  26           HH       TYR  26   4.732  -2.726  11.525
  202    H    HIS  27           H        HIS  27  -3.212  -2.860  11.239
  203    HA   HIS  27           HA       HIS  27  -5.713  -4.394  11.420
  204   1HB   HIS  27          2HB       HIS  27  -5.257  -2.184  12.958
  205   2HB   HIS  27          1HB       HIS  27  -6.005  -1.461  11.538
  206    HD1  HIS  27           1HD      HIS  27  -8.239  -0.903  12.586
  207    HD2  HIS  27           2HD      HIS  27  -7.196  -4.902  13.017
  208    HE1  HIS  27           1HE      HIS  27 -10.296  -2.042  13.477
  209    HE2  HIS  27           2HE      HIS  27  -9.666  -4.475  13.655
  210    HA   PRO  28           HA       PRO  28  -4.836  -3.218   7.036
  211   1HB   PRO  28          2HB       PRO  28  -6.314  -5.709   6.537
  212   2HB   PRO  28          1HB       PRO  28  -4.723  -5.212   5.959
  213   1HG   PRO  28          2HG       PRO  28  -5.013  -7.127   7.818
  214   2HG   PRO  28          1HG       PRO  28  -3.650  -6.002   7.829
  215   1HD   PRO  28          2HD       PRO  28  -6.127  -5.981   9.506
  216   2HD   PRO  28          1HD       PRO  28  -4.449  -5.623   9.967
  217    H    ASP  29           H        ASP  29  -6.191  -2.238   5.623
  218    HA   ASP  29           HA       ASP  29  -9.046  -2.395   6.238
  219   1HB   ASP  29          2HB       ASP  29  -7.838  -0.180   6.716
  220   2HB   ASP  29          1HB       ASP  29  -7.842   0.022   4.967
  221    H    THR  30           H        THR  30  -6.785  -3.020   3.983
  222    HA   THR  30           HA       THR  30  -6.752  -3.464   1.764
  223    HB   THR  30           HB       THR  30  -8.615  -4.985   1.075
  224    HG1  THR  30           1HG      THR  30 -10.181  -3.913   2.487
  225   1HG2  THR  30          1HG2      THR  30  -7.161  -6.419   1.958
  226   2HG2  THR  30          2HG2      THR  30  -8.236  -6.434   3.356
  227   3HG2  THR  30          3HG2      THR  30  -6.826  -5.375   3.338
  228    H    ALA  31           H        ALA  31  -8.125  -3.546  -0.308
  229    HA   ALA  31           HA       ALA  31 -10.193  -1.621  -0.646
  230   1HB   ALA  31          1HB       ALA  31  -8.898   0.187  -0.852
  231   2HB   ALA  31          2HB       ALA  31  -8.375  -0.500  -2.390
  232   3HB   ALA  31          3HB       ALA  31  -7.424  -0.778  -0.931
  233    H    LYS  32           H        LYS  32 -10.477  -1.256  -3.155
  234    HA   LYS  32           HA       LYS  32  -9.989  -3.864  -4.435
  235   1HB   LYS  32          2HB       LYS  32 -12.181  -1.969  -5.241
  236   2HB   LYS  32          1HB       LYS  32 -12.049  -3.692  -5.563
  237   1HG   LYS  32          2HG       LYS  32 -12.445  -4.180  -3.216
  238   2HG   LYS  32          1HG       LYS  32 -12.530  -2.454  -2.862
  239   1HD   LYS  32          2HD       LYS  32 -14.745  -2.754  -3.137
  240   2HD   LYS  32          1HD       LYS  32 -14.353  -2.653  -4.854
  241   1HE   LYS  32          2HE       LYS  32 -15.275  -4.670  -5.073
  242   2HE   LYS  32          1HE       LYS  32 -13.886  -5.309  -4.198
  243   1HZ   LYS  32          1HZ       LYS  32 -16.557  -4.614  -3.145
  244   2HZ   LYS  32          2HZ       LYS  32 -15.219  -4.763  -2.120
  245   3HZ   LYS  32          3HZ       LYS  32 -15.733  -6.087  -3.038
  246    H    THR  33           H        THR  33  -9.684  -0.425  -4.744
  247    HA   THR  33           HA       THR  33  -7.795  -0.653  -6.842
  248    HB   THR  33           HB       THR  33  -9.383   0.941  -8.319
  249    HG1  THR  33           1HG      THR  33 -11.479   0.129  -8.279
  250   1HG2  THR  33          1HG2      THR  33  -8.522  -1.746  -8.496
  251   2HG2  THR  33          2HG2      THR  33  -8.999  -0.651  -9.794
  252   3HG2  THR  33          3HG2      THR  33 -10.205  -1.677  -9.017
  253    H    LEU  34           H        LEU  34  -7.551   1.748  -7.854
  254    HA   LEU  34           HA       LEU  34  -6.682   3.349  -5.722
  255   1HB   LEU  34          2HB       LEU  34  -7.236   4.107  -8.591
  256   2HB   LEU  34          1HB       LEU  34  -6.360   5.103  -7.443
  257    HG   LEU  34           HG       LEU  34  -5.491   2.367  -8.375
  258   1HD1  LEU  34          1HD1      LEU  34  -4.194   3.316  -9.958
  259   2HD1  LEU  34          2HD1      LEU  34  -3.920   4.780  -9.014
  260   3HD1  LEU  34          3HD1      LEU  34  -5.431   4.571  -9.898
  261   1HD2  LEU  34          1HD2      LEU  34  -4.767   2.908  -6.097
  262   2HD2  LEU  34          2HD2      LEU  34  -4.066   4.417  -6.683
  263   3HD2  LEU  34          3HD2      LEU  34  -3.410   2.872  -7.222
  264    H    ARG  35           H        ARG  35  -9.640   3.417  -7.645
  265    HA   ARG  35           HA       ARG  35 -10.672   5.839  -6.638
  266   1HB   ARG  35          2HB       ARG  35 -11.604   3.650  -8.283
  267   2HB   ARG  35          1HB       ARG  35 -12.860   4.148  -7.157
  268   1HG   ARG  35          2HG       ARG  35 -13.042   6.247  -8.074
  269   2HG   ARG  35          1HG       ARG  35 -11.405   6.219  -8.732
  270   1HD   ARG  35          2HD       ARG  35 -12.413   5.778 -10.685
  271   2HD   ARG  35          1HD       ARG  35 -12.570   4.139 -10.054
  272    HE   ARG  35           HE       ARG  35 -14.672   6.091 -10.394
  273   1HH1  ARG  35          1HH1      ARG  35 -13.700   3.126  -8.825
  274   2HH1  ARG  35          2HH1      ARG  35 -15.324   2.592  -8.556
  275   1HH2  ARG  35          1HH2      ARG  35 -16.807   5.387 -10.037
  276   2HH2  ARG  35          2HH2      ARG  35 -17.087   3.874  -9.243
  277    H    GLU  36           H        GLU  36 -11.213   2.467  -5.661
  278    HA   GLU  36           HA       GLU  36 -12.865   3.063  -3.447
  279   1HB   GLU  36          2HB       GLU  36 -12.066   0.767  -4.748
  280   2HB   GLU  36          1HB       GLU  36 -11.246   0.630  -3.199
  281   1HG   GLU  36          2HG       GLU  36 -14.198   0.938  -3.671
  282   2HG   GLU  36          1HG       GLU  36 -13.352  -0.485  -3.066
  283    H    ALA  37           H        ALA  37  -9.402   2.837  -3.894
  284    HA   ALA  37           HA       ALA  37  -8.770   2.894  -1.098
  285   1HB   ALA  37          1HB       ALA  37  -6.482   3.052  -1.781
  286   2HB   ALA  37          2HB       ALA  37  -6.948   3.541  -3.410
  287   3HB   ALA  37          3HB       ALA  37  -7.289   1.904  -2.847
  288    H    GLU  38           H        GLU  38  -9.587   5.260  -3.455
  289    HA   GLU  38           HA       GLU  38  -8.268   7.452  -2.146
  290   1HB   GLU  38          2HB       GLU  38 -10.195   7.187  -4.413
  291   2HB   GLU  38          1HB       GLU  38  -9.957   8.759  -3.662
  292   1HG   GLU  38          2HG       GLU  38  -7.393   7.972  -4.061
  293   2HG   GLU  38          1HG       GLU  38  -8.205   7.230  -5.439
  294    H    LYS  39           H        LYS  39 -11.476   6.028  -2.210
  295    HA   LYS  39           HA       LYS  39 -12.734   8.027  -0.625
  296   1HB   LYS  39          2HB       LYS  39 -14.071   6.538  -1.998
  297   2HB   LYS  39          1HB       LYS  39 -13.455   5.133  -1.139
  298   1HG   LYS  39          2HG       LYS  39 -14.845   7.221   0.445
  299   2HG   LYS  39          1HG       LYS  39 -15.818   6.185  -0.602
  300   1HD   LYS  39          2HD       LYS  39 -14.565   4.233   0.493
  301   2HD   LYS  39          1HD       LYS  39 -14.068   5.409   1.712
  302   1HE   LYS  39          2HE       LYS  39 -16.006   4.382   2.574
  303   2HE   LYS  39          1HE       LYS  39 -16.527   5.959   1.983
  304   1HZ   LYS  39          1HZ       LYS  39 -16.793   3.427   0.455
  305   2HZ   LYS  39          2HZ       LYS  39 -17.405   4.941   0.017
  306   3HZ   LYS  39          3HZ       LYS  39 -18.035   4.130   1.362
  307    H    LYS  40           H        LYS  40 -11.083   4.991   0.052
  308    HA   LYS  40           HA       LYS  40 -11.653   4.969   2.844
  309   1HB   LYS  40          2HB       LYS  40  -9.449   3.577   1.313
  310   2HB   LYS  40          1HB       LYS  40  -9.935   3.216   2.964
  311   1HG   LYS  40          2HG       LYS  40 -12.046   3.100   0.898
  312   2HG   LYS  40          1HG       LYS  40 -10.811   1.841   0.860
  313   1HD   LYS  40          2HD       LYS  40 -11.451   1.995   3.532
  314   2HD   LYS  40          1HD       LYS  40 -13.005   2.259   2.738
  315   1HE   LYS  40          2HE       LYS  40 -11.380   0.076   1.625
  316   2HE   LYS  40          1HE       LYS  40 -11.949  -0.179   3.275
  317   1HZ   LYS  40          1HZ       LYS  40 -13.527  -1.041   1.678
  318   2HZ   LYS  40          2HZ       LYS  40 -13.649   0.469   0.926
  319   3HZ   LYS  40          3HZ       LYS  40 -14.209   0.266   2.510
  320    H    ILE  41           H        ILE  41  -9.034   6.241   0.863
  321    HA   ILE  41           HA       ILE  41  -7.479   7.014   3.189
  322    HB   ILE  41           HB       ILE  41  -7.024   7.600   0.263
  323   1HG1  ILE  41          2HG1      ILE  41  -5.440   5.673   1.935
  324   2HG1  ILE  41          1HG1      ILE  41  -6.943   5.162   1.176
  325   1HG2  ILE  41          1HG2      ILE  41  -5.263   8.029   2.669
  326   2HG2  ILE  41          2HG2      ILE  41  -5.912   9.258   1.583
  327   3HG2  ILE  41          3HG2      ILE  41  -4.701   8.116   1.000
  328   1HD1  ILE  41          1HD1      ILE  41  -5.858   4.786  -0.707
  329   2HD1  ILE  41          2HD1      ILE  41  -4.356   5.313   0.051
  330   3HD1  ILE  41          3HD1      ILE  41  -5.379   6.482  -0.782
  331    H    LYS  42           H        LYS  42  -9.959   8.353   1.254
  332    HA   LYS  42           HA       LYS  42  -9.357  11.071   1.303
  333   1HB   LYS  42          2HB       LYS  42 -11.700   9.427   0.826
  334   2HB   LYS  42          1HB       LYS  42 -12.100  10.973   1.561
  335   1HG   LYS  42          2HG       LYS  42 -10.876  12.123  -0.229
  336   2HG   LYS  42          1HG       LYS  42 -10.534  10.562  -0.976
  337   1HD   LYS  42          2HD       LYS  42 -12.783  10.199  -1.517
  338   2HD   LYS  42          1HD       LYS  42 -13.345  11.427  -0.382
  339   1HE   LYS  42          2HE       LYS  42 -12.044  13.083  -1.862
  340   2HE   LYS  42          1HE       LYS  42 -12.044  11.789  -3.059
  341   1HZ   LYS  42          1HZ       LYS  42 -14.613  11.830  -2.378
  342   2HZ   LYS  42          2HZ       LYS  42 -13.977  12.747  -3.648
  343   3HZ   LYS  42          3HZ       LYS  42 -14.231  13.460  -2.136
  344    H    GLU  43           H        GLU  43 -10.225   8.985   3.885
  345    HA   GLU  43           HA       GLU  43 -10.397  11.310   5.661
  346   1HB   GLU  43          2HB       GLU  43 -12.177   8.874   5.831
  347   2HB   GLU  43          1HB       GLU  43 -12.159  10.215   6.969
  348   1HG   GLU  43          2HG       GLU  43 -12.740  11.694   4.980
  349   2HG   GLU  43          1HG       GLU  43 -13.095  10.196   4.122
  350    H    LEU  44           H        LEU  44 -10.159   7.756   5.631
  351    HA   LEU  44           HA       LEU  44  -8.968   7.467   8.138
  352   1HB   LEU  44          2HB       LEU  44  -9.696   5.795   6.017
  353   2HB   LEU  44          1HB       LEU  44  -7.982   5.512   6.247
  354    HG   LEU  44           HG       LEU  44  -9.314   3.921   7.520
  355   1HD1  LEU  44          1HD1      LEU  44  -8.093   4.020   9.484
  356   2HD1  LEU  44          2HD1      LEU  44  -8.149   5.781   9.549
  357   3HD1  LEU  44          3HD1      LEU  44  -7.114   4.975   8.371
  358   1HD2  LEU  44          1HD2      LEU  44 -10.976   4.469   8.988
  359   2HD2  LEU  44          2HD2      LEU  44 -11.156   5.781   7.823
  360   3HD2  LEU  44          3HD2      LEU  44 -10.296   6.058   9.337
  361    H    PHE  45           H        PHE  45  -7.091   8.192   8.860
  362    HA   PHE  45           HA       PHE  45  -5.063   9.185   7.101
  363   1HB   PHE  45          2HB       PHE  45  -5.688   9.988   9.496
  364   2HB   PHE  45          1HB       PHE  45  -4.637   8.682  10.034
  365    HD1  PHE  45           1HD      PHE  45  -4.735  11.785   8.019
  366    HD2  PHE  45           2HD      PHE  45  -2.305   8.929  10.032
  367    HE1  PHE  45           1HE      PHE  45  -2.779  13.248   7.725
  368    HE2  PHE  45           2HE      PHE  45  -0.345  10.387   9.742
  369    HZ   PHE  45           HZ       PHE  45  -0.579  12.550   8.587
  370    H    PHE  46           H        PHE  46  -5.057   6.923   6.055
  371    HA   PHE  46           HA       PHE  46  -3.881   4.711   7.251
  372   1HB   PHE  46          2HB       PHE  46  -4.042   5.668   4.412
  373   2HB   PHE  46          1HB       PHE  46  -3.123   4.219   4.810
  374    HD1  PHE  46           1HD      PHE  46  -6.192   5.347   3.717
  375    HD2  PHE  46           2HD      PHE  46  -4.485   2.574   6.455
  376    HE1  PHE  46           1HE      PHE  46  -8.265   4.023   3.660
  377    HE2  PHE  46           2HE      PHE  46  -6.554   1.245   6.404
  378    HZ   PHE  46           HZ       PHE  46  -8.447   1.971   5.006
  379    HA   PRO  47           HA       PRO  47   0.251   6.435   7.778
  380   1HB   PRO  47          2HB       PRO  47   1.240   4.393   9.248
  381   2HB   PRO  47          1HB       PRO  47   0.167   5.620   9.932
  382   1HG   PRO  47          2HG       PRO  47  -0.475   2.848   9.002
  383   2HG   PRO  47          1HG       PRO  47  -1.039   3.703  10.448
  384   1HD   PRO  47          2HD       PRO  47  -2.531   3.455   8.185
  385   2HD   PRO  47          1HD       PRO  47  -2.673   4.830   9.296
  386    H    VAL  48           H        VAL  48  -0.604   3.264   6.574
  387    HA   VAL  48           HA       VAL  48   1.727   3.328   4.811
  388    HB   VAL  48           HB       VAL  48   0.886   0.774   6.153
  389   1HG1  VAL  48          1HG1      VAL  48   3.057   1.641   4.332
  390   2HG1  VAL  48          2HG1      VAL  48   2.182   0.111   4.407
  391   3HG1  VAL  48          3HG1      VAL  48   3.464   0.453   5.569
  392   1HG2  VAL  48          1HG2      VAL  48   1.539   2.364   7.879
  393   2HG2  VAL  48          2HG2      VAL  48   3.052   2.673   7.027
  394   3HG2  VAL  48          3HG2      VAL  48   2.734   1.078   7.709
  395    H    ILE  49           H        ILE  49   1.213   2.920   2.778
  396    HA   ILE  49           HA       ILE  49  -1.380   1.659   2.195
  397    HB   ILE  49           HB       ILE  49   0.137   3.411   0.276
  398   1HG1  ILE  49          2HG1      ILE  49  -0.304   4.672   2.380
  399   2HG1  ILE  49          1HG1      ILE  49  -1.172   5.317   0.991
  400   1HG2  ILE  49          1HG2      ILE  49  -2.494   2.093   0.365
  401   2HG2  ILE  49          2HG2      ILE  49  -1.468   2.496  -1.012
  402   3HG2  ILE  49          3HG2      ILE  49  -2.481   3.737  -0.273
  403   1HD1  ILE  49          1HD1      ILE  49  -2.458   5.181   3.146
  404   2HD1  ILE  49          2HD1      ILE  49  -2.426   3.429   2.958
  405   3HD1  ILE  49          3HD1      ILE  49  -3.222   4.431   1.745
  406    H    VAL  50           H        VAL  50  -1.501   0.111   0.567
  407    HA   VAL  50           HA       VAL  50   1.010  -0.789  -0.637
  408    HB   VAL  50           HB       VAL  50  -0.888  -2.595   0.872
  409   1HG1  VAL  50          1HG1      VAL  50   1.421  -3.207  -0.952
  410   2HG1  VAL  50          2HG1      VAL  50  -0.222  -3.847  -1.003
  411   3HG1  VAL  50          3HG1      VAL  50   0.879  -4.341   0.284
  412   1HG2  VAL  50          1HG2      VAL  50   1.531  -3.078   1.913
  413   2HG2  VAL  50          2HG2      VAL  50   0.436  -1.849   2.547
  414   3HG2  VAL  50          3HG2      VAL  50   1.743  -1.387   1.457
  415    H    LEU  51           H        LEU  51   0.457  -0.264  -2.663
  416    HA   LEU  51           HA       LEU  51  -2.144  -0.785  -3.748
  417   1HB   LEU  51          2HB       LEU  51  -0.666   1.115  -4.439
  418   2HB   LEU  51          1HB       LEU  51   0.380  -0.052  -5.224
  419    HG   LEU  51           HG       LEU  51  -1.402  -0.665  -6.766
  420   1HD1  LEU  51          1HD1      LEU  51  -3.516   0.567  -6.790
  421   2HD1  LEU  51          2HD1      LEU  51  -3.044   1.404  -5.311
  422   3HD1  LEU  51          3HD1      LEU  51  -3.310  -0.340  -5.292
  423   1HD2  LEU  51          1HD2      LEU  51   0.056   1.625  -6.829
  424   2HD2  LEU  51          2HD2      LEU  51  -1.583   2.251  -6.999
  425   3HD2  LEU  51          3HD2      LEU  51  -0.974   1.055  -8.141
  426    H    ASP  52           H        ASP  52  -2.375  -2.001  -5.817
  427    HA   ASP  52           HA       ASP  52  -0.565  -4.199  -6.276
  428   1HB   ASP  52          2HB       ASP  52  -2.447  -4.666  -4.368
  429   2HB   ASP  52          1HB       ASP  52  -3.318  -5.164  -5.814
  430    H    VAL  53           H        VAL  53  -0.397  -3.450  -8.357
  431    HA   VAL  53           HA       VAL  53  -2.691  -2.870  -9.976
  432    HB   VAL  53           HB       VAL  53  -1.138  -2.421 -11.748
  433   1HG1  VAL  53          1HG1      VAL  53  -0.178  -0.604 -10.818
  434   2HG1  VAL  53          2HG1      VAL  53   0.570  -1.530  -9.516
  435   3HG1  VAL  53          3HG1      VAL  53  -1.136  -1.088  -9.418
  436   1HG2  VAL  53          1HG2      VAL  53   0.678  -3.658 -12.087
  437   2HG2  VAL  53          2HG2      VAL  53   0.400  -4.489 -10.557
  438   3HG2  VAL  53          3HG2      VAL  53   1.394  -3.033 -10.601
  439    H    TRP  54           H        TRP  54  -3.408  -5.256  -9.199
  440    HA   TRP  54           HA       TRP  54  -2.358  -7.467 -10.580
  441   1HB   TRP  54          2HB       TRP  54  -3.784  -7.763  -8.640
  442   2HB   TRP  54          1HB       TRP  54  -5.137  -7.007  -9.472
  443    HD1  TRP  54           HD       TRP  54  -6.840  -8.744 -10.241
  444    HE1  TRP  54           1HE      TRP  54  -6.760 -11.176 -11.078
  445    HE3  TRP  54           3HE      TRP  54  -1.791  -9.513 -10.019
  446    HZ2  TRP  54           2HZ      TRP  54  -4.813 -13.158 -11.579
  447    HZ3  TRP  54           3HZ      TRP  54  -0.900 -11.705 -10.694
  448    HH2  TRP  54           HH       TRP  54  -2.382 -13.489 -11.457
  449    H    MET  55           H        MET  55  -5.714  -6.665 -11.241
  450    HA   MET  55           HA       MET  55  -5.217  -7.067 -14.073
  451   1HB   MET  55          2HB       MET  55  -7.566  -7.203 -12.283
  452   2HB   MET  55          1HB       MET  55  -7.883  -6.683 -13.932
  453   1HG   MET  55          2HG       MET  55  -6.175  -8.932 -14.064
  454   2HG   MET  55          1HG       MET  55  -7.470  -9.310 -12.929
  455   1HE   MET  55          1HE       MET  55  -9.750  -7.325 -14.262
  456   2HE   MET  55          2HE       MET  55 -10.074  -8.909 -13.559
  457   3HE   MET  55          3HE       MET  55 -10.632  -8.536 -15.190
  458    HA   PRO  56           HA       PRO  56  -6.910  -2.579 -14.025
  459   1HB   PRO  56          2HB       PRO  56  -6.648  -1.097 -11.839
  460   2HB   PRO  56          1HB       PRO  56  -7.943  -2.297 -11.957
  461   1HG   PRO  56          2HG       PRO  56  -5.310  -2.487 -10.540
  462   2HG   PRO  56          1HG       PRO  56  -6.917  -2.989  -9.983
  463   1HD   PRO  56          2HD       PRO  56  -5.037  -4.679 -11.086
  464   2HD   PRO  56          1HD       PRO  56  -6.782  -4.999 -11.063
  465    H    ASP  57           H        ASP  57  -5.852  -0.235 -13.425
  466    HA   ASP  57           HA       ASP  57  -2.947  -0.381 -13.432
  467   1HB   ASP  57          2HB       ASP  57  -3.560  -0.600 -15.807
  468   2HB   ASP  57          1HB       ASP  57  -4.499   0.887 -15.700
  469    H    GLY  58           H        GLY  58  -5.796   1.713 -13.780
  470   1HA   GLY  58          2HA       GLY  58  -6.222   3.842 -13.021
  471   2HA   GLY  58          1HA       GLY  58  -5.471   3.251 -11.549
  472    H    ASP  59           H        ASP  59  -5.002   5.657 -11.502
  473    HA   ASP  59           HA       ASP  59  -2.736   6.435 -13.164
  474   1HB   ASP  59          2HB       ASP  59  -4.534   7.916 -11.257
  475   2HB   ASP  59          1HB       ASP  59  -3.026   8.627 -11.824
  476    H    GLY  60           H        GLY  60  -2.016   4.365 -11.587
  477   1HA   GLY  60          2HA       GLY  60  -1.117   4.753  -9.027
  478   2HA   GLY  60          1HA       GLY  60  -0.277   3.757 -10.206
  479    H    VAL  61           H        VAL  61   0.336   5.951 -11.995
  480    HA   VAL  61           HA       VAL  61   2.806   6.752 -10.920
  481    HB   VAL  61           HB       VAL  61   1.397   8.152 -13.185
  482   1HG1  VAL  61          1HG1      VAL  61   4.087   8.102 -12.084
  483   2HG1  VAL  61          2HG1      VAL  61   3.320   9.273 -13.156
  484   3HG1  VAL  61          3HG1      VAL  61   4.043   7.809 -13.823
  485   1HG2  VAL  61          1HG2      VAL  61   2.753   5.469 -13.175
  486   2HG2  VAL  61          2HG2      VAL  61   2.575   6.435 -14.640
  487   3HG2  VAL  61          3HG2      VAL  61   1.145   5.882 -13.769
  488    H    ASN  62           H        ASN  62  -0.204   8.562 -11.489
  489    HA   ASN  62           HA       ASN  62   0.835  10.836 -10.001
  490   1HB   ASN  62          2HB       ASN  62  -1.174  10.431 -12.031
  491   2HB   ASN  62          1HB       ASN  62  -1.863  11.295 -10.660
  492   1HD2  ASN  62          1HD2      ASN  62   1.087  11.280 -12.634
  493   2HD2  ASN  62          2HD2      ASN  62   1.221  12.998 -12.748
  494    H    PHE  63           H        PHE  63  -0.295   8.024  -8.983
  495    HA   PHE  63           HA       PHE  63  -2.339   8.932  -7.147
  496   1HB   PHE  63          2HB       PHE  63  -2.428   6.671  -8.173
  497   2HB   PHE  63          1HB       PHE  63  -0.961   6.242  -7.298
  498    HD1  PHE  63           1HD      PHE  63  -4.212   7.873  -6.450
  499    HD2  PHE  63           2HD      PHE  63  -1.335   4.886  -5.492
  500    HE1  PHE  63           1HE      PHE  63  -5.567   7.196  -4.513
  501    HE2  PHE  63           2HE      PHE  63  -2.687   4.201  -3.554
  502    HZ   PHE  63           HZ       PHE  63  -4.808   5.358  -3.063
  503    H    ILE  64           H        ILE  64   1.030   7.870  -6.985
  504    HA   ILE  64           HA       ILE  64   1.476   7.696  -4.299
  505    HB   ILE  64           HB       ILE  64   3.340   9.051  -6.251
  506   1HG1  ILE  64          2HG1      ILE  64   4.202   6.449  -5.891
  507   2HG1  ILE  64          1HG1      ILE  64   2.451   6.279  -5.968
  508   1HG2  ILE  64          1HG2      ILE  64   5.113   8.432  -4.763
  509   2HG2  ILE  64          2HG2      ILE  64   3.996   7.552  -3.721
  510   3HG2  ILE  64          3HG2      ILE  64   3.895   9.309  -3.836
  511   1HD1  ILE  64          1HD1      ILE  64   4.319   7.356  -8.041
  512   2HD1  ILE  64          2HD1      ILE  64   2.590   7.692  -8.085
  513   3HD1  ILE  64          3HD1      ILE  64   3.166   6.029  -8.165
  514    H    ASP  65           H        ASP  65   0.918  10.594  -6.164
  515    HA   ASP  65           HA       ASP  65   1.782  12.423  -4.148
  516   1HB   ASP  65          2HB       ASP  65   1.197  12.672  -6.800
  517   2HB   ASP  65          1HB       ASP  65  -0.249  13.363  -6.073
  518    H    PHE  66           H        PHE  66  -1.328  11.032  -5.092
  519    HA   PHE  66           HA       PHE  66  -3.010  12.548  -3.477
  520   1HB   PHE  66          2HB       PHE  66  -3.947  11.067  -5.120
  521   2HB   PHE  66          1HB       PHE  66  -3.191   9.665  -4.373
  522    HD1  PHE  66           1HD      PHE  66  -4.404   8.366  -2.901
  523    HD2  PHE  66           2HD      PHE  66  -5.654  12.362  -3.658
  524    HE1  PHE  66           1HE      PHE  66  -6.437   7.977  -1.574
  525    HE2  PHE  66           2HE      PHE  66  -7.690  11.981  -2.331
  526    HZ   PHE  66           HZ       PHE  66  -8.084   9.786  -1.285
  527    H    ILE  67           H        ILE  67  -1.171   9.613  -2.730
  528    HA   ILE  67           HA       ILE  67  -2.152   9.232  -0.122
  529    HB   ILE  67           HB       ILE  67   0.486   8.446  -1.366
  530   1HG1  ILE  67          2HG1      ILE  67  -0.712   6.139  -1.051
  531   2HG1  ILE  67          1HG1      ILE  67  -2.172   7.117  -0.955
  532   1HG2  ILE  67          1HG2      ILE  67   1.170   8.247   0.781
  533   2HG2  ILE  67          2HG2      ILE  67   0.250   6.745   0.700
  534   3HG2  ILE  67          3HG2      ILE  67  -0.475   8.186   1.414
  535   1HD1  ILE  67          1HD1      ILE  67  -0.499   7.819  -3.221
  536   2HD1  ILE  67          2HD1      ILE  67  -2.219   7.430  -3.153
  537   3HD1  ILE  67          3HD1      ILE  67  -1.025   6.136  -3.242
  538    H    LYS  68           H        LYS  68   0.648  11.050  -1.338
  539    HA   LYS  68           HA       LYS  68   1.407  11.929   1.299
  540   1HB   LYS  68          2HB       LYS  68   2.326  12.988  -1.380
  541   2HB   LYS  68          1HB       LYS  68   3.115  13.229   0.172
  542   1HG   LYS  68          2HG       LYS  68   2.862  10.446  -0.177
  543   2HG   LYS  68          1HG       LYS  68   3.439  11.105  -1.709
  544   1HD   LYS  68          2HD       LYS  68   5.441  11.691  -0.847
  545   2HD   LYS  68          1HD       LYS  68   4.744  12.190   0.696
  546   1HE   LYS  68          2HE       LYS  68   4.512   9.338   0.339
  547   2HE   LYS  68          1HE       LYS  68   6.188   9.857   0.157
  548   1HZ   LYS  68          1HZ       LYS  68   5.587  11.205   2.316
  549   2HZ   LYS  68          2HZ       LYS  68   6.097   9.594   2.396
  550   3HZ   LYS  68          3HZ       LYS  68   4.451   9.966   2.507
  551    H    GLU  69           H        GLU  69  -0.895  12.900  -0.996
  552    HA   GLU  69           HA       GLU  69  -0.903  15.701  -0.438
  553   1HB   GLU  69          2HB       GLU  69  -1.820  14.542  -2.515
  554   2HB   GLU  69          1HB       GLU  69  -3.208  14.106  -1.528
  555   1HG   GLU  69          2HG       GLU  69  -3.867  16.339  -1.268
  556   2HG   GLU  69          1HG       GLU  69  -2.309  16.949  -1.826
  557    H    ASN  70           H        ASN  70  -2.771  12.916   0.666
  558    HA   ASN  70           HA       ASN  70  -3.900  14.599   2.805
  559   1HB   ASN  70          2HB       ASN  70  -5.145  12.017   1.897
  560   2HB   ASN  70          1HB       ASN  70  -5.892  13.361   2.757
  561   1HD2  ASN  70          1HD2      ASN  70  -4.376  12.524  -0.327
  562   2HD2  ASN  70          2HD2      ASN  70  -5.357  13.564  -1.294
  563    H    SER  71           H        SER  71  -1.422  12.700   2.458
  564    HA   SER  71           HA       SER  71  -1.468  11.775   5.173
  565   1HB   SER  71          2HB       SER  71  -2.118   9.940   3.001
  566   2HB   SER  71          1HB       SER  71  -0.722   9.400   3.933
  567    HG   SER  71           HG       SER  71  -3.144  10.234   5.139
  568    HA   PRO  72           HA       PRO  72   2.665  12.849   3.273
  569   1HB   PRO  72          2HB       PRO  72   2.886  14.771   5.458
  570   2HB   PRO  72          1HB       PRO  72   3.007  15.046   3.720
  571   1HG   PRO  72          2HG       PRO  72   0.916  15.927   5.200
  572   2HG   PRO  72          1HG       PRO  72   0.761  15.465   3.495
  573   1HD   PRO  72          2HD       PRO  72   0.030  13.921   5.954
  574   2HD   PRO  72          1HD       PRO  72  -0.838  14.061   4.410
  575    H    ASP  73           H        ASP  73   1.468  12.044   6.370
  576    HA   ASP  73           HA       ASP  73   4.130  11.236   7.306
  577   1HB   ASP  73          2HB       ASP  73   2.714  12.699   8.776
  578   2HB   ASP  73          1HB       ASP  73   1.576  11.363   8.909
  579    H    SER  74           H        SER  74   2.673   9.782   5.279
  580    HA   SER  74           HA       SER  74   2.094   7.273   6.710
  581   1HB   SER  74          2HB       SER  74   0.167   8.147   5.467
  582   2HB   SER  74          1HB       SER  74   1.128   8.194   3.990
  583    HG   SER  74           HG       SER  74  -0.280   6.295   4.346
  584    H    VAL  75           H        VAL  75   2.186   5.668   4.338
  585    HA   VAL  75           HA       VAL  75   4.894   5.959   3.318
  586    HB   VAL  75           HB       VAL  75   4.085   3.391   4.686
  587   1HG1  VAL  75          1HG1      VAL  75   6.408   4.287   3.035
  588   2HG1  VAL  75          2HG1      VAL  75   5.561   2.740   3.042
  589   3HG1  VAL  75          3HG1      VAL  75   6.691   3.133   4.338
  590   1HG2  VAL  75          1HG2      VAL  75   4.500   4.839   6.464
  591   2HG2  VAL  75          2HG2      VAL  75   5.759   5.710   5.590
  592   3HG2  VAL  75          3HG2      VAL  75   6.069   4.081   6.190
  593    H    VAL  76           H        VAL  76   5.154   5.223   1.338
  594    HA   VAL  76           HA       VAL  76   2.898   3.767   0.116
  595    HB   VAL  76           HB       VAL  76   4.858   5.531  -1.342
  596   1HG1  VAL  76          1HG1      VAL  76   3.831   3.957  -2.806
  597   2HG1  VAL  76          2HG1      VAL  76   3.040   5.511  -3.064
  598   3HG1  VAL  76          3HG1      VAL  76   2.239   4.261  -2.111
  599   1HG2  VAL  76          1HG2      VAL  76   2.424   6.199   0.185
  600   2HG2  VAL  76          2HG2      VAL  76   2.564   6.931  -1.414
  601   3HG2  VAL  76          3HG2      VAL  76   3.826   7.193  -0.210
  602    H    ILE  77           H        ILE  77   3.370   1.696  -0.171
  603    HA   ILE  77           HA       ILE  77   6.123   0.926  -0.830
  604    HB   ILE  77           HB       ILE  77   3.800  -0.842  -0.051
  605   1HG1  ILE  77          2HG1      ILE  77   4.475   0.662   1.776
  606   2HG1  ILE  77          1HG1      ILE  77   4.902  -1.008   2.133
  607   1HG2  ILE  77          1HG2      ILE  77   5.637  -1.857  -1.445
  608   2HG2  ILE  77          2HG2      ILE  77   5.361  -2.617   0.122
  609   3HG2  ILE  77          3HG2      ILE  77   6.729  -1.527  -0.101
  610   1HD1  ILE  77          1HD1      ILE  77   7.098   0.224   0.815
  611   2HD1  ILE  77          2HD1      ILE  77   7.002  -0.409   2.458
  612   3HD1  ILE  77          3HD1      ILE  77   6.564   1.268   2.133
  613    H    VAL  78           H        VAL  78   2.797   0.665  -1.987
  614    HA   VAL  78           HA       VAL  78   1.910  -0.073  -3.970
  615    HB   VAL  78           HB       VAL  78   4.378   1.322  -5.033
  616   1HG1  VAL  78          1HG1      VAL  78   1.725   0.810  -6.374
  617   2HG1  VAL  78          2HG1      VAL  78   3.211  -0.076  -6.703
  618   3HG1  VAL  78          3HG1      VAL  78   3.112   1.644  -7.072
  619   1HG2  VAL  78          1HG2      VAL  78   1.722   2.637  -4.933
  620   2HG2  VAL  78          2HG2      VAL  78   3.337   3.327  -4.777
  621   3HG2  VAL  78          3HG2      VAL  78   2.608   2.473  -3.417
  622    H    ILE  79           H        ILE  79   2.363  -2.324  -3.390
  623    HA   ILE  79           HA       ILE  79   4.629  -3.557  -4.758
  624    HB   ILE  79           HB       ILE  79   2.563  -5.095  -3.221
  625   1HG1  ILE  79          2HG1      ILE  79   4.915  -3.628  -2.010
  626   2HG1  ILE  79          1HG1      ILE  79   3.224  -3.188  -1.798
  627   1HG2  ILE  79          1HG2      ILE  79   4.835  -6.276  -2.614
  628   2HG2  ILE  79          2HG2      ILE  79   5.382  -5.476  -4.087
  629   3HG2  ILE  79          3HG2      ILE  79   4.021  -6.596  -4.145
  630   1HD1  ILE  79          1HD1      ILE  79   4.018  -4.369   0.139
  631   2HD1  ILE  79          2HD1      ILE  79   4.547  -5.722  -0.862
  632   3HD1  ILE  79          3HD1      ILE  79   2.828  -5.358  -0.709
  633    H    THR  80           H        THR  80   4.389  -5.179  -6.338
  634    HA   THR  80           HA       THR  80   1.728  -5.739  -7.357
  635    HB   THR  80           HB       THR  80   1.949  -4.786  -9.456
  636    HG1  THR  80           1HG      THR  80   3.802  -4.547 -10.498
  637   1HG2  THR  80          1HG2      THR  80   1.752  -2.913  -8.021
  638   2HG2  THR  80          2HG2      THR  80   2.945  -2.511  -9.258
  639   3HG2  THR  80          3HG2      THR  80   3.473  -2.951  -7.633
  640    H    GLY  81           H        GLY  81   5.173  -6.040  -8.267
  641   1HA   GLY  81          2HA       GLY  81   6.383  -7.852  -8.994
  642   2HA   GLY  81          1HA       GLY  81   5.412  -8.768  -7.851
  643    H    HIS  82           H        HIS  82   5.984  -8.024 -11.159
  644    HA   HIS  82           HA       HIS  82   4.236 -10.203 -11.954
  645   1HB   HIS  82          2HB       HIS  82   2.861  -8.085 -12.030
  646   2HB   HIS  82          1HB       HIS  82   3.955  -7.504 -13.281
  647    HD1  HIS  82           1HD      HIS  82   1.921 -10.688 -12.746
  648    HD2  HIS  82           2HD      HIS  82   2.914  -7.964 -15.723
  649    HE1  HIS  82           1HE      HIS  82   0.718 -11.477 -14.807
  650    HE2  HIS  82           2HE      HIS  82   1.398  -9.861 -16.616
  651    H    GLY  83           H        GLY  83   6.388  -7.609 -13.084
  652   1HA   GLY  83          2HA       GLY  83   8.310  -9.269 -14.201
  653   2HA   GLY  83          1HA       GLY  83   7.152  -8.927 -15.478
  654    H    SER  84           H        SER  84  10.050  -8.120 -14.837
  655    HA   SER  84           HA       SER  84  11.398  -6.329 -15.219
  656   1HB   SER  84          2HB       SER  84   8.936  -5.721 -16.758
  657   2HB   SER  84          1HB       SER  84  10.024  -4.363 -16.461
  658    HG   SER  84           HG       SER  84  10.781  -6.851 -17.601
  659    H    VAL  85           H        VAL  85  11.251  -3.689 -15.044
  660    HA   VAL  85           HA       VAL  85   9.696  -2.960 -12.683
  661    HB   VAL  85           HB       VAL  85  12.682  -2.521 -12.758
  662   1HG1  VAL  85          1HG1      VAL  85  10.572  -2.045 -10.662
  663   2HG1  VAL  85          2HG1      VAL  85  11.585  -0.845 -11.465
  664   3HG1  VAL  85          3HG1      VAL  85  12.305  -1.994 -10.338
  665   1HG2  VAL  85          1HG2      VAL  85  11.047  -4.721 -11.564
  666   2HG2  VAL  85          2HG2      VAL  85  12.535  -4.198 -10.773
  667   3HG2  VAL  85          3HG2      VAL  85  12.584  -4.806 -12.427
  668    H    ASP  86           H        ASP  86   8.796  -1.871 -14.737
  669    HA   ASP  86           HA       ASP  86  10.223   0.662 -15.210
  670   1HB   ASP  86          2HB       ASP  86   8.749   0.797 -17.277
  671   2HB   ASP  86          1HB       ASP  86   9.973  -0.469 -17.288
  672    H    THR  87           H        THR  87   7.303  -0.773 -14.021
  673    HA   THR  87           HA       THR  87   5.857   1.746 -14.036
  674    HB   THR  87           HB       THR  87   4.884  -0.703 -14.269
  675    HG1  THR  87           1HG      THR  87   3.168   0.467 -14.244
  676   1HG2  THR  87          1HG2      THR  87   5.763  -1.297 -11.923
  677   2HG2  THR  87          2HG2      THR  87   4.118  -1.759 -12.358
  678   3HG2  THR  87          3HG2      THR  87   4.397  -0.346 -11.340
  679    H    ALA  88           H        ALA  88   7.705  -0.258 -11.881
  680    HA   ALA  88           HA       ALA  88   7.010   0.921  -9.426
  681   1HB   ALA  88          1HB       ALA  88   9.123  -0.005  -8.612
  682   2HB   ALA  88          2HB       ALA  88   9.626  -0.322 -10.270
  683   3HB   ALA  88          3HB       ALA  88   8.248  -1.183  -9.588
  684    H    VAL  89           H        VAL  89   9.822   1.462 -11.505
  685    HA   VAL  89           HA       VAL  89  10.871   3.656 -10.149
  686    HB   VAL  89           HB       VAL  89  12.161   4.118 -12.141
  687   1HG1  VAL  89          1HG1      VAL  89  11.784   1.361 -11.185
  688   2HG1  VAL  89          2HG1      VAL  89  13.244   2.345 -11.268
  689   3HG1  VAL  89          3HG1      VAL  89  12.651   1.523 -12.711
  690   1HG2  VAL  89          1HG2      VAL  89  11.701   2.808 -14.238
  691   2HG2  VAL  89          2HG2      VAL  89  10.515   4.059 -13.861
  692   3HG2  VAL  89          3HG2      VAL  89  10.145   2.365 -13.534
  693    H    LYS  90           H        LYS  90   8.210   3.419 -12.373
  694    HA   LYS  90           HA       LYS  90   8.102   6.247 -12.928
  695   1HB   LYS  90          2HB       LYS  90   7.345   4.650 -14.609
  696   2HB   LYS  90          1HB       LYS  90   6.135   4.025 -13.499
  697   1HG   LYS  90          2HG       LYS  90   4.873   6.019 -13.597
  698   2HG   LYS  90          1HG       LYS  90   6.175   6.887 -14.412
  699   1HD   LYS  90          2HD       LYS  90   5.434   4.530 -15.897
  700   2HD   LYS  90          1HD       LYS  90   4.023   5.544 -15.594
  701   1HE   LYS  90          2HE       LYS  90   6.396   7.038 -16.418
  702   2HE   LYS  90          1HE       LYS  90   5.827   5.887 -17.627
  703   1HZ   LYS  90          1HZ       LYS  90   4.867   8.342 -17.404
  704   2HZ   LYS  90          2HZ       LYS  90   3.798   7.546 -16.363
  705   3HZ   LYS  90          3HZ       LYS  90   3.940   7.048 -17.972
  706    H    ALA  91           H        ALA  91   7.187   4.338 -10.313
  707    HA   ALA  91           HA       ALA  91   5.184   6.338  -9.493
  708   1HB   ALA  91          1HB       ALA  91   4.334   4.395  -8.010
  709   2HB   ALA  91          2HB       ALA  91   5.220   3.370  -9.139
  710   3HB   ALA  91          3HB       ALA  91   3.923   4.414  -9.725
  711    H    ILE  92           H        ILE  92   8.031   4.534  -8.592
  712    HA   ILE  92           HA       ILE  92   7.875   5.333  -5.827
  713    HB   ILE  92           HB       ILE  92   9.810   4.081  -5.425
  714   1HG1  ILE  92          2HG1      ILE  92  10.353   4.178  -8.400
  715   2HG1  ILE  92          1HG1      ILE  92  11.281   4.979  -7.137
  716   1HG2  ILE  92          1HG2      ILE  92   9.261   2.106  -7.318
  717   2HG2  ILE  92          2HG2      ILE  92   7.741   2.971  -7.102
  718   3HG2  ILE  92          3HG2      ILE  92   8.558   2.266  -5.709
  719   1HD1  ILE  92          1HD1      ILE  92  12.619   3.204  -7.212
  720   2HD1  ILE  92          2HD1      ILE  92  11.447   2.258  -8.130
  721   3HD1  ILE  92          3HD1      ILE  92  11.333   2.337  -6.372
  722    H    LYS  93           H        LYS  93   9.807   6.252  -8.657
  723    HA   LYS  93           HA       LYS  93  11.579   7.991  -7.392
  724   1HB   LYS  93          2HB       LYS  93  10.652   7.527 -10.126
  725   2HB   LYS  93          1HB       LYS  93  11.108   9.199  -9.831
  726   1HG   LYS  93          2HG       LYS  93  13.183   7.848  -8.691
  727   2HG   LYS  93          1HG       LYS  93  12.768   6.804 -10.051
  728   1HD   LYS  93          2HD       LYS  93  12.789   9.609 -10.798
  729   2HD   LYS  93          1HD       LYS  93  14.339   9.089 -10.135
  730   1HE   LYS  93          2HE       LYS  93  13.195   7.169 -12.004
  731   2HE   LYS  93          1HE       LYS  93  13.487   8.747 -12.732
  732   1HZ   LYS  93          1HZ       LYS  93  15.763   8.399 -11.417
  733   2HZ   LYS  93          2HZ       LYS  93  15.534   7.886 -13.013
  734   3HZ   LYS  93          3HZ       LYS  93  15.385   6.783 -11.739
  735    H    LYS  94           H        LYS  94   8.210   8.327  -8.054
  736    HA   LYS  94           HA       LYS  94   8.024  11.145  -7.994
  737   1HB   LYS  94          2HB       LYS  94   6.252   8.938  -8.224
  738   2HB   LYS  94          1HB       LYS  94   5.640  10.009  -6.971
  739   1HG   LYS  94          2HG       LYS  94   6.523  11.399  -9.382
  740   2HG   LYS  94          1HG       LYS  94   5.188  10.278  -9.646
  741   1HD   LYS  94          2HD       LYS  94   4.159  11.403  -7.547
  742   2HD   LYS  94          1HD       LYS  94   5.308  12.697  -7.887
  743   1HE   LYS  94          2HE       LYS  94   4.158  13.413  -9.679
  744   2HE   LYS  94          1HE       LYS  94   3.800  11.775 -10.224
  745   1HZ   LYS  94          1HZ       LYS  94   2.327  13.427  -8.270
  746   2HZ   LYS  94          2HZ       LYS  94   2.157  11.744  -8.290
  747   3HZ   LYS  94          3HZ       LYS  94   1.742  12.652  -9.656
  748    H    GLY  95           H        GLY  95   8.356   8.748  -5.515
  749   1HA   GLY  95          2HA       GLY  95   9.222  10.189  -3.469
  750   2HA   GLY  95          1HA       GLY  95   7.517  10.603  -3.424
  751    H    ALA  96           H        ALA  96   7.116   7.678  -4.475
  752    HA   ALA  96           HA       ALA  96   6.262   6.548  -2.111
  753   1HB   ALA  96          1HB       ALA  96   5.632   4.794  -3.367
  754   2HB   ALA  96          2HB       ALA  96   7.235   4.594  -4.076
  755   3HB   ALA  96          3HB       ALA  96   6.134   5.813  -4.717
  756    H    TYR  97           H        TYR  97   7.137   4.270  -1.387
  757    HA   TYR  97           HA       TYR  97   9.864   4.743  -0.456
  758   1HB   TYR  97          2HB       TYR  97   8.064   4.250   1.171
  759   2HB   TYR  97          1HB       TYR  97   7.851   2.671   0.425
  760    HD1  TYR  97           1HD      TYR  97  10.404   4.784   2.125
  761    HD2  TYR  97           2HD      TYR  97   9.084   0.849   1.195
  762    HE1  TYR  97           1HE      TYR  97  12.129   3.860   3.614
  763    HE2  TYR  97           2HE      TYR  97  10.804  -0.086   2.681
  764    HH   TYR  97           HH       TYR  97  13.373   1.271   3.605
  765    H    GLU  98           H        GLU  98   9.273   3.826  -3.171
  766    HA   GLU  98           HA       GLU  98  10.232   2.457  -4.712
  767   1HB   GLU  98          2HB       GLU  98  12.311   2.618  -3.523
  768   2HB   GLU  98          1HB       GLU  98  11.776   1.456  -2.325
  769   1HG   GLU  98          2HG       GLU  98  12.608  -0.201  -3.516
  770   2HG   GLU  98          1HG       GLU  98  11.590   0.241  -4.884
  771    H    PHE  99           H        PHE  99   9.659   0.598  -5.701
  772    HA   PHE  99           HA       PHE  99   7.474  -0.845  -4.789
  773   1HB   PHE  99          2HB       PHE  99   9.307  -0.961  -7.042
  774   2HB   PHE  99          1HB       PHE  99   8.765  -2.561  -6.561
  775    HD1  PHE  99           1HD      PHE  99   7.225  -3.236  -8.143
  776    HD2  PHE  99           2HD      PHE  99   6.975   0.704  -6.552
  777    HE1  PHE  99           1HE      PHE  99   5.116  -2.881  -9.362
  778    HE2  PHE  99           2HE      PHE  99   4.866   1.064  -7.768
  779    HZ   PHE  99           HZ       PHE  99   3.934  -0.729  -9.172
  780    H    LEU 100           H        LEU 100   7.204  -2.889  -3.905
  781    HA   LEU 100           HA       LEU 100   9.387  -3.784  -2.232
  782   1HB   LEU 100          2HB       LEU 100   6.860  -3.522  -1.626
  783   2HB   LEU 100          1HB       LEU 100   6.707  -5.104  -2.367
  784    HG   LEU 100           HG       LEU 100   6.934  -5.351   0.017
  785   1HD1  LEU 100          1HD1      LEU 100   7.999  -7.001  -1.489
  786   2HD1  LEU 100          2HD1      LEU 100   8.785  -6.881   0.086
  787   3HD1  LEU 100          3HD1      LEU 100   9.517  -6.118  -1.326
  788   1HD2  LEU 100          1HD2      LEU 100   9.578  -3.924  -0.242
  789   2HD2  LEU 100          2HD2      LEU 100   8.868  -4.575   1.235
  790   3HD2  LEU 100          3HD2      LEU 100   8.107  -3.209   0.419
  791    H    GLU 101           H        GLU 101  10.837  -5.102  -3.128
  792    HA   GLU 101           HA       GLU 101  10.495  -6.636  -5.425
  793   1HB   GLU 101          2HB       GLU 101  12.601  -6.023  -3.782
  794   2HB   GLU 101          1HB       GLU 101  12.406  -7.746  -3.492
  795   1HG   GLU 101          2HG       GLU 101  12.349  -7.886  -6.095
  796   2HG   GLU 101          1HG       GLU 101  13.148  -6.318  -5.997
  797    H    LYS 102           H        LYS 102  11.287  -9.189  -5.001
  798    HA   LYS 102           HA       LYS 102  10.528 -11.282  -4.542
  799   1HB   LYS 102          2HB       LYS 102   9.375  -9.956  -2.081
  800   2HB   LYS 102          1HB       LYS 102   9.510 -11.691  -2.331
  801   1HG   LYS 102          2HG       LYS 102  12.075 -10.861  -2.753
  802   2HG   LYS 102          1HG       LYS 102  11.524  -9.748  -1.500
  803   1HD   LYS 102          2HD       LYS 102  11.097 -11.471   0.012
  804   2HD   LYS 102          1HD       LYS 102  11.046 -12.697  -1.257
  805   1HE   LYS 102          2HE       LYS 102  13.483 -11.226  -0.260
  806   2HE   LYS 102          1HE       LYS 102  13.088 -12.921   0.019
  807   1HZ   LYS 102          1HZ       LYS 102  14.083 -11.617  -2.407
  808   2HZ   LYS 102          2HZ       LYS 102  13.054 -12.949  -2.589
  809   3HZ   LYS 102          3HZ       LYS 102  14.505 -13.112  -1.734
  810    HA   PRO 103           HA       PRO 103   6.432 -10.224  -6.405
  811   1HB   PRO 103          2HB       PRO 103   6.597 -12.153  -8.330
  812   2HB   PRO 103          1HB       PRO 103   7.256 -10.525  -8.522
  813   1HG   PRO 103          2HG       PRO 103   8.658 -13.060  -7.768
  814   2HG   PRO 103          1HG       PRO 103   9.178 -11.782  -8.883
  815   1HD   PRO 103          2HD       PRO 103  10.139 -11.965  -6.372
  816   2HD   PRO 103          1HD       PRO 103   9.881 -10.399  -7.169
  817    H    PHE 104           H        PHE 104   4.495 -11.269  -6.123
  818    HA   PHE 104           HA       PHE 104   3.001 -12.724  -5.214
  819   1HB   PHE 104          2HB       PHE 104   4.670 -14.221  -6.926
  820   2HB   PHE 104          1HB       PHE 104   4.446 -15.199  -5.480
  821    HD1  PHE 104           1HD      PHE 104   3.012 -14.105  -8.551
  822    HD2  PHE 104           2HD      PHE 104   2.060 -15.610  -4.686
  823    HE1  PHE 104           1HE      PHE 104   0.798 -14.796  -9.370
  824    HE2  PHE 104           2HE      PHE 104  -0.156 -16.304  -5.498
  825    HZ   PHE 104           HZ       PHE 104  -0.791 -15.897  -7.843
  826    H    SER 105           H        SER 105   5.157 -11.601  -3.546
  827    HA   SER 105           HA       SER 105   4.650 -13.145  -1.189
  828   1HB   SER 105          2HB       SER 105   7.102 -13.487  -0.665
  829   2HB   SER 105          1HB       SER 105   6.465 -14.509  -1.954
  830    HG   SER 105           HG       SER 105   7.306 -12.840  -3.417
  831    H    VAL 106           H        VAL 106   5.374 -12.078   0.747
  832    HA   VAL 106           HA       VAL 106   6.421  -9.369   0.404
  833    HB   VAL 106           HB       VAL 106   4.700  -8.393   1.836
  834   1HG1  VAL 106          1HG1      VAL 106   3.712  -9.839  -0.608
  835   2HG1  VAL 106          2HG1      VAL 106   4.302  -8.181  -0.491
  836   3HG1  VAL 106          3HG1      VAL 106   2.763  -8.624   0.247
  837   1HG2  VAL 106          1HG2      VAL 106   2.573 -10.081   1.892
  838   2HG2  VAL 106          2HG2      VAL 106   3.692  -9.835   3.232
  839   3HG2  VAL 106          3HG2      VAL 106   3.912 -11.202   2.139
  840    H    GLU 107           H        GLU 107   7.952 -11.379   1.346
  841    HA   GLU 107           HA       GLU 107   7.809 -11.666   4.186
  842   1HB   GLU 107          2HB       GLU 107   8.864 -13.439   3.019
  843   2HB   GLU 107          1HB       GLU 107   9.876 -12.337   2.095
  844   1HG   GLU 107          2HG       GLU 107  11.419 -12.172   3.720
  845   2HG   GLU 107          1HG       GLU 107  10.226 -12.265   5.015
  846    H    ARG 108           H        ARG 108  10.179 -10.057   2.045
  847    HA   ARG 108           HA       ARG 108  11.533  -8.637   4.023
  848   1HB   ARG 108          2HB       ARG 108  11.630  -8.796   1.241
  849   2HB   ARG 108          1HB       ARG 108  11.250  -7.108   1.557
  850   1HG   ARG 108          2HG       ARG 108  13.295  -6.666   2.353
  851   2HG   ARG 108          1HG       ARG 108  13.395  -8.196   3.228
  852   1HD   ARG 108          2HD       ARG 108  13.945  -9.365   1.175
  853   2HD   ARG 108          1HD       ARG 108  13.759  -7.875   0.251
  854    HE   ARG 108           HE       ARG 108  16.023  -8.665   1.841
  855   1HH1  ARG 108          1HH1      ARG 108  14.306  -5.968   0.442
  856   2HH1  ARG 108          2HH1      ARG 108  15.692  -4.931   0.429
  857   1HH2  ARG 108          1HH2      ARG 108  17.848  -7.304   1.822
  858   2HH2  ARG 108          2HH2      ARG 108  17.704  -5.690   1.211
  859    H    PHE 109           H        PHE 109   8.492  -8.082   2.449
  860    HA   PHE 109           HA       PHE 109   8.051  -5.392   3.138
  861   1HB   PHE 109          2HB       PHE 109   6.652  -6.506   1.499
  862   2HB   PHE 109          1HB       PHE 109   6.135  -7.690   2.689
  863    HD1  PHE 109           1HD      PHE 109   5.886  -4.149   1.692
  864    HD2  PHE 109           2HD      PHE 109   4.345  -7.249   4.166
  865    HE1  PHE 109           1HE      PHE 109   3.958  -2.732   2.261
  866    HE2  PHE 109           2HE      PHE 109   2.414  -5.838   4.739
  867    HZ   PHE 109           HZ       PHE 109   2.218  -3.575   3.786
  868    H    LEU 110           H        LEU 110   7.438  -8.437   4.793
  869    HA   LEU 110           HA       LEU 110   5.947  -7.605   6.960
  870   1HB   LEU 110          2HB       LEU 110   6.911  -9.938   6.202
  871   2HB   LEU 110          1HB       LEU 110   8.129  -9.561   7.405
  872    HG   LEU 110           HG       LEU 110   5.203  -9.466   8.070
  873   1HD1  LEU 110          1HD1      LEU 110   5.403 -11.750   8.914
  874   2HD1  LEU 110          2HD1      LEU 110   7.034 -11.855   8.249
  875   3HD1  LEU 110          3HD1      LEU 110   5.650 -11.683   7.169
  876   1HD2  LEU 110          1HD2      LEU 110   7.783  -9.542   9.582
  877   2HD2  LEU 110          2HD2      LEU 110   6.287 -10.102  10.328
  878   3HD2  LEU 110          3HD2      LEU 110   6.418  -8.440   9.755
  879    H    LEU 111           H        LEU 111   9.490  -7.979   6.914
  880    HA   LEU 111           HA       LEU 111   9.895  -6.735   9.416
  881   1HB   LEU 111          2HB       LEU 111  11.862  -7.035   7.149
  882   2HB   LEU 111          1HB       LEU 111  12.256  -6.722   8.828
  883    HG   LEU 111           HG       LEU 111  10.875  -9.016   9.119
  884   1HD1  LEU 111          1HD1      LEU 111  11.756  -8.897   6.300
  885   2HD1  LEU 111          2HD1      LEU 111  10.408  -9.763   7.035
  886   3HD1  LEU 111          3HD1      LEU 111  12.045 -10.407   7.164
  887   1HD2  LEU 111          1HD2      LEU 111  13.231  -8.356   9.827
  888   2HD2  LEU 111          2HD2      LEU 111  13.764  -9.061   8.301
  889   3HD2  LEU 111          3HD2      LEU 111  12.941 -10.065   9.495
  890    H    THR 112           H        THR 112  10.159  -5.507   6.096
  891    HA   THR 112           HA       THR 112  11.137  -2.958   6.716
  892    HB   THR 112           HB       THR 112   9.392  -3.851   4.414
  893    HG1  THR 112           1HG      THR 112  11.167  -4.590   3.605
  894   1HG2  THR 112          1HG2      THR 112  10.334  -1.943   3.189
  895   2HG2  THR 112          2HG2      THR 112  11.051  -1.358   4.690
  896   3HG2  THR 112          3HG2      THR 112   9.297  -1.451   4.528
  897    H    ILE 113           H        ILE 113   7.856  -4.213   6.593
  898    HA   ILE 113           HA       ILE 113   6.345  -1.928   6.660
  899    HB   ILE 113           HB       ILE 113   5.972  -4.673   7.718
  900   1HG1  ILE 113          2HG1      ILE 113   5.410  -4.008   5.398
  901   2HG1  ILE 113          1HG1      ILE 113   4.014  -4.613   6.284
  902   1HG2  ILE 113          1HG2      ILE 113   5.122  -3.519   9.610
  903   2HG2  ILE 113          2HG2      ILE 113   3.734  -4.040   8.655
  904   3HG2  ILE 113          3HG2      ILE 113   4.264  -2.358   8.598
  905   1HD1  ILE 113          1HD1      ILE 113   4.346  -1.724   6.470
  906   2HD1  ILE 113          2HD1      ILE 113   2.919  -2.685   6.081
  907   3HD1  ILE 113          3HD1      ILE 113   4.099  -2.312   4.825
  908    H    LYS 114           H        LYS 114   7.667  -3.623   9.505
  909    HA   LYS 114           HA       LYS 114   6.735  -2.031  11.517
  910   1HB   LYS 114          2HB       LYS 114   8.334  -4.099  11.547
  911   2HB   LYS 114          1HB       LYS 114   9.601  -2.880  11.572
  912   1HG   LYS 114          2HG       LYS 114   7.350  -2.875  13.553
  913   2HG   LYS 114          1HG       LYS 114   8.826  -3.808  13.805
  914   1HD   LYS 114          2HD       LYS 114   8.682  -0.828  13.353
  915   2HD   LYS 114          1HD       LYS 114   8.931  -1.621  14.910
  916   1HE   LYS 114          2HE       LYS 114  10.921  -2.769  13.610
  917   2HE   LYS 114          1HE       LYS 114  10.788  -1.329  12.601
  918   1HZ   LYS 114          1HZ       LYS 114  10.824  -0.904  15.482
  919   2HZ   LYS 114          2HZ       LYS 114  11.536   0.003  14.244
  920   3HZ   LYS 114          3HZ       LYS 114  12.274  -1.420  14.783
  921    H    HIS 115           H        HIS 115   9.817  -1.578   9.803
  922    HA   HIS 115           HA       HIS 115  10.575   0.824  10.924
  923   1HB   HIS 115          2HB       HIS 115  11.503  -0.800   8.892
  924   2HB   HIS 115          1HB       HIS 115  11.174   0.730   8.087
  925    HD1  HIS 115           1HD      HIS 115  12.457   0.452  11.620
  926    HD2  HIS 115           2HD      HIS 115  13.795   1.551   7.842
  927    HE1  HIS 115           1HE      HIS 115  14.725   1.478  11.981
  928    HE2  HIS 115           2HE      HIS 115  15.549   2.059   9.673
  929    H    ALA 116           H        ALA 116   8.294   0.231   8.303
  930    HA   ALA 116           HA       ALA 116   7.990   2.860   7.383
  931   1HB   ALA 116          1HB       ALA 116   5.471   1.525   7.286
  932   2HB   ALA 116          2HB       ALA 116   6.746   0.357   6.944
  933   3HB   ALA 116          3HB       ALA 116   6.616   1.826   5.979
  934    H    PHE 117           H        PHE 117   6.495   1.145  10.070
  935    HA   PHE 117           HA       PHE 117   4.754   3.337  10.750
  936   1HB   PHE 117          2HB       PHE 117   5.329   0.626  11.891
  937   2HB   PHE 117          1HB       PHE 117   4.447   1.810  12.850
  938    HD1  PHE 117           1HD      PHE 117   2.326   2.767  11.916
  939    HD2  PHE 117           2HD      PHE 117   4.257  -0.625  10.225
  940    HE1  PHE 117           1HE      PHE 117   0.230   2.140  10.797
  941    HE2  PHE 117           2HE      PHE 117   2.161  -1.259   9.099
  942    HZ   PHE 117           HZ       PHE 117   0.144   0.127   9.385
  943    H    GLU 118           H        GLU 118   7.992   2.456  11.464
  944    HA   GLU 118           HA       GLU 118   7.996   4.085  13.903
  945   1HB   GLU 118          2HB       GLU 118  10.135   2.255  12.809
  946   2HB   GLU 118          1HB       GLU 118  10.197   3.105  14.347
  947   1HG   GLU 118          2HG       GLU 118   8.061   1.110  13.651
  948   2HG   GLU 118          1HG       GLU 118   9.567   0.680  14.460
  949    H    GLU 119           H        GLU 119  10.289   3.579  11.205
  950    HA   GLU 119           HA       GLU 119  11.249   6.296  11.538
  951   1HB   GLU 119          2HB       GLU 119  12.141   4.051   9.737
  952   2HB   GLU 119          1HB       GLU 119  12.897   5.637   9.779
  953   1HG   GLU 119          2HG       GLU 119  12.651   3.873  12.196
  954   2HG   GLU 119          1HG       GLU 119  14.038   3.838  11.108
  955    H    TYR 120           H        TYR 120   8.524   5.661  10.353
  956    HA   TYR 120           HA       TYR 120   8.713   7.582   8.213
  957   1HB   TYR 120          2HB       TYR 120   8.909   4.934   7.497
  958   2HB   TYR 120          1HB       TYR 120   7.190   5.252   7.314
  959    HD1  TYR 120           1HD      TYR 120   6.752   7.669   6.124
  960    HD2  TYR 120           2HD      TYR 120  10.176   5.200   5.598
  961    HE1  TYR 120           1HE      TYR 120   7.181   8.737   3.951
  962    HE2  TYR 120           2HE      TYR 120  10.617   6.264   3.426
  963    HH   TYR 120           HH       TYR 120   9.920   8.755   2.420
  964    H    SER 121           H        SER 121   7.506   7.696  10.733
  965    HA   SER 121           HA       SER 121   4.874   8.503  10.011
  966   1HB   SER 121          2HB       SER 121   5.256   5.858  11.299
  967   2HB   SER 121          1HB       SER 121   3.976   6.873  11.964
  968    HG   SER 121           HG       SER 121   4.230   6.372   9.192
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -2.480   1.970  16.929
    2   2H    MET   1          2HT       MET   1  -3.656   1.166  17.885
    3   3H    MET   1          3HT       MET   1  -3.673   0.995  16.178
    4    HA   MET   1           HA       MET   1  -1.391   0.177  17.826
    5   1HB   MET   1          2HB       MET   1  -3.861  -1.378  17.039
    6   2HB   MET   1          1HB       MET   1  -2.384  -2.125  17.634
    7   1HG   MET   1          2HG       MET   1  -2.959  -1.750  19.734
    8   2HG   MET   1          1HG       MET   1  -3.224  -0.038  19.415
    9   1HE   MET   1          1HE       MET   1  -6.396  -1.103  21.363
   10   2HE   MET   1          2HE       MET   1  -5.621   0.416  20.909
   11   3HE   MET   1          3HE       MET   1  -4.654  -0.907  21.559
   12    H    LYS   2           H        LYS   2  -1.213   1.520  15.403
   13    HA   LYS   2           HA       LYS   2  -0.208   1.369  13.371
   14   1HB   LYS   2          2HB       LYS   2   0.699  -0.963  14.821
   15   2HB   LYS   2          1HB       LYS   2   0.652  -1.249  13.087
   16   1HG   LYS   2          2HG       LYS   2   2.699  -0.351  13.110
   17   2HG   LYS   2          1HG       LYS   2   1.836   1.186  13.180
   18   1HD   LYS   2          2HD       LYS   2   2.521   1.596  15.272
   19   2HD   LYS   2          1HD       LYS   2   2.187  -0.055  15.797
   20   1HE   LYS   2          2HE       LYS   2   4.355  -0.466  14.241
   21   2HE   LYS   2          1HE       LYS   2   4.693   1.161  14.832
   22   1HZ   LYS   2          1HZ       LYS   2   4.021  -1.133  16.592
   23   2HZ   LYS   2          2HZ       LYS   2   4.554   0.400  17.072
   24   3HZ   LYS   2          3HZ       LYS   2   5.601  -0.640  16.244
   25    H    ARG   3           H        ARG   3  -1.143   1.264  11.440
   26    HA   ARG   3           HA       ARG   3  -2.661  -1.079  10.655
   27   1HB   ARG   3          2HB       ARG   3  -4.646   0.214  10.037
   28   2HB   ARG   3          1HB       ARG   3  -4.344   0.265  11.770
   29   1HG   ARG   3          2HG       ARG   3  -3.262   2.415  10.039
   30   2HG   ARG   3          1HG       ARG   3  -4.976   2.413  10.462
   31   1HD   ARG   3          2HD       ARG   3  -4.300   2.248  12.861
   32   2HD   ARG   3          1HD       ARG   3  -2.627   2.463  12.349
   33    HE   ARG   3           HE       ARG   3  -4.400   4.533  11.432
   34   1HH1  ARG   3          1HH1      ARG   3  -2.358   3.462  14.051
   35   2HH1  ARG   3          2HH1      ARG   3  -2.107   5.057  14.675
   36   1HH2  ARG   3          1HH2      ARG   3  -4.073   6.634  12.251
   37   2HH2  ARG   3          2HH2      ARG   3  -3.082   6.859  13.655
   38    H    VAL   4           H        VAL   4  -2.707  -1.413   8.469
   39    HA   VAL   4           HA       VAL   4  -1.444   0.662   6.794
   40    HB   VAL   4           HB       VAL   4  -1.110  -2.313   6.409
   41   1HG1  VAL   4          1HG1      VAL   4   0.246   0.081   5.183
   42   2HG1  VAL   4          2HG1      VAL   4  -0.778  -1.101   4.373
   43   3HG1  VAL   4          3HG1      VAL   4   0.804  -1.577   4.986
   44   1HG2  VAL   4          1HG2      VAL   4   0.846  -0.382   7.662
   45   2HG2  VAL   4          2HG2      VAL   4   1.112  -2.100   7.362
   46   3HG2  VAL   4          3HG2      VAL   4  -0.096  -1.587   8.540
   47    H    LEU   5           H        LEU   5  -1.969   0.460   4.455
   48    HA   LEU   5           HA       LEU   5  -4.663  -0.663   4.058
   49   1HB   LEU   5          2HB       LEU   5  -4.732   1.768   4.089
   50   2HB   LEU   5          1HB       LEU   5  -3.474   1.844   2.871
   51    HG   LEU   5           HG       LEU   5  -4.982   0.806   1.238
   52   1HD1  LEU   5          1HD1      LEU   5  -7.497   0.916   2.116
   53   2HD1  LEU   5          2HD1      LEU   5  -6.694   0.515   3.634
   54   3HD1  LEU   5          3HD1      LEU   5  -6.509  -0.540   2.233
   55   1HD2  LEU   5          1HD2      LEU   5  -6.803   2.884   2.029
   56   2HD2  LEU   5          2HD2      LEU   5  -5.656   2.847   0.689
   57   3HD2  LEU   5          3HD2      LEU   5  -5.136   3.400   2.281
   58    H    VAL   6           H        VAL   6  -4.751  -2.227   2.608
   59    HA   VAL   6           HA       VAL   6  -2.541  -2.493   0.685
   60    HB   VAL   6           HB       VAL   6  -4.618  -4.556   1.432
   61   1HG1  VAL   6          1HG1      VAL   6  -2.304  -4.513  -0.420
   62   2HG1  VAL   6          2HG1      VAL   6  -3.849  -5.351  -0.554
   63   3HG1  VAL   6          3HG1      VAL   6  -2.587  -5.993   0.497
   64   1HG2  VAL   6          1HG2      VAL   6  -3.352  -5.274   3.146
   65   2HG2  VAL   6          2HG2      VAL   6  -2.708  -3.633   3.116
   66   3HG2  VAL   6          3HG2      VAL   6  -1.839  -4.935   2.306
   67    H    VAL   7           H        VAL   7  -2.881  -1.982  -1.393
   68    HA   VAL   7           HA       VAL   7  -5.672  -1.914  -2.330
   69    HB   VAL   7           HB       VAL   7  -3.326  -0.383  -3.466
   70   1HG1  VAL   7          1HG1      VAL   7  -6.249  -0.471  -4.126
   71   2HG1  VAL   7          2HG1      VAL   7  -4.864  -0.637  -5.204
   72   3HG1  VAL   7          3HG1      VAL   7  -5.260   0.936  -4.514
   73   1HG2  VAL   7          1HG2      VAL   7  -4.459   0.141  -1.077
   74   2HG2  VAL   7          2HG2      VAL   7  -5.526   1.058  -2.142
   75   3HG2  VAL   7          3HG2      VAL   7  -3.793   1.380  -2.140
   76    H    ASP   8           H        ASP   8  -6.086  -3.764  -3.344
   77    HA   ASP   8           HA       ASP   8  -4.147  -4.696  -5.359
   78   1HB   ASP   8          2HB       ASP   8  -4.143  -6.507  -3.959
   79   2HB   ASP   8          1HB       ASP   8  -5.744  -6.159  -3.321
   80    H    ASP   9           H        ASP   9  -5.024  -5.514  -7.327
   81    HA   ASP   9           HA       ASP   9  -7.380  -4.104  -8.173
   82   1HB   ASP   9          2HB       ASP   9  -5.401  -4.213  -9.619
   83   2HB   ASP   9          1HB       ASP   9  -5.566  -5.961  -9.723
   84    H    GLU  10           H        GLU  10  -8.223  -5.826  -6.313
   85    HA   GLU  10           HA       GLU  10  -9.805  -7.396  -5.880
   86   1HB   GLU  10          2HB       GLU  10 -10.330  -6.571  -8.658
   87   2HB   GLU  10          1HB       GLU  10 -11.010  -8.130  -8.209
   88   1HG   GLU  10          2HG       GLU  10 -12.144  -7.080  -6.311
   89   2HG   GLU  10          1HG       GLU  10 -11.480  -5.518  -6.788
   90    H    GLU  11           H        GLU  11  -9.233  -9.344  -5.279
   91    HA   GLU  11           HA       GLU  11  -8.990 -11.559  -6.917
   92   1HB   GLU  11          2HB       GLU  11  -6.710 -10.016  -7.190
   93   2HB   GLU  11          1HB       GLU  11  -6.234 -11.210  -5.990
   94   1HG   GLU  11          2HG       GLU  11  -7.598 -12.106  -8.482
   95   2HG   GLU  11          1HG       GLU  11  -5.892 -11.664  -8.533
   96    H    SER  12           H        SER  12 -10.152 -10.864  -4.462
   97    HA   SER  12           HA       SER  12 -10.498 -11.654  -2.355
   98   1HB   SER  12          2HB       SER  12 -10.582 -13.836  -3.390
   99   2HB   SER  12          1HB       SER  12  -8.822 -13.930  -3.441
  100    HG   SER  12           HG       SER  12  -8.809 -14.013  -1.185
  101    H    ILE  13           H        ILE  13  -8.848  -9.697  -2.163
  102    HA   ILE  13           HA       ILE  13  -7.165  -8.708  -0.998
  103    HB   ILE  13           HB       ILE  13  -7.361 -11.253   0.565
  104   1HG1  ILE  13          2HG1      ILE  13  -9.453  -9.841   0.307
  105   2HG1  ILE  13          1HG1      ILE  13  -8.959 -10.205   1.957
  106   1HG2  ILE  13          1HG2      ILE  13  -5.324 -10.292   1.229
  107   2HG2  ILE  13          2HG2      ILE  13  -6.489  -9.828   2.468
  108   3HG2  ILE  13          3HG2      ILE  13  -6.008  -8.666   1.232
  109   1HD1  ILE  13          1HD1      ILE  13  -7.979  -7.686   0.744
  110   2HD1  ILE  13          2HD1      ILE  13  -8.413  -8.051   2.414
  111   3HD1  ILE  13          3HD1      ILE  13  -9.677  -7.782   1.214
  112    H    THR  14           H        THR  14  -4.854  -9.018  -0.261
  113    HA   THR  14           HA       THR  14  -3.416 -10.435  -2.328
  114    HB   THR  14           HB       THR  14  -1.538  -9.192  -1.710
  115    HG1  THR  14           1HG      THR  14  -1.041  -9.294   0.311
  116   1HG2  THR  14          1HG2      THR  14  -3.387  -7.670  -2.400
  117   2HG2  THR  14          2HG2      THR  14  -2.162  -6.919  -1.378
  118   3HG2  THR  14          3HG2      THR  14  -3.717  -7.386  -0.691
  119    H    SER  15           H        SER  15  -2.847 -12.494  -2.114
  120    HA   SER  15           HA       SER  15  -3.335 -14.055   0.103
  121   1HB   SER  15          2HB       SER  15  -1.693 -14.400  -2.361
  122   2HB   SER  15          1HB       SER  15  -1.523 -15.589  -1.070
  123    HG   SER  15           HG       SER  15  -3.191 -16.008  -2.709
  124    H    SER  16           H        SER  16  -2.140 -14.973   1.703
  125    HA   SER  16           HA       SER  16  -0.568 -15.190   3.311
  126   1HB   SER  16          2HB       SER  16   0.929 -15.791   1.482
  127   2HB   SER  16          1HB       SER  16   1.292 -14.090   1.200
  128    HG   SER  16           HG       SER  16   2.132 -14.045   3.370
  129    H    LEU  17           H        LEU  17  -1.849 -12.375   2.559
  130    HA   LEU  17           HA       LEU  17   0.019 -10.666   4.004
  131   1HB   LEU  17          2HB       LEU  17  -1.700 -10.172   1.954
  132   2HB   LEU  17          1HB       LEU  17  -2.664  -9.637   3.308
  133    HG   LEU  17           HG       LEU  17  -0.583  -8.257   1.920
  134   1HD1  LEU  17          1HD1      LEU  17  -2.400  -6.978   2.360
  135   2HD1  LEU  17          2HD1      LEU  17  -1.381  -6.494   3.714
  136   3HD1  LEU  17          3HD1      LEU  17  -2.658  -7.686   3.953
  137   1HD2  LEU  17          1HD2      LEU  17   0.537  -7.350   4.040
  138   2HD2  LEU  17          2HD2      LEU  17   1.097  -8.898   3.409
  139   3HD2  LEU  17          3HD2      LEU  17   0.014  -8.853   4.800
  140    H    SER  18           H        SER  18  -3.370 -11.696   4.286
  141    HA   SER  18           HA       SER  18  -4.032 -10.553   6.695
  142   1HB   SER  18          2HB       SER  18  -5.566 -11.840   5.177
  143   2HB   SER  18          1HB       SER  18  -4.881 -13.326   5.835
  144    HG   SER  18           HG       SER  18  -6.504 -13.033   7.185
  145    H    ALA  19           H        ALA  19  -2.710 -13.839   6.250
  146    HA   ALA  19           HA       ALA  19  -2.475 -14.512   8.939
  147   1HB   ALA  19          1HB       ALA  19  -2.119 -15.940   6.806
  148   2HB   ALA  19          2HB       ALA  19  -1.197 -16.322   8.260
  149   3HB   ALA  19          3HB       ALA  19  -0.438 -15.424   6.946
  150    H    ILE  20           H        ILE  20  -0.225 -12.797   6.827
  151    HA   ILE  20           HA       ILE  20   1.942 -12.655   8.613
  152    HB   ILE  20           HB       ILE  20   1.117 -10.957   6.265
  153   1HG1  ILE  20          2HG1      ILE  20   3.488 -12.777   6.697
  154   2HG1  ILE  20          1HG1      ILE  20   1.992 -13.257   5.902
  155   1HG2  ILE  20          1HG2      ILE  20   3.263 -10.439   8.253
  156   2HG2  ILE  20          2HG2      ILE  20   2.280  -9.305   7.324
  157   3HG2  ILE  20          3HG2      ILE  20   3.621 -10.150   6.549
  158   1HD1  ILE  20          1HD1      ILE  20   4.036 -11.273   4.969
  159   2HD1  ILE  20          2HD1      ILE  20   2.423 -11.384   4.264
  160   3HD1  ILE  20          3HD1      ILE  20   3.514 -12.766   4.188
  161    H    LEU  21           H        LEU  21  -0.255  -9.983   7.730
  162    HA   LEU  21           HA       LEU  21   0.431  -8.214   9.717
  163   1HB   LEU  21          2HB       LEU  21  -2.370  -8.650   8.700
  164   2HB   LEU  21          1HB       LEU  21  -1.707  -7.169   9.371
  165    HG   LEU  21           HG       LEU  21  -0.171  -8.122   7.091
  166   1HD1  LEU  21          1HD1      LEU  21  -1.729  -8.503   5.569
  167   2HD1  LEU  21          2HD1      LEU  21  -2.549  -6.993   5.963
  168   3HD1  LEU  21          3HD1      LEU  21  -2.941  -8.467   6.847
  169   1HD2  LEU  21          1HD2      LEU  21  -1.349  -5.608   8.130
  170   2HD2  LEU  21          2HD2      LEU  21  -0.946  -5.688   6.414
  171   3HD2  LEU  21          3HD2      LEU  21   0.304  -5.967   7.628
  172    H    GLU  22           H        GLU  22  -1.518 -11.090   9.951
  173    HA   GLU  22           HA       GLU  22  -2.689 -10.489  12.483
  174   1HB   GLU  22          2HB       GLU  22  -2.488 -12.919  10.764
  175   2HB   GLU  22          1HB       GLU  22  -2.993 -13.091  12.440
  176   1HG   GLU  22          2HG       GLU  22  -4.758 -11.361  11.963
  177   2HG   GLU  22          1HG       GLU  22  -4.338 -11.527  10.259
  178    H    GLU  23           H        GLU  23   0.316 -11.890  11.425
  179    HA   GLU  23           HA       GLU  23   0.957 -13.013  14.005
  180   1HB   GLU  23          2HB       GLU  23   1.892 -14.192  12.192
  181   2HB   GLU  23          1HB       GLU  23   2.428 -12.719  11.396
  182   1HG   GLU  23          2HG       GLU  23   4.377 -12.723  12.461
  183   2HG   GLU  23          1HG       GLU  23   3.629 -13.088  14.016
  184    H    GLU  24           H        GLU  24   1.634 -10.113  12.169
  185    HA   GLU  24           HA       GLU  24   3.526  -9.126  14.126
  186   1HB   GLU  24          2HB       GLU  24   2.561  -8.238  11.465
  187   2HB   GLU  24          1HB       GLU  24   3.202  -7.017  12.555
  188   1HG   GLU  24          2HG       GLU  24   4.671  -9.508  11.731
  189   2HG   GLU  24          1HG       GLU  24   4.871  -7.927  10.978
  190    H    GLY  25           H        GLY  25   0.174  -8.703  13.256
  191   1HA   GLY  25          2HA       GLY  25  -1.496  -7.880  14.678
  192   2HA   GLY  25          1HA       GLY  25  -0.248  -7.192  15.705
  193    H    TYR  26           H        TYR  26  -1.360  -6.824  12.335
  194    HA   TYR  26           HA       TYR  26  -1.158  -3.908  12.702
  195   1HB   TYR  26          2HB       TYR  26  -0.721  -5.659  10.300
  196   2HB   TYR  26          1HB       TYR  26  -1.094  -3.952  10.112
  197    HD1  TYR  26           1HD      TYR  26   0.426  -2.289  11.390
  198    HD2  TYR  26           2HD      TYR  26   1.487  -6.333  10.604
  199    HE1  TYR  26           1HE      TYR  26   2.794  -1.725  11.721
  200    HE2  TYR  26           2HE      TYR  26   3.861  -5.779  10.933
  201    HH   TYR  26           HH       TYR  26   4.910  -2.976  12.384
  202    H    HIS  27           H        HIS  27  -2.593  -2.940  10.672
  203    HA   HIS  27           HA       HIS  27  -5.258  -4.144  10.885
  204   1HB   HIS  27          2HB       HIS  27  -4.408  -1.673  12.035
  205   2HB   HIS  27          1HB       HIS  27  -5.532  -1.315  10.732
  206    HD1  HIS  27           1HD      HIS  27  -5.336  -2.873  14.110
  207    HD2  HIS  27           2HD      HIS  27  -8.177  -2.181  11.158
  208    HE1  HIS  27           1HE      HIS  27  -7.557  -3.333  15.194
  209    HE2  HIS  27           2HE      HIS  27  -9.253  -3.008  13.360
  210    HA   PRO  28           HA       PRO  28  -4.418  -3.171   6.481
  211   1HB   PRO  28          2HB       PRO  28  -4.984  -5.569   5.460
  212   2HB   PRO  28          1HB       PRO  28  -3.442  -5.268   6.270
  213   1HG   PRO  28          2HG       PRO  28  -5.875  -6.670   7.287
  214   2HG   PRO  28          1HG       PRO  28  -4.167  -7.068   7.534
  215   1HD   PRO  28          2HD       PRO  28  -5.782  -5.706   9.344
  216   2HD   PRO  28          1HD       PRO  28  -4.009  -5.701   9.350
  217    H    ASP  29           H        ASP  29  -6.072  -1.960   5.666
  218    HA   ASP  29           HA       ASP  29  -8.776  -2.941   6.014
  219   1HB   ASP  29          2HB       ASP  29  -8.034  -0.539   6.560
  220   2HB   ASP  29          1HB       ASP  29  -8.109  -0.290   4.818
  221    H    THR  30           H        THR  30  -6.458  -3.037   3.765
  222    HA   THR  30           HA       THR  30  -6.333  -3.496   1.551
  223    HB   THR  30           HB       THR  30  -7.913  -5.181   0.750
  224    HG1  THR  30           1HG      THR  30  -9.789  -4.246   1.753
  225   1HG2  THR  30          1HG2      THR  30  -6.763  -6.656   1.921
  226   2HG2  THR  30          2HG2      THR  30  -7.825  -6.377   3.301
  227   3HG2  THR  30          3HG2      THR  30  -6.355  -5.421   3.112
  228    H    ALA  31           H        ALA  31  -7.604  -3.505  -0.592
  229    HA   ALA  31           HA       ALA  31  -9.778  -1.633  -0.809
  230   1HB   ALA  31          1HB       ALA  31  -7.326  -0.481  -0.696
  231   2HB   ALA  31          2HB       ALA  31  -8.708   0.203  -1.553
  232   3HB   ALA  31          3HB       ALA  31  -7.499  -0.733  -2.433
  233    H    LYS  32           H        LYS  32  -9.158  -0.990  -3.602
  234    HA   LYS  32           HA       LYS  32  -9.037  -3.613  -4.883
  235   1HB   LYS  32          2HB       LYS  32 -11.239  -1.788  -5.749
  236   2HB   LYS  32          1HB       LYS  32 -11.116  -3.536  -5.893
  237   1HG   LYS  32          2HG       LYS  32 -11.647  -3.839  -3.592
  238   2HG   LYS  32          1HG       LYS  32 -11.520  -2.107  -3.279
  239   1HD   LYS  32          2HD       LYS  32 -13.486  -1.641  -4.503
  240   2HD   LYS  32          1HD       LYS  32 -13.505  -3.250  -5.229
  241   1HE   LYS  32          2HE       LYS  32 -14.089  -4.263  -3.152
  242   2HE   LYS  32          1HE       LYS  32 -13.814  -2.758  -2.274
  243   1HZ   LYS  32          1HZ       LYS  32 -15.875  -2.998  -4.386
  244   2HZ   LYS  32          2HZ       LYS  32 -15.726  -1.800  -3.202
  245   3HZ   LYS  32          3HZ       LYS  32 -16.199  -3.364  -2.767
  246    H    THR  33           H        THR  33  -9.306  -0.107  -5.318
  247    HA   THR  33           HA       THR  33  -7.270  -0.233  -7.378
  248    HB   THR  33           HB       THR  33  -9.500   1.435  -8.279
  249    HG1  THR  33           1HG      THR  33  -9.849  -1.379  -8.244
  250   1HG2  THR  33          1HG2      THR  33  -7.747   1.035  -9.805
  251   2HG2  THR  33          2HG2      THR  33  -9.137   0.114 -10.380
  252   3HG2  THR  33          3HG2      THR  33  -7.820  -0.707  -9.543
  253    H    LEU  34           H        LEU  34  -6.745   2.063  -8.152
  254    HA   LEU  34           HA       LEU  34  -6.100   3.621  -5.910
  255   1HB   LEU  34          2HB       LEU  34  -6.219   4.514  -8.792
  256   2HB   LEU  34          1HB       LEU  34  -5.328   5.297  -7.500
  257    HG   LEU  34           HG       LEU  34  -4.756   2.488  -8.438
  258   1HD1  LEU  34          1HD1      LEU  34  -3.240   3.237  -9.962
  259   2HD1  LEU  34          2HD1      LEU  34  -2.967   4.758  -9.112
  260   3HD1  LEU  34          3HD1      LEU  34  -4.427   4.536 -10.076
  261   1HD2  LEU  34          1HD2      LEU  34  -4.038   3.691  -6.112
  262   2HD2  LEU  34          2HD2      LEU  34  -2.682   4.123  -7.154
  263   3HD2  LEU  34          3HD2      LEU  34  -3.106   2.427  -6.914
  264    H    ARG  35           H        ARG  35  -8.893   3.565  -7.964
  265    HA   ARG  35           HA       ARG  35  -9.880   6.144  -7.176
  266   1HB   ARG  35          2HB       ARG  35 -11.533   3.890  -8.305
  267   2HB   ARG  35          1HB       ARG  35 -11.832   5.618  -8.423
  268   1HG   ARG  35          2HG       ARG  35  -9.356   4.479  -9.633
  269   2HG   ARG  35          1HG       ARG  35 -10.902   4.287 -10.462
  270   1HD   ARG  35          2HD       ARG  35 -11.172   6.580 -10.749
  271   2HD   ARG  35          1HD       ARG  35 -10.021   6.972  -9.473
  272    HE   ARG  35           HE       ARG  35  -8.478   5.730 -11.300
  273   1HH1  ARG  35          1HH1      ARG  35 -10.763   8.357 -11.540
  274   2HH1  ARG  35          2HH1      ARG  35  -9.942   9.115 -12.863
  275   1HH2  ARG  35          1HH2      ARG  35  -7.399   6.724 -13.040
  276   2HH2  ARG  35          2HH2      ARG  35  -8.032   8.187 -13.715
  277    H    GLU  36           H        GLU  36 -10.500   2.783  -6.280
  278    HA   GLU  36           HA       GLU  36 -12.483   3.430  -4.322
  279   1HB   GLU  36          2HB       GLU  36 -11.796   1.139  -5.628
  280   2HB   GLU  36          1HB       GLU  36 -11.057   0.860  -4.057
  281   1HG   GLU  36          2HG       GLU  36 -13.040   0.103  -3.417
  282   2HG   GLU  36          1HG       GLU  36 -13.560   1.787  -3.406
  283    H    ALA  37           H        ALA  37  -9.023   3.181  -4.370
  284    HA   ALA  37           HA       ALA  37  -8.708   2.906  -1.532
  285   1HB   ALA  37          1HB       ALA  37  -6.356   3.173  -1.932
  286   2HB   ALA  37          2HB       ALA  37  -6.657   3.822  -3.545
  287   3HB   ALA  37          3HB       ALA  37  -7.015   2.131  -3.194
  288    H    GLU  38           H        GLU  38  -8.843   5.553  -3.830
  289    HA   GLU  38           HA       GLU  38  -7.946   7.554  -2.015
  290   1HB   GLU  38          2HB       GLU  38  -9.403   7.611  -4.637
  291   2HB   GLU  38          1HB       GLU  38  -9.193   9.081  -3.695
  292   1HG   GLU  38          2HG       GLU  38  -6.732   8.647  -3.729
  293   2HG   GLU  38          1HG       GLU  38  -7.043   7.335  -4.860
  294    H    LYS  39           H        LYS  39 -11.089   6.292  -2.992
  295    HA   LYS  39           HA       LYS  39 -12.682   8.105  -1.547
  296   1HB   LYS  39          2HB       LYS  39 -13.657   6.681  -3.250
  297   2HB   LYS  39          1HB       LYS  39 -13.195   5.237  -2.362
  298   1HG   LYS  39          2HG       LYS  39 -14.969   7.217  -1.030
  299   2HG   LYS  39          1HG       LYS  39 -15.646   6.167  -2.277
  300   1HD   LYS  39          2HD       LYS  39 -14.449   4.277  -0.931
  301   2HD   LYS  39          1HD       LYS  39 -14.485   5.453   0.384
  302   1HE   LYS  39          2HE       LYS  39 -16.965   5.686  -0.081
  303   2HE   LYS  39          1HE       LYS  39 -16.809   4.263  -1.112
  304   1HZ   LYS  39          1HZ       LYS  39 -15.884   4.217   1.692
  305   2HZ   LYS  39          2HZ       LYS  39 -16.295   2.918   0.691
  306   3HZ   LYS  39          3HZ       LYS  39 -17.505   3.928   1.308
  307    H    LYS  40           H        LYS  40 -11.097   5.081  -0.676
  308    HA   LYS  40           HA       LYS  40 -12.272   4.897   1.919
  309   1HB   LYS  40          2HB       LYS  40  -9.830   3.602   0.711
  310   2HB   LYS  40          1HB       LYS  40 -10.432   3.235   2.322
  311   1HG   LYS  40          2HG       LYS  40 -12.332   3.020   0.056
  312   2HG   LYS  40          1HG       LYS  40 -11.082   1.784   0.212
  313   1HD   LYS  40          2HD       LYS  40 -12.578   2.509   2.665
  314   2HD   LYS  40          1HD       LYS  40 -13.454   1.606   1.428
  315   1HE   LYS  40          2HE       LYS  40 -11.462   0.011   1.429
  316   2HE   LYS  40          1HE       LYS  40 -10.971   0.810   2.921
  317   1HZ   LYS  40          1HZ       LYS  40 -13.388   0.281   3.636
  318   2HZ   LYS  40          2HZ       LYS  40 -12.217  -0.939   3.695
  319   3HZ   LYS  40          3HZ       LYS  40 -13.319  -0.885   2.412
  320    H    ILE  41           H        ILE  41  -9.122   6.001   0.705
  321    HA   ILE  41           HA       ILE  41  -8.103   6.718   3.255
  322    HB   ILE  41           HB       ILE  41  -7.263   7.775   0.556
  323   1HG1  ILE  41          2HG1      ILE  41  -5.760   5.627   1.974
  324   2HG1  ILE  41          1HG1      ILE  41  -7.259   5.173   1.171
  325   1HG2  ILE  41          1HG2      ILE  41  -5.149   7.542   2.474
  326   2HG2  ILE  41          2HG2      ILE  41  -6.460   8.510   3.149
  327   3HG2  ILE  41          3HG2      ILE  41  -5.722   8.972   1.615
  328   1HD1  ILE  41          1HD1      ILE  41  -6.307   6.299  -0.895
  329   2HD1  ILE  41          2HD1      ILE  41  -5.565   4.780  -0.392
  330   3HD1  ILE  41          3HD1      ILE  41  -4.766   6.312  -0.039
  331    H    LYS  42           H        LYS  42 -10.117   8.346   0.928
  332    HA   LYS  42           HA       LYS  42  -9.782  11.000   1.485
  333   1HB   LYS  42          2HB       LYS  42 -11.491   9.718  -0.047
  334   2HB   LYS  42          1HB       LYS  42 -12.569   9.971   1.317
  335   1HG   LYS  42          2HG       LYS  42 -12.172  12.381   1.175
  336   2HG   LYS  42          1HG       LYS  42 -11.113  12.115  -0.211
  337   1HD   LYS  42          2HD       LYS  42 -13.263  12.770  -1.036
  338   2HD   LYS  42          1HD       LYS  42 -13.043  11.056  -1.389
  339   1HE   LYS  42          2HE       LYS  42 -14.261  11.424   1.199
  340   2HE   LYS  42          1HE       LYS  42 -15.186  12.254  -0.051
  341   1HZ   LYS  42          1HZ       LYS  42 -14.766   9.412   0.364
  342   2HZ   LYS  42          2HZ       LYS  42 -14.727   9.926  -1.246
  343   3HZ   LYS  42          3HZ       LYS  42 -16.094  10.227  -0.294
  344    H    GLU  43           H        GLU  43 -11.218   8.571   3.523
  345    HA   GLU  43           HA       GLU  43 -11.798  10.635   5.533
  346   1HB   GLU  43          2HB       GLU  43 -13.087   7.917   5.249
  347   2HB   GLU  43          1HB       GLU  43 -13.481   9.125   6.464
  348   1HG   GLU  43          2HG       GLU  43 -14.576  10.478   4.965
  349   2HG   GLU  43          1HG       GLU  43 -13.693   9.837   3.580
  350    H    LEU  44           H        LEU  44 -10.633   7.327   5.046
  351    HA   LEU  44           HA       LEU  44  -9.675   7.112   7.757
  352   1HB   LEU  44          2HB       LEU  44 -10.036   5.353   5.480
  353   2HB   LEU  44          1HB       LEU  44  -8.477   5.097   6.240
  354    HG   LEU  44           HG       LEU  44 -10.221   3.591   7.114
  355   1HD1  LEU  44          1HD1      LEU  44  -8.308   4.217   8.507
  356   2HD1  LEU  44          2HD1      LEU  44  -9.758   3.947   9.473
  357   3HD1  LEU  44          3HD1      LEU  44  -9.219   5.592   9.135
  358   1HD2  LEU  44          1HD2      LEU  44 -12.103   4.344   8.283
  359   2HD2  LEU  44          2HD2      LEU  44 -12.038   5.369   6.850
  360   3HD2  LEU  44          3HD2      LEU  44 -11.481   5.990   8.404
  361    H    PHE  45           H        PHE  45  -7.918   8.166   8.394
  362    HA   PHE  45           HA       PHE  45  -5.934   9.101   6.553
  363   1HB   PHE  45          2HB       PHE  45  -6.543  10.379   8.573
  364   2HB   PHE  45          1HB       PHE  45  -5.906   9.082   9.580
  365    HD1  PHE  45           1HD      PHE  45  -4.900  11.478   6.920
  366    HD2  PHE  45           2HD      PHE  45  -3.690   9.121  10.250
  367    HE1  PHE  45           1HE      PHE  45  -2.673  12.522   6.846
  368    HE2  PHE  45           2HE      PHE  45  -1.462  10.162  10.183
  369    HZ   PHE  45           HZ       PHE  45  -0.950  11.866   8.479
  370    H    PHE  46           H        PHE  46  -5.691   6.712   5.841
  371    HA   PHE  46           HA       PHE  46  -4.327   4.824   7.357
  372   1HB   PHE  46          2HB       PHE  46  -4.409   5.360   4.395
  373   2HB   PHE  46          1HB       PHE  46  -3.467   4.033   5.062
  374    HD1  PHE  46           1HD      PHE  46  -6.497   4.851   3.624
  375    HD2  PHE  46           2HD      PHE  46  -4.879   2.567   6.830
  376    HE1  PHE  46           1HE      PHE  46  -8.504   3.428   3.617
  377    HE2  PHE  46           2HE      PHE  46  -6.883   1.139   6.828
  378    HZ   PHE  46           HZ       PHE  46  -8.699   1.572   5.222
  379    HA   PRO  47           HA       PRO  47  -0.365   6.885   7.698
  380   1HB   PRO  47          2HB       PRO  47   0.910   5.008   9.142
  381   2HB   PRO  47          1HB       PRO  47  -0.341   6.038   9.850
  382   1HG   PRO  47          2HG       PRO  47  -0.538   3.228   8.857
  383   2HG   PRO  47          1HG       PRO  47  -1.215   3.938  10.331
  384   1HD   PRO  47          2HD       PRO  47  -2.670   3.520   8.057
  385   2HD   PRO  47          1HD       PRO  47  -3.031   4.808   9.224
  386    H    VAL  48           H        VAL  48  -0.695   3.524   6.652
  387    HA   VAL  48           HA       VAL  48   1.609   3.910   4.864
  388    HB   VAL  48           HB       VAL  48   0.907   1.339   6.265
  389   1HG1  VAL  48          1HG1      VAL  48   2.327   1.664   3.971
  390   2HG1  VAL  48          2HG1      VAL  48   2.554   0.338   5.112
  391   3HG1  VAL  48          3HG1      VAL  48   3.602   1.755   5.186
  392   1HG2  VAL  48          1HG2      VAL  48   1.786   2.293   8.058
  393   2HG2  VAL  48          2HG2      VAL  48   2.407   3.661   7.135
  394   3HG2  VAL  48          3HG2      VAL  48   3.334   2.163   7.222
  395    H    ILE  49           H        ILE  49   0.815   3.957   2.853
  396    HA   ILE  49           HA       ILE  49  -1.487   2.261   2.189
  397    HB   ILE  49           HB       ILE  49  -0.256   4.077   0.167
  398   1HG1  ILE  49          2HG1      ILE  49  -0.285   5.460   2.193
  399   2HG1  ILE  49          1HG1      ILE  49  -1.499   6.008   1.044
  400   1HG2  ILE  49          1HG2      ILE  49  -2.867   2.838   0.737
  401   2HG2  ILE  49          2HG2      ILE  49  -2.069   3.154  -0.803
  402   3HG2  ILE  49          3HG2      ILE  49  -2.912   4.455   0.036
  403   1HD1  ILE  49          1HD1      ILE  49  -1.968   5.656   3.657
  404   2HD1  ILE  49          2HD1      ILE  49  -2.417   4.061   3.051
  405   3HD1  ILE  49          3HD1      ILE  49  -3.209   5.501   2.413
  406    H    VAL  50           H        VAL  50  -1.423   0.635   0.604
  407    HA   VAL  50           HA       VAL  50   1.211   0.064  -0.565
  408    HB   VAL  50           HB       VAL  50  -0.692  -2.088   0.346
  409   1HG1  VAL  50          1HG1      VAL  50   1.805  -3.141   0.410
  410   2HG1  VAL  50          2HG1      VAL  50   1.950  -1.998  -0.923
  411   3HG1  VAL  50          3HG1      VAL  50   0.709  -3.248  -0.967
  412   1HG2  VAL  50          1HG2      VAL  50   0.536  -2.361   2.369
  413   2HG2  VAL  50          2HG2      VAL  50   0.067  -0.664   2.266
  414   3HG2  VAL  50          3HG2      VAL  50   1.719  -1.148   1.884
  415    H    LEU  51           H        LEU  51   0.994  -1.445  -2.501
  416    HA   LEU  51           HA       LEU  51  -1.622  -1.287  -3.788
  417   1HB   LEU  51          2HB       LEU  51  -0.182   0.717  -4.424
  418   2HB   LEU  51          1HB       LEU  51   0.850  -0.422  -5.268
  419    HG   LEU  51           HG       LEU  51  -0.982  -1.049  -6.740
  420   1HD1  LEU  51          1HD1      LEU  51  -2.887  -0.854  -5.350
  421   2HD1  LEU  51          2HD1      LEU  51  -3.088   0.327  -6.644
  422   3HD1  LEU  51          3HD1      LEU  51  -2.575   0.854  -5.040
  423   1HD2  LEU  51          1HD2      LEU  51  -0.544   1.923  -6.496
  424   2HD2  LEU  51          2HD2      LEU  51  -1.284   1.131  -7.888
  425   3HD2  LEU  51          3HD2      LEU  51   0.391   0.783  -7.463
  426    H    ASP  52           H        ASP  52  -1.842  -2.655  -5.647
  427    HA   ASP  52           HA       ASP  52   0.193  -4.722  -5.996
  428   1HB   ASP  52          2HB       ASP  52  -2.050  -5.146  -4.392
  429   2HB   ASP  52          1HB       ASP  52  -2.481  -5.881  -5.931
  430    H    VAL  53           H        VAL  53   0.451  -3.550  -7.996
  431    HA   VAL  53           HA       VAL  53  -1.626  -3.187  -9.863
  432    HB   VAL  53           HB       VAL  53   0.161  -2.826 -11.521
  433   1HG1  VAL  53          1HG1      VAL  53  -0.177  -0.830 -10.517
  434   2HG1  VAL  53          2HG1      VAL  53   1.455  -1.112  -9.913
  435   3HG1  VAL  53          3HG1      VAL  53   0.063  -1.481  -8.896
  436   1HG2  VAL  53          1HG2      VAL  53   2.304  -3.464 -11.260
  437   2HG2  VAL  53          2HG2      VAL  53   1.625  -4.603 -10.098
  438   3HG2  VAL  53          3HG2      VAL  53   2.317  -3.082  -9.538
  439    H    TRP  54           H        TRP  54  -2.485  -5.490  -9.447
  440    HA   TRP  54           HA       TRP  54  -1.190  -7.690 -10.690
  441   1HB   TRP  54          2HB       TRP  54  -2.857  -8.164  -9.041
  442   2HB   TRP  54          1HB       TRP  54  -4.060  -7.194  -9.883
  443    HD1  TRP  54           HD       TRP  54  -5.841  -8.758 -10.825
  444    HE1  TRP  54           1HE      TRP  54  -5.855 -11.022 -12.045
  445    HE3  TRP  54           3HE      TRP  54  -0.830  -9.761 -10.731
  446    HZ2  TRP  54           2HZ      TRP  54  -3.989 -12.979 -12.860
  447    HZ3  TRP  54           3HZ      TRP  54  -0.026 -11.851 -11.752
  448    HH2  TRP  54           HH       TRP  54  -1.575 -13.426 -12.794
  449    H    MET  55           H        MET  55  -4.289  -6.274 -11.695
  450    HA   MET  55           HA       MET  55  -3.319  -5.957 -14.416
  451   1HB   MET  55          2HB       MET  55  -5.291  -8.015 -13.567
  452   2HB   MET  55          1HB       MET  55  -5.615  -7.159 -15.068
  453   1HG   MET  55          2HG       MET  55  -3.398  -7.821 -15.898
  454   2HG   MET  55          1HG       MET  55  -3.132  -8.727 -14.410
  455   1HE   MET  55          1HE       MET  55  -2.652  -9.998 -17.033
  456   2HE   MET  55          2HE       MET  55  -3.649 -11.441 -17.215
  457   3HE   MET  55          3HE       MET  55  -2.752 -11.171 -15.721
  458    HA   PRO  56           HA       PRO  56  -6.634  -2.934 -13.102
  459   1HB   PRO  56          2HB       PRO  56  -4.908  -0.927 -12.158
  460   2HB   PRO  56          1HB       PRO  56  -5.855  -2.037 -11.172
  461   1HG   PRO  56          2HG       PRO  56  -3.052  -1.940 -11.371
  462   2HG   PRO  56          1HG       PRO  56  -4.014  -3.210 -10.603
  463   1HD   PRO  56          2HD       PRO  56  -2.776  -3.142 -13.312
  464   2HD   PRO  56          1HD       PRO  56  -3.037  -4.515 -12.221
  465    H    ASP  57           H        ASP  57  -6.058  -0.198 -13.412
  466    HA   ASP  57           HA       ASP  57  -4.938   0.017 -16.115
  467   1HB   ASP  57          2HB       ASP  57  -7.609   1.166 -15.284
  468   2HB   ASP  57          1HB       ASP  57  -6.831   1.392 -16.848
  469    H    GLY  58           H        GLY  58  -6.137   1.742 -13.251
  470   1HA   GLY  58          2HA       GLY  58  -5.176   4.286 -13.864
  471   2HA   GLY  58          1HA       GLY  58  -5.413   3.667 -12.237
  472    H    ASP  59           H        ASP  59  -3.311   5.414 -13.347
  473    HA   ASP  59           HA       ASP  59  -0.929   3.736 -13.085
  474   1HB   ASP  59          2HB       ASP  59  -1.556   6.241 -14.441
  475   2HB   ASP  59          1HB       ASP  59  -0.065   6.339 -13.509
  476    H    GLY  60           H        GLY  60   0.235   3.665 -11.274
  477   1HA   GLY  60          2HA       GLY  60  -0.626   5.136  -8.963
  478   2HA   GLY  60          1HA       GLY  60   0.699   3.987  -9.033
  479    H    VAL  61           H        VAL  61   1.603   5.791 -11.452
  480    HA   VAL  61           HA       VAL  61   3.678   7.097 -10.191
  481    HB   VAL  61           HB       VAL  61   2.380   8.007 -12.760
  482   1HG1  VAL  61          1HG1      VAL  61   5.184   8.232 -11.691
  483   2HG1  VAL  61          2HG1      VAL  61   4.039   9.545 -11.962
  484   3HG1  VAL  61          3HG1      VAL  61   4.699   8.654 -13.333
  485   1HG2  VAL  61          1HG2      VAL  61   4.213   5.699 -12.193
  486   2HG2  VAL  61          2HG2      VAL  61   4.148   6.462 -13.781
  487   3HG2  VAL  61          3HG2      VAL  61   2.703   5.715 -13.105
  488    H    ASN  62           H        ASN  62   0.521   8.405 -11.167
  489    HA   ASN  62           HA       ASN  62   1.140  10.959  -9.922
  490   1HB   ASN  62          2HB       ASN  62  -0.621  10.066 -11.999
  491   2HB   ASN  62          1HB       ASN  62  -1.566  10.888 -10.762
  492   1HD2  ASN  62          1HD2      ASN  62   1.319  11.224 -12.770
  493   2HD2  ASN  62          2HD2      ASN  62   1.227  12.941 -12.926
  494    H    PHE  63           H        PHE  63  -0.051   8.027  -8.873
  495    HA   PHE  63           HA       PHE  63  -2.137   8.940  -7.148
  496   1HB   PHE  63          2HB       PHE  63  -2.006   6.608  -7.966
  497   2HB   PHE  63          1HB       PHE  63  -0.542   6.373  -7.014
  498    HD1  PHE  63           1HD      PHE  63  -3.703   8.112  -6.122
  499    HD2  PHE  63           2HD      PHE  63  -1.112   4.815  -5.394
  500    HE1  PHE  63           1HE      PHE  63  -5.069   7.474  -4.180
  501    HE2  PHE  63           2HE      PHE  63  -2.476   4.169  -3.450
  502    HZ   PHE  63           HZ       PHE  63  -4.459   5.501  -2.841
  503    H    ILE  64           H        ILE  64   1.317   8.322  -6.766
  504    HA   ILE  64           HA       ILE  64   1.589   8.367  -4.030
  505    HB   ILE  64           HB       ILE  64   3.450   9.728  -5.983
  506   1HG1  ILE  64          2HG1      ILE  64   4.425   7.191  -5.192
  507   2HG1  ILE  64          1HG1      ILE  64   2.742   6.958  -5.654
  508   1HG2  ILE  64          1HG2      ILE  64   5.156   9.037  -4.219
  509   2HG2  ILE  64          2HG2      ILE  64   3.776   8.793  -3.147
  510   3HG2  ILE  64          3HG2      ILE  64   4.096  10.390  -3.824
  511   1HD1  ILE  64          1HD1      ILE  64   4.829   8.290  -7.361
  512   2HD1  ILE  64          2HD1      ILE  64   3.167   7.924  -7.819
  513   3HD1  ILE  64          3HD1      ILE  64   4.305   6.614  -7.511
  514    H    ASP  65           H        ASP  65   0.800  11.006  -6.156
  515    HA   ASP  65           HA       ASP  65   1.415  13.100  -4.321
  516   1HB   ASP  65          2HB       ASP  65   0.849  13.035  -6.981
  517   2HB   ASP  65          1HB       ASP  65  -0.686  13.606  -6.335
  518    H    PHE  66           H        PHE  66  -1.498  11.256  -5.090
  519    HA   PHE  66           HA       PHE  66  -3.313  12.762  -3.571
  520   1HB   PHE  66          2HB       PHE  66  -4.159  11.124  -5.118
  521   2HB   PHE  66          1HB       PHE  66  -3.288   9.827  -4.306
  522    HD1  PHE  66           1HD      PHE  66  -4.002   9.121  -2.018
  523    HD2  PHE  66           2HD      PHE  66  -6.303  11.789  -4.405
  524    HE1  PHE  66           1HE      PHE  66  -5.969   8.679  -0.610
  525    HE2  PHE  66           2HE      PHE  66  -8.276  11.352  -3.001
  526    HZ   PHE  66           HZ       PHE  66  -8.110   9.794  -1.099
  527    H    ILE  67           H        ILE  67  -1.230  10.028  -2.728
  528    HA   ILE  67           HA       ILE  67  -2.111   9.626  -0.110
  529    HB   ILE  67           HB       ILE  67   0.599   9.193  -1.367
  530   1HG1  ILE  67          2HG1      ILE  67  -0.185   6.758  -0.930
  531   2HG1  ILE  67          1HG1      ILE  67  -1.784   7.469  -0.737
  532   1HG2  ILE  67          1HG2      ILE  67   1.323   9.289   0.792
  533   2HG2  ILE  67          2HG2      ILE  67   0.763   7.617   0.764
  534   3HG2  ILE  67          3HG2      ILE  67  -0.256   8.878   1.458
  535   1HD1  ILE  67          1HD1      ILE  67  -0.205   8.108  -3.176
  536   2HD1  ILE  67          2HD1      ILE  67  -1.953   8.020  -2.951
  537   3HD1  ILE  67          3HD1      ILE  67  -0.999   6.540  -3.043
  538    H    LYS  68           H        LYS  68   0.314  11.866  -1.411
  539    HA   LYS  68           HA       LYS  68   0.926  12.908   1.215
  540   1HB   LYS  68          2HB       LYS  68   1.710  13.965  -1.510
  541   2HB   LYS  68          1HB       LYS  68   2.392  14.469   0.031
  542   1HG   LYS  68          2HG       LYS  68   2.739  11.731   0.038
  543   2HG   LYS  68          1HG       LYS  68   3.046  12.189  -1.639
  544   1HD   LYS  68          2HD       LYS  68   4.945  13.291  -1.123
  545   2HD   LYS  68          1HD       LYS  68   4.281  13.936   0.379
  546   1HE   LYS  68          2HE       LYS  68   4.729  11.035   0.375
  547   2HE   LYS  68          1HE       LYS  68   6.192  12.006   0.225
  548   1HZ   LYS  68          1HZ       LYS  68   4.298  12.847   2.264
  549   2HZ   LYS  68          2HZ       LYS  68   5.989  12.796   2.311
  550   3HZ   LYS  68          3HZ       LYS  68   5.092  11.382   2.553
  551    H    GLU  69           H        GLU  69  -1.279  13.590  -1.351
  552    HA   GLU  69           HA       GLU  69  -1.805  16.308  -0.790
  553   1HB   GLU  69          2HB       GLU  69  -2.441  15.015  -2.875
  554   2HB   GLU  69          1HB       GLU  69  -3.766  14.338  -1.942
  555   1HG   GLU  69          2HG       GLU  69  -4.896  16.336  -1.831
  556   2HG   GLU  69          1HG       GLU  69  -3.438  17.294  -2.083
  557    H    ASN  70           H        ASN  70  -2.818  13.343   0.680
  558    HA   ASN  70           HA       ASN  70  -4.350  14.878   2.649
  559   1HB   ASN  70          2HB       ASN  70  -5.841  12.628   2.605
  560   2HB   ASN  70          1HB       ASN  70  -6.236  14.067   1.671
  561   1HD2  ASN  70          1HD2      ASN  70  -5.193  14.135  -0.533
  562   2HD2  ASN  70          2HD2      ASN  70  -5.186  12.662  -1.435
  563    H    SER  71           H        SER  71  -1.694  13.319   2.362
  564    HA   SER  71           HA       SER  71  -1.632  12.368   5.037
  565   1HB   SER  71          2HB       SER  71  -2.262  10.451   2.937
  566   2HB   SER  71          1HB       SER  71  -0.804  10.006   3.821
  567    HG   SER  71           HG       SER  71  -3.261   9.623   4.584
  568    HA   PRO  72           HA       PRO  72   2.371  13.684   3.013
  569   1HB   PRO  72          2HB       PRO  72   2.564  15.445   5.348
  570   2HB   PRO  72          1HB       PRO  72   2.682  15.848   3.633
  571   1HG   PRO  72          2HG       PRO  72   0.561  16.565   5.135
  572   2HG   PRO  72          1HG       PRO  72   0.415  16.166   3.414
  573   1HD   PRO  72          2HD       PRO  72  -0.242  14.501   5.812
  574   2HD   PRO  72          1HD       PRO  72  -1.124  14.668   4.277
  575    H    ASP  73           H        ASP  73   1.357  12.644   6.106
  576    HA   ASP  73           HA       ASP  73   4.083  11.797   6.800
  577   1HB   ASP  73          2HB       ASP  73   2.118  13.088   8.323
  578   2HB   ASP  73          1HB       ASP  73   2.199  11.442   8.941
  579    H    SER  74           H        SER  74   2.638  10.351   4.873
  580    HA   SER  74           HA       SER  74   2.036   7.869   6.343
  581   1HB   SER  74          2HB       SER  74   0.012   8.663   5.301
  582   2HB   SER  74          1HB       SER  74   0.840   8.898   3.762
  583    HG   SER  74           HG       SER  74  -0.190   6.968   3.593
  584    H    VAL  75           H        VAL  75   2.177   5.933   4.684
  585    HA   VAL  75           HA       VAL  75   4.836   6.109   3.446
  586    HB   VAL  75           HB       VAL  75   3.488   3.516   4.163
  587   1HG1  VAL  75          1HG1      VAL  75   6.165   3.253   4.622
  588   2HG1  VAL  75          2HG1      VAL  75   6.143   4.395   3.279
  589   3HG1  VAL  75          3HG1      VAL  75   5.356   2.825   3.117
  590   1HG2  VAL  75          1HG2      VAL  75   3.498   4.993   6.166
  591   2HG2  VAL  75          2HG2      VAL  75   5.252   5.100   6.024
  592   3HG2  VAL  75          3HG2      VAL  75   4.486   3.544   6.344
  593    H    VAL  76           H        VAL  76   4.985   4.184   1.691
  594    HA   VAL  76           HA       VAL  76   2.631   3.865   0.085
  595    HB   VAL  76           HB       VAL  76   4.863   5.110  -1.430
  596   1HG1  VAL  76          1HG1      VAL  76   3.294   4.811  -2.979
  597   2HG1  VAL  76          2HG1      VAL  76   2.454   6.179  -2.249
  598   3HG1  VAL  76          3HG1      VAL  76   2.041   4.533  -1.770
  599   1HG2  VAL  76          1HG2      VAL  76   2.908   6.774   0.145
  600   2HG2  VAL  76          2HG2      VAL  76   4.133   7.367  -0.976
  601   3HG2  VAL  76          3HG2      VAL  76   4.620   6.582   0.526
  602    H    ILE  77           H        ILE  77   3.303   1.680   0.664
  603    HA   ILE  77           HA       ILE  77   5.775   0.565  -0.051
  604    HB   ILE  77           HB       ILE  77   3.145  -0.902   0.097
  605   1HG1  ILE  77          2HG1      ILE  77   3.511   0.478   2.109
  606   2HG1  ILE  77          1HG1      ILE  77   3.625  -1.238   2.469
  607   1HG2  ILE  77          1HG2      ILE  77   4.307  -2.832   0.105
  608   2HG2  ILE  77          2HG2      ILE  77   5.649  -2.141   1.020
  609   3HG2  ILE  77          3HG2      ILE  77   5.530  -1.862  -0.718
  610   1HD1  ILE  77          1HD1      ILE  77   6.198  -0.099   1.791
  611   2HD1  ILE  77          2HD1      ILE  77   5.706  -1.028   3.208
  612   3HD1  ILE  77          3HD1      ILE  77   5.440   0.715   3.161
  613    H    VAL  78           H        VAL  78   2.647   0.413  -1.757
  614    HA   VAL  78           HA       VAL  78   2.122  -0.215  -3.890
  615    HB   VAL  78           HB       VAL  78   4.609   1.290  -4.692
  616   1HG1  VAL  78          1HG1      VAL  78   1.876   1.127  -5.961
  617   2HG1  VAL  78          2HG1      VAL  78   3.266   0.154  -6.444
  618   3HG1  VAL  78          3HG1      VAL  78   3.310   1.908  -6.627
  619   1HG2  VAL  78          1HG2      VAL  78   2.158   2.270  -3.347
  620   2HG2  VAL  78          2HG2      VAL  78   2.769   3.223  -4.700
  621   3HG2  VAL  78          3HG2      VAL  78   3.804   2.902  -3.309
  622    H    ILE  79           H        ILE  79   2.451  -2.435  -3.799
  623    HA   ILE  79           HA       ILE  79   5.063  -3.449  -4.680
  624    HB   ILE  79           HB       ILE  79   2.788  -5.106  -3.612
  625   1HG1  ILE  79          2HG1      ILE  79   5.048  -3.887  -2.018
  626   2HG1  ILE  79          1HG1      ILE  79   3.377  -3.331  -1.983
  627   1HG2  ILE  79          1HG2      ILE  79   4.944  -6.425  -2.858
  628   2HG2  ILE  79          2HG2      ILE  79   5.662  -5.550  -4.211
  629   3HG2  ILE  79          3HG2      ILE  79   4.273  -6.604  -4.480
  630   1HD1  ILE  79          1HD1      ILE  79   3.508  -4.655  -0.106
  631   2HD1  ILE  79          2HD1      ILE  79   4.560  -5.837  -0.884
  632   3HD1  ILE  79          3HD1      ILE  79   2.847  -5.771  -1.301
  633    H    THR  80           H        THR  80   4.977  -5.435  -6.081
  634    HA   THR  80           HA       THR  80   4.240  -6.661  -7.870
  635    HB   THR  80           HB       THR  80   1.828  -4.892  -8.169
  636    HG1  THR  80           1HG      THR  80   0.788  -6.449  -6.777
  637   1HG2  THR  80          1HG2      THR  80   1.034  -6.438  -9.548
  638   2HG2  THR  80          2HG2      THR  80   1.506  -7.756  -8.477
  639   3HG2  THR  80          3HG2      THR  80   2.677  -7.074  -9.605
  640    H    GLY  81           H        GLY  81   4.510  -6.495 -10.090
  641   1HA   GLY  81          2HA       GLY  81   4.316  -4.238 -11.678
  642   2HA   GLY  81          1HA       GLY  81   5.925  -4.189 -10.971
  643    H    HIS  82           H        HIS  82   3.921  -6.874 -12.171
  644    HA   HIS  82           HA       HIS  82   6.004  -8.350 -13.256
  645   1HB   HIS  82          2HB       HIS  82   3.053  -8.263 -13.751
  646   2HB   HIS  82          1HB       HIS  82   4.070  -9.248 -14.797
  647    HD1  HIS  82           1HD      HIS  82   5.121 -11.365 -13.779
  648    HD2  HIS  82           2HD      HIS  82   2.783  -9.198 -11.114
  649    HE1  HIS  82           1HE      HIS  82   4.781 -12.877 -11.799
  650    HE2  HIS  82           2HE      HIS  82   3.281 -11.580 -10.243
  651    H    GLY  83           H        GLY  83   3.569  -6.882 -15.385
  652   1HA   GLY  83          2HA       GLY  83   5.643  -6.503 -17.405
  653   2HA   GLY  83          1HA       GLY  83   3.909  -6.382 -17.660
  654    H    SER  84           H        SER  84   6.038  -4.756 -15.323
  655    HA   SER  84           HA       SER  84   6.181  -2.287 -16.618
  656   1HB   SER  84          2HB       SER  84   4.521  -1.180 -14.823
  657   2HB   SER  84          1HB       SER  84   3.976  -1.703 -16.417
  658    HG   SER  84           HG       SER  84   3.927  -3.418 -14.170
  659    H    VAL  85           H        VAL  85   8.071  -3.625 -15.337
  660    HA   VAL  85           HA       VAL  85   8.389  -3.140 -12.589
  661    HB   VAL  85           HB       VAL  85  10.601  -3.397 -14.632
  662   1HG1  VAL  85          1HG1      VAL  85  11.588  -2.718 -12.629
  663   2HG1  VAL  85          2HG1      VAL  85  11.731  -4.476 -12.596
  664   3HG1  VAL  85          3HG1      VAL  85  10.478  -3.675 -11.649
  665   1HG2  VAL  85          1HG2      VAL  85   8.638  -5.222 -14.307
  666   2HG2  VAL  85          2HG2      VAL  85   9.773  -5.750 -13.066
  667   3HG2  VAL  85          3HG2      VAL  85  10.298  -5.629 -14.745
  668    H    ASP  86           H        ASP  86   9.038  -1.169 -15.406
  669    HA   ASP  86           HA       ASP  86  10.702   0.758 -14.201
  670   1HB   ASP  86          2HB       ASP  86  10.424   0.547 -16.640
  671   2HB   ASP  86          1HB       ASP  86   8.759   1.104 -16.497
  672    H    THR  87           H        THR  87   7.198   0.363 -14.248
  673    HA   THR  87           HA       THR  87   6.385   2.888 -13.463
  674    HB   THR  87           HB       THR  87   5.038   0.663 -13.942
  675    HG1  THR  87           1HG      THR  87   4.123   2.580 -12.066
  676   1HG2  THR  87          1HG2      THR  87   5.879  -0.375 -11.763
  677   2HG2  THR  87          2HG2      THR  87   4.154  -0.473 -12.112
  678   3HG2  THR  87          3HG2      THR  87   4.755   0.721 -10.961
  679    H    ALA  88           H        ALA  88   7.854   0.314 -11.620
  680    HA   ALA  88           HA       ALA  88   7.417   1.212  -9.022
  681   1HB   ALA  88          1HB       ALA  88   9.754  -0.269 -10.218
  682   2HB   ALA  88          2HB       ALA  88   8.359  -0.957  -9.391
  683   3HB   ALA  88          3HB       ALA  88   9.540  -0.011  -8.489
  684    H    VAL  89           H        VAL  89  10.327   1.689 -10.993
  685    HA   VAL  89           HA       VAL  89  11.508   3.597  -9.318
  686    HB   VAL  89           HB       VAL  89  12.976   4.110 -11.216
  687   1HG1  VAL  89          1HG1      VAL  89  12.351   1.180 -10.885
  688   2HG1  VAL  89          2HG1      VAL  89  13.466   2.138  -9.910
  689   3HG1  VAL  89          3HG1      VAL  89  13.825   1.823 -11.609
  690   1HG2  VAL  89          1HG2      VAL  89  12.631   3.332 -13.399
  691   2HG2  VAL  89          2HG2      VAL  89  11.056   3.947 -12.901
  692   3HG2  VAL  89          3HG2      VAL  89  11.367   2.212 -12.894
  693    H    LYS  90           H        LYS  90   8.985   3.863 -11.658
  694    HA   LYS  90           HA       LYS  90   9.271   6.726 -11.992
  695   1HB   LYS  90          2HB       LYS  90   8.498   5.398 -13.878
  696   2HB   LYS  90          1HB       LYS  90   7.142   4.802 -12.934
  697   1HG   LYS  90          2HG       LYS  90   6.091   6.911 -12.926
  698   2HG   LYS  90          1HG       LYS  90   7.541   7.719 -13.523
  699   1HD   LYS  90          2HD       LYS  90   7.264   6.165 -15.577
  700   2HD   LYS  90          1HD       LYS  90   5.612   5.962 -14.994
  701   1HE   LYS  90          2HE       LYS  90   6.221   8.732 -14.936
  702   2HE   LYS  90          1HE       LYS  90   6.720   8.102 -16.506
  703   1HZ   LYS  90          1HZ       LYS  90   4.570   8.455 -16.997
  704   2HZ   LYS  90          2HZ       LYS  90   4.059   8.391 -15.386
  705   3HZ   LYS  90          3HZ       LYS  90   4.331   6.958 -16.243
  706    H    ALA  91           H        ALA  91   7.525   4.518  -9.975
  707    HA   ALA  91           HA       ALA  91   5.740   6.640  -9.039
  708   1HB   ALA  91          1HB       ALA  91   4.753   4.681  -7.694
  709   2HB   ALA  91          2HB       ALA  91   5.733   3.658  -8.746
  710   3HB   ALA  91          3HB       ALA  91   4.501   4.712  -9.439
  711    H    ILE  92           H        ILE  92   8.514   4.784  -8.062
  712    HA   ILE  92           HA       ILE  92   8.245   5.595  -5.285
  713    HB   ILE  92           HB       ILE  92  10.003   4.159  -4.746
  714   1HG1  ILE  92          2HG1      ILE  92  10.791   4.200  -7.669
  715   2HG1  ILE  92          1HG1      ILE  92  11.679   4.922  -6.332
  716   1HG2  ILE  92          1HG2      ILE  92   9.475   2.194  -6.612
  717   2HG2  ILE  92          2HG2      ILE  92   8.033   3.204  -6.659
  718   3HG2  ILE  92          3HG2      ILE  92   8.565   2.501  -5.134
  719   1HD1  ILE  92          1HD1      ILE  92  11.815   2.261  -7.376
  720   2HD1  ILE  92          2HD1      ILE  92  11.356   2.217  -5.674
  721   3HD1  ILE  92          3HD1      ILE  92  12.835   3.041  -6.167
  722    H    LYS  93           H        LYS  93   9.698   6.774  -8.133
  723    HA   LYS  93           HA       LYS  93  11.893   8.152  -6.943
  724   1HB   LYS  93          2HB       LYS  93  10.636   7.989  -9.594
  725   2HB   LYS  93          1HB       LYS  93  11.328   9.562  -9.229
  726   1HG   LYS  93          2HG       LYS  93  13.432   8.256  -8.553
  727   2HG   LYS  93          1HG       LYS  93  12.698   6.909  -9.426
  728   1HD   LYS  93          2HD       LYS  93  12.402   8.960 -11.204
  729   2HD   LYS  93          1HD       LYS  93  13.940   9.365 -10.438
  730   1HE   LYS  93          2HE       LYS  93  13.208   6.790 -11.824
  731   2HE   LYS  93          1HE       LYS  93  14.374   7.998 -12.363
  732   1HZ   LYS  93          1HZ       LYS  93  15.341   7.408  -9.956
  733   2HZ   LYS  93          2HZ       LYS  93  15.820   6.614 -11.373
  734   3HZ   LYS  93          3HZ       LYS  93  14.655   5.917 -10.364
  735    H    LYS  94           H        LYS  94   8.525   8.877  -7.528
  736    HA   LYS  94           HA       LYS  94   8.629  11.664  -7.110
  737   1HB   LYS  94          2HB       LYS  94   6.717  10.481  -8.145
  738   2HB   LYS  94          1HB       LYS  94   6.329   9.778  -6.580
  739   1HG   LYS  94          2HG       LYS  94   5.693  11.850  -5.684
  740   2HG   LYS  94          1HG       LYS  94   6.453  12.744  -7.001
  741   1HD   LYS  94          2HD       LYS  94   4.174  10.842  -7.474
  742   2HD   LYS  94          1HD       LYS  94   3.907  12.532  -7.040
  743   1HE   LYS  94          2HE       LYS  94   5.826  12.105  -9.220
  744   2HE   LYS  94          1HE       LYS  94   4.175  11.604  -9.582
  745   1HZ   LYS  94          1HZ       LYS  94   5.255  14.265  -9.172
  746   2HZ   LYS  94          2HZ       LYS  94   3.745  13.982  -8.466
  747   3HZ   LYS  94          3HZ       LYS  94   3.957  13.759 -10.130
  748    H    GLY  95           H        GLY  95   7.445   9.130  -4.879
  749   1HA   GLY  95          2HA       GLY  95   8.899  10.045  -2.656
  750   2HA   GLY  95          1HA       GLY  95   7.318  10.809  -2.631
  751    H    ALA  96           H        ALA  96   7.926   7.550  -3.831
  752    HA   ALA  96           HA       ALA  96   6.055   6.535  -1.846
  753   1HB   ALA  96          1HB       ALA  96   5.608   4.826  -3.269
  754   2HB   ALA  96          2HB       ALA  96   7.286   4.677  -3.791
  755   3HB   ALA  96          3HB       ALA  96   6.267   5.956  -4.453
  756    H    TYR  97           H        TYR  97   6.713   4.090  -1.229
  757    HA   TYR  97           HA       TYR  97   9.241   4.379   0.216
  758   1HB   TYR  97          2HB       TYR  97   7.017   3.825   1.356
  759   2HB   TYR  97          1HB       TYR  97   7.186   2.224   0.647
  760    HD1  TYR  97           1HD      TYR  97   8.745   0.640   1.528
  761    HD2  TYR  97           2HD      TYR  97   8.637   4.611   3.047
  762    HE1  TYR  97           1HE      TYR  97  10.156  -0.054   3.420
  763    HE2  TYR  97           2HE      TYR  97  10.046   3.930   4.944
  764    HH   TYR  97           HH       TYR  97  11.693   0.959   5.039
  765    H    GLU  98           H        GLU  98   9.077   3.674  -2.611
  766    HA   GLU  98           HA       GLU  98  10.189   2.345  -4.079
  767   1HB   GLU  98          2HB       GLU  98  12.003   2.418  -2.387
  768   2HB   GLU  98          1HB       GLU  98  11.327   0.979  -1.644
  769   1HG   GLU  98          2HG       GLU  98  12.733  -0.147  -2.942
  770   2HG   GLU  98          1HG       GLU  98  11.598   0.201  -4.245
  771    H    PHE  99           H        PHE  99   9.554   0.662  -5.269
  772    HA   PHE  99           HA       PHE  99   7.328  -0.874  -4.525
  773   1HB   PHE  99          2HB       PHE  99   9.191  -0.763  -6.812
  774   2HB   PHE  99          1HB       PHE  99   8.367  -2.297  -6.590
  775    HD1  PHE  99           1HD      PHE  99   7.171   1.184  -6.041
  776    HD2  PHE  99           2HD      PHE  99   6.778  -2.425  -8.260
  777    HE1  PHE  99           1HE      PHE  99   5.197   2.106  -7.184
  778    HE2  PHE  99           2HE      PHE  99   4.802  -1.509  -9.407
  779    HZ   PHE  99           HZ       PHE  99   4.009   0.759  -8.867
  780    H    LEU 100           H        LEU 100   7.116  -2.793  -3.523
  781    HA   LEU 100           HA       LEU 100   9.401  -4.009  -2.311
  782   1HB   LEU 100          2HB       LEU 100   6.956  -3.825  -1.442
  783   2HB   LEU 100          1HB       LEU 100   6.674  -5.251  -2.422
  784    HG   LEU 100           HG       LEU 100   7.078  -5.968  -0.182
  785   1HD1  LEU 100          1HD1      LEU 100   8.139  -7.213  -2.098
  786   2HD1  LEU 100          2HD1      LEU 100   8.846  -7.498  -0.508
  787   3HD1  LEU 100          3HD1      LEU 100   9.655  -6.429  -1.655
  788   1HD2  LEU 100          1HD2      LEU 100   9.305  -4.004  -0.324
  789   2HD2  LEU 100          2HD2      LEU 100   9.510  -5.432   0.692
  790   3HD2  LEU 100          3HD2      LEU 100   8.164  -4.330   0.981
  791    H    GLU 101           H        GLU 101  10.596  -4.554  -4.234
  792    HA   GLU 101           HA       GLU 101   9.791  -6.120  -6.342
  793   1HB   GLU 101          2HB       GLU 101  12.476  -6.288  -4.966
  794   2HB   GLU 101          1HB       GLU 101  12.124  -6.742  -6.628
  795   1HG   GLU 101          2HG       GLU 101  12.073  -3.979  -5.444
  796   2HG   GLU 101          1HG       GLU 101  13.213  -4.619  -6.627
  797    H    LYS 102           H        LYS 102  10.770  -8.431  -6.717
  798    HA   LYS 102           HA       LYS 102  10.637 -10.660  -6.305
  799   1HB   LYS 102          2HB       LYS 102  11.779  -9.572  -4.011
  800   2HB   LYS 102          1HB       LYS 102  10.490 -10.597  -3.399
  801   1HG   LYS 102          2HG       LYS 102  12.614 -11.506  -5.327
  802   2HG   LYS 102          1HG       LYS 102  12.681 -11.734  -3.579
  803   1HD   LYS 102          2HD       LYS 102  10.943 -13.264  -3.583
  804   2HD   LYS 102          1HD       LYS 102  10.294 -12.676  -5.114
  805   1HE   LYS 102          2HE       LYS 102  11.262 -14.573  -5.888
  806   2HE   LYS 102          1HE       LYS 102  12.678 -13.525  -5.967
  807   1HZ   LYS 102          1HZ       LYS 102  12.667 -15.871  -4.733
  808   2HZ   LYS 102          2HZ       LYS 102  12.229 -14.880  -3.435
  809   3HZ   LYS 102          3HZ       LYS 102  13.672 -14.592  -4.270
  810    HA   PRO 103           HA       PRO 103   6.098 -10.242  -5.526
  811   1HB   PRO 103          2HB       PRO 103   5.326 -11.574  -7.753
  812   2HB   PRO 103          1HB       PRO 103   5.716  -9.850  -7.761
  813   1HG   PRO 103          2HG       PRO 103   7.408 -12.178  -8.586
  814   2HG   PRO 103          1HG       PRO 103   7.195 -10.610  -9.387
  815   1HD   PRO 103          2HD       PRO 103   9.348 -11.186  -7.840
  816   2HD   PRO 103          1HD       PRO 103   8.678  -9.549  -7.981
  817    H    PHE 104           H        PHE 104   4.432 -12.017  -5.437
  818    HA   PHE 104           HA       PHE 104   3.741 -13.989  -4.541
  819   1HB   PHE 104          2HB       PHE 104   5.213 -14.606  -6.788
  820   2HB   PHE 104          1HB       PHE 104   5.946 -15.628  -5.556
  821    HD1  PHE 104           1HD      PHE 104   3.285 -15.292  -7.860
  822    HD2  PHE 104           2HD      PHE 104   4.327 -17.043  -4.123
  823    HE1  PHE 104           1HE      PHE 104   1.437 -16.898  -8.102
  824    HE2  PHE 104           2HE      PHE 104   2.481 -18.652  -4.359
  825    HZ   PHE 104           HZ       PHE 104   1.032 -18.580  -6.349
  826    H    SER 105           H        SER 105   5.851 -12.350  -3.163
  827    HA   SER 105           HA       SER 105   6.481 -14.322  -1.122
  828   1HB   SER 105          2HB       SER 105   8.861 -13.138  -1.061
  829   2HB   SER 105          1HB       SER 105   8.557 -14.530  -2.099
  830    HG   SER 105           HG       SER 105   8.225 -11.856  -2.970
  831    H    VAL 106           H        VAL 106   4.594 -12.716  -0.575
  832    HA   VAL 106           HA       VAL 106   5.024 -10.076   0.141
  833    HB   VAL 106           HB       VAL 106   2.804 -11.083   0.119
  834   1HG1  VAL 106          1HG1      VAL 106   2.221 -12.384   2.309
  835   2HG1  VAL 106          2HG1      VAL 106   3.950 -12.737   2.318
  836   3HG1  VAL 106          3HG1      VAL 106   2.960 -13.220   0.943
  837   1HG2  VAL 106          1HG2      VAL 106   3.276 -10.172   2.938
  838   2HG2  VAL 106          2HG2      VAL 106   1.893  -9.862   1.888
  839   3HG2  VAL 106          3HG2      VAL 106   3.434  -9.064   1.576
  840    H    GLU 107           H        GLU 107   6.050 -12.986   1.765
  841    HA   GLU 107           HA       GLU 107   6.397 -12.224   4.357
  842   1HB   GLU 107          2HB       GLU 107   7.022 -14.423   3.197
  843   2HB   GLU 107          1HB       GLU 107   8.572 -13.661   2.863
  844   1HG   GLU 107          2HG       GLU 107   8.778 -13.249   5.326
  845   2HG   GLU 107          1HG       GLU 107   7.358 -14.273   5.537
  846    H    ARG 108           H        ARG 108   8.265 -11.224   1.566
  847    HA   ARG 108           HA       ARG 108  10.347  -9.940   3.040
  848   1HB   ARG 108          2HB       ARG 108   9.699 -10.422   0.279
  849   2HB   ARG 108          1HB       ARG 108  10.109  -8.726   0.495
  850   1HG   ARG 108          2HG       ARG 108  12.273  -9.177   1.075
  851   2HG   ARG 108          1HG       ARG 108  11.884 -10.776   1.710
  852   1HD   ARG 108          2HD       ARG 108  12.077 -11.774  -0.312
  853   2HD   ARG 108          1HD       ARG 108  11.429 -10.381  -1.178
  854    HE   ARG 108           HE       ARG 108  13.567  -9.637  -1.497
  855   1HH1  ARG 108          1HH1      ARG 108  13.585 -12.033   1.040
  856   2HH1  ARG 108          2HH1      ARG 108  15.312 -12.094   1.142
  857   1HH2  ARG 108          1HH2      ARG 108  15.839  -9.714  -1.363
  858   2HH2  ARG 108          2HH2      ARG 108  16.593 -10.776  -0.221
  859    H    PHE 109           H        PHE 109   7.260  -8.974   1.692
  860    HA   PHE 109           HA       PHE 109   7.485  -6.197   1.963
  861   1HB   PHE 109          2HB       PHE 109   5.667  -7.070   0.685
  862   2HB   PHE 109          1HB       PHE 109   5.106  -8.058   2.026
  863    HD1  PHE 109           1HD      PHE 109   6.115  -4.535   2.361
  864    HD2  PHE 109           2HD      PHE 109   2.868  -7.267   2.050
  865    HE1  PHE 109           1HE      PHE 109   4.557  -2.755   3.021
  866    HE2  PHE 109           2HE      PHE 109   1.302  -5.489   2.708
  867    HZ   PHE 109           HZ       PHE 109   2.146  -3.226   3.195
  868    H    LEU 110           H        LEU 110   6.804  -8.721   4.272
  869    HA   LEU 110           HA       LEU 110   5.643  -7.384   6.365
  870   1HB   LEU 110          2HB       LEU 110   6.663  -9.854   6.011
  871   2HB   LEU 110          1HB       LEU 110   7.836  -9.182   7.126
  872    HG   LEU 110           HG       LEU 110   4.913  -8.990   7.737
  873   1HD1  LEU 110          1HD1      LEU 110   5.263 -11.112   9.082
  874   2HD1  LEU 110          2HD1      LEU 110   6.689 -11.387   8.083
  875   3HD1  LEU 110          3HD1      LEU 110   5.093 -11.302   7.337
  876   1HD2  LEU 110          1HD2      LEU 110   7.489  -8.711   9.175
  877   2HD2  LEU 110          2HD2      LEU 110   6.123  -9.375  10.070
  878   3HD2  LEU 110          3HD2      LEU 110   5.997  -7.782   9.326
  879    H    LEU 111           H        LEU 111   9.116  -7.638   5.684
  880    HA   LEU 111           HA       LEU 111  10.053  -6.169   7.857
  881   1HB   LEU 111          2HB       LEU 111  11.194  -6.406   5.076
  882   2HB   LEU 111          1HB       LEU 111  12.055  -5.733   6.446
  883    HG   LEU 111           HG       LEU 111  11.481  -8.082   7.526
  884   1HD1  LEU 111          1HD1      LEU 111  11.075  -8.457   4.610
  885   2HD1  LEU 111          2HD1      LEU 111  10.288  -9.247   5.976
  886   3HD1  LEU 111          3HD1      LEU 111  11.919  -9.723   5.502
  887   1HD2  LEU 111          1HD2      LEU 111  13.721  -6.893   6.622
  888   2HD2  LEU 111          2HD2      LEU 111  13.663  -8.298   5.558
  889   3HD2  LEU 111          3HD2      LEU 111  13.682  -8.517   7.308
  890    H    THR 112           H        THR 112   9.517  -5.005   4.529
  891    HA   THR 112           HA       THR 112  10.057  -2.354   4.805
  892    HB   THR 112           HB       THR 112   7.766  -3.575   3.255
  893    HG1  THR 112           1HG      THR 112   9.705  -4.444   2.611
  894   1HG2  THR 112          1HG2      THR 112   9.109  -1.197   2.195
  895   2HG2  THR 112          2HG2      THR 112   8.082  -0.918   3.602
  896   3HG2  THR 112          3HG2      THR 112   7.408  -1.664   2.153
  897    H    ILE 113           H        ILE 113   7.102  -3.998   5.801
  898    HA   ILE 113           HA       ILE 113   5.567  -1.743   6.458
  899    HB   ILE 113           HB       ILE 113   5.548  -4.543   7.581
  900   1HG1  ILE 113          2HG1      ILE 113   4.845  -4.223   5.228
  901   2HG1  ILE 113          1HG1      ILE 113   3.528  -4.787   6.252
  902   1HG2  ILE 113          1HG2      ILE 113   4.719  -3.067   9.322
  903   2HG2  ILE 113          2HG2      ILE 113   3.394  -4.004   8.630
  904   3HG2  ILE 113          3HG2      ILE 113   3.608  -2.313   8.178
  905   1HD1  ILE 113          1HD1      ILE 113   3.152  -2.131   6.418
  906   2HD1  ILE 113          2HD1      ILE 113   2.393  -3.161   5.204
  907   3HD1  ILE 113          3HD1      ILE 113   3.850  -2.252   4.804
  908    H    LYS 114           H        LYS 114   7.134  -3.885   8.834
  909    HA   LYS 114           HA       LYS 114   7.052  -2.114  10.979
  910   1HB   LYS 114          2HB       LYS 114   7.520  -4.460  11.303
  911   2HB   LYS 114          1HB       LYS 114   8.994  -4.342  10.359
  912   1HG   LYS 114          2HG       LYS 114   8.710  -2.666  12.806
  913   2HG   LYS 114          1HG       LYS 114   9.052  -4.387  12.981
  914   1HD   LYS 114          2HD       LYS 114  10.717  -2.294  11.595
  915   2HD   LYS 114          1HD       LYS 114  11.145  -3.273  12.994
  916   1HE   LYS 114          2HE       LYS 114  10.574  -5.160  11.087
  917   2HE   LYS 114          1HE       LYS 114  11.334  -3.878  10.145
  918   1HZ   LYS 114          1HZ       LYS 114  13.175  -3.925  11.796
  919   2HZ   LYS 114          2HZ       LYS 114  13.025  -5.348  10.895
  920   3HZ   LYS 114          3HZ       LYS 114  12.470  -5.296  12.493
  921    H    HIS 115           H        HIS 115   9.107  -2.177   8.228
  922    HA   HIS 115           HA       HIS 115  11.155  -0.488   9.393
  923   1HB   HIS 115          2HB       HIS 115  10.725  -1.626   6.643
  924   2HB   HIS 115          1HB       HIS 115  11.992  -0.451   6.979
  925    HD1  HIS 115           1HD      HIS 115  12.759  -1.690   9.804
  926    HD2  HIS 115           2HD      HIS 115  12.434  -3.757   6.215
  927    HE1  HIS 115           1HE      HIS 115  14.182  -3.744  10.082
  928    HE2  HIS 115           2HE      HIS 115  13.873  -5.038   7.942
  929    H    ALA 116           H        ALA 116   8.184  -0.139   7.724
  930    HA   ALA 116           HA       ALA 116   8.738   2.552   6.783
  931   1HB   ALA 116          1HB       ALA 116   6.109   2.281   6.359
  932   2HB   ALA 116          2HB       ALA 116   6.564   0.580   6.441
  933   3HB   ALA 116          3HB       ALA 116   7.333   1.642   5.261
  934    H    PHE 117           H        PHE 117   6.679   0.974   9.205
  935    HA   PHE 117           HA       PHE 117   5.420   3.276  10.182
  936   1HB   PHE 117          2HB       PHE 117   5.942   0.544  11.278
  937   2HB   PHE 117          1HB       PHE 117   5.319   1.789  12.356
  938    HD1  PHE 117           1HD      PHE 117   3.216   3.070  11.500
  939    HD2  PHE 117           2HD      PHE 117   4.466  -0.729  10.047
  940    HE1  PHE 117           1HE      PHE 117   0.935   2.636  10.690
  941    HE2  PHE 117           2HE      PHE 117   2.189  -1.170   9.235
  942    HZ   PHE 117           HZ       PHE 117   0.419   0.514   9.554
  943    H    GLU 118           H        GLU 118   8.633   2.105  10.628
  944    HA   GLU 118           HA       GLU 118   9.347   3.130  13.093
  945   1HB   GLU 118          2HB       GLU 118  11.037   3.114  10.588
  946   2HB   GLU 118          1HB       GLU 118  11.636   3.227  12.238
  947   1HG   GLU 118          2HG       GLU 118  10.183   0.958  12.393
  948   2HG   GLU 118          1HG       GLU 118  10.710   0.896  10.712
  949    H    GLU 119           H        GLU 119   8.628   4.826  10.159
  950    HA   GLU 119           HA       GLU 119   9.723   7.323  11.221
  951   1HB   GLU 119          2HB       GLU 119   8.483   6.759   8.521
  952   2HB   GLU 119          1HB       GLU 119   9.286   8.247   9.002
  953   1HG   GLU 119          2HG       GLU 119  11.385   7.007   9.282
  954   2HG   GLU 119          1HG       GLU 119  10.571   5.537   8.748
  955    H    TYR 120           H        TYR 120   7.373   6.050  12.397
  956    HA   TYR 120           HA       TYR 120   5.351   8.109  11.805
  957   1HB   TYR 120          2HB       TYR 120   4.843   5.582  11.414
  958   2HB   TYR 120          1HB       TYR 120   4.695   5.516  13.167
  959    HD1  TYR 120           1HD      TYR 120   2.716   6.206  14.228
  960    HD2  TYR 120           2HD      TYR 120   3.358   7.206  10.143
  961    HE1  TYR 120           1HE      TYR 120   0.395   7.002  14.064
  962    HE2  TYR 120           2HE      TYR 120   1.038   8.005   9.968
  963    HH   TYR 120           HH       TYR 120  -1.171   7.529  11.206
  964    H    SER 121           H        SER 121   7.643   8.273  13.651
  965    HA   SER 121           HA       SER 121   6.118   8.829  16.104
  966   1HB   SER 121          2HB       SER 121   7.418   6.784  16.478
  967   2HB   SER 121          1HB       SER 121   8.890   7.617  15.977
  968    HG   SER 121           HG       SER 121   7.277   8.456  18.150
  Start of MODEL   21
    1   1H    MET   1          1HT       MET   1   0.575  -0.118  17.065
    2   2H    MET   1          2HT       MET   1   0.405  -1.682  17.751
    3   3H    MET   1          3HT       MET   1  -0.514  -0.369  18.365
    4    HA   MET   1           HA       MET   1  -1.689  -1.974  16.895
    5   1HB   MET   1          2HB       MET   1  -1.904   0.749  17.337
    6   2HB   MET   1          1HB       MET   1  -1.985   0.626  15.584
    7   1HG   MET   1          2HG       MET   1  -4.167   0.312  15.944
    8   2HG   MET   1          1HG       MET   1  -3.685  -1.346  16.298
    9   1HE   MET   1          1HE       MET   1  -4.770  -1.968  19.717
   10   2HE   MET   1          2HE       MET   1  -3.879  -2.498  18.290
   11   3HE   MET   1          3HE       MET   1  -5.594  -2.107  18.164
   12    H    LYS   2           H        LYS   2  -0.099   0.558  14.956
   13    HA   LYS   2           HA       LYS   2   0.822   0.534  12.877
   14   1HB   LYS   2          2HB       LYS   2   1.315  -2.413  13.281
   15   2HB   LYS   2          1HB       LYS   2   2.230  -1.290  12.284
   16   1HG   LYS   2          2HG       LYS   2   2.067  -0.853  15.232
   17   2HG   LYS   2          1HG       LYS   2   3.169  -2.067  14.578
   18   1HD   LYS   2          2HD       LYS   2   3.796  -0.039  12.965
   19   2HD   LYS   2          1HD       LYS   2   3.244   0.889  14.361
   20   1HE   LYS   2          2HE       LYS   2   4.821  -0.289  15.790
   21   2HE   LYS   2          1HE       LYS   2   5.344  -1.277  14.426
   22   1HZ   LYS   2          1HZ       LYS   2   6.800   0.668  15.000
   23   2HZ   LYS   2          2HZ       LYS   2   5.566   1.678  14.439
   24   3HZ   LYS   2          3HZ       LYS   2   6.309   0.584  13.383
   25    H    ARG   3           H        ARG   3  -1.052   0.938  11.719
   26    HA   ARG   3           HA       ARG   3  -2.399  -1.411  10.583
   27   1HB   ARG   3          2HB       ARG   3  -4.364  -0.083  10.287
   28   2HB   ARG   3          1HB       ARG   3  -3.819   0.094  11.947
   29   1HG   ARG   3          2HG       ARG   3  -3.011   2.067   9.874
   30   2HG   ARG   3          1HG       ARG   3  -4.598   2.154  10.635
   31   1HD   ARG   3          2HD       ARG   3  -2.994   1.839  12.800
   32   2HD   ARG   3          1HD       ARG   3  -1.938   2.757  11.729
   33    HE   ARG   3           HE       ARG   3  -4.587   3.849  11.962
   34   1HH1  ARG   3          1HH1      ARG   3  -1.387   3.780  13.351
   35   2HH1  ARG   3          2HH1      ARG   3  -1.551   5.322  14.121
   36   1HH2  ARG   3          1HH2      ARG   3  -4.805   5.878  12.974
   37   2HH2  ARG   3          2HH2      ARG   3  -3.492   6.513  13.907
   38    H    VAL   4           H        VAL   4  -2.442  -1.725   8.424
   39    HA   VAL   4           HA       VAL   4  -1.282   0.400   6.736
   40    HB   VAL   4           HB       VAL   4  -0.840  -2.560   6.350
   41   1HG1  VAL   4          1HG1      VAL   4   1.085  -1.513   4.923
   42   2HG1  VAL   4          2HG1      VAL   4   0.028  -0.103   4.902
   43   3HG1  VAL   4          3HG1      VAL   4  -0.545  -1.643   4.262
   44   1HG2  VAL   4          1HG2      VAL   4   1.149  -0.548   7.387
   45   2HG2  VAL   4          2HG2      VAL   4   1.361  -2.293   7.237
   46   3HG2  VAL   4          3HG2      VAL   4   0.229  -1.640   8.420
   47    H    LEU   5           H        LEU   5  -1.966   0.430   4.528
   48    HA   LEU   5           HA       LEU   5  -4.621  -0.777   4.158
   49   1HB   LEU   5          2HB       LEU   5  -4.426   1.721   4.061
   50   2HB   LEU   5          1HB       LEU   5  -3.419   1.535   2.635
   51    HG   LEU   5           HG       LEU   5  -5.282   0.470   1.446
   52   1HD1  LEU   5          1HD1      LEU   5  -7.570   0.853   2.685
   53   2HD1  LEU   5          2HD1      LEU   5  -6.557   0.690   4.119
   54   3HD1  LEU   5          3HD1      LEU   5  -6.626  -0.616   2.935
   55   1HD2  LEU   5          1HD2      LEU   5  -6.904   2.592   1.818
   56   2HD2  LEU   5          2HD2      LEU   5  -5.425   2.641   0.857
   57   3HD2  LEU   5          3HD2      LEU   5  -5.411   3.206   2.527
   58    H    VAL   6           H        VAL   6  -4.915  -2.287   2.666
   59    HA   VAL   6           HA       VAL   6  -2.719  -2.797   0.773
   60    HB   VAL   6           HB       VAL   6  -4.881  -4.712   1.663
   61   1HG1  VAL   6          1HG1      VAL   6  -4.084  -5.272  -0.530
   62   2HG1  VAL   6          2HG1      VAL   6  -3.382  -6.408   0.621
   63   3HG1  VAL   6          3HG1      VAL   6  -2.407  -5.085  -0.020
   64   1HG2  VAL   6          1HG2      VAL   6  -3.376  -5.679   3.160
   65   2HG2  VAL   6          2HG2      VAL   6  -3.131  -3.947   3.388
   66   3HG2  VAL   6          3HG2      VAL   6  -1.986  -4.880   2.426
   67    H    VAL   7           H        VAL   7  -3.367  -1.367  -0.836
   68    HA   VAL   7           HA       VAL   7  -6.038  -1.545  -1.926
   69    HB   VAL   7           HB       VAL   7  -3.745  -0.011  -3.139
   70   1HG1  VAL   7          1HG1      VAL   7  -6.735   0.371  -3.177
   71   2HG1  VAL   7          2HG1      VAL   7  -5.725  -0.182  -4.514
   72   3HG1  VAL   7          3HG1      VAL   7  -5.562   1.467  -3.909
   73   1HG2  VAL   7          1HG2      VAL   7  -5.460   0.713  -0.780
   74   2HG2  VAL   7          2HG2      VAL   7  -4.695   1.939  -1.791
   75   3HG2  VAL   7          3HG2      VAL   7  -3.702   0.767  -0.924
   76    H    ASP   8           H        ASP   8  -6.457  -3.331  -3.084
   77    HA   ASP   8           HA       ASP   8  -4.686  -3.931  -5.341
   78   1HB   ASP   8          2HB       ASP   8  -4.114  -5.510  -3.537
   79   2HB   ASP   8          1HB       ASP   8  -5.798  -6.017  -3.449
   80    H    ASP   9           H        ASP   9  -5.704  -4.666  -7.174
   81    HA   ASP   9           HA       ASP   9  -8.597  -4.317  -7.212
   82   1HB   ASP   9          2HB       ASP   9  -7.239  -3.148  -8.901
   83   2HB   ASP   9          1HB       ASP   9  -6.640  -4.694  -9.492
   84    H    GLU  10           H        GLU  10  -8.063  -6.552  -5.842
   85    HA   GLU  10           HA       GLU  10  -9.491  -8.542  -7.191
   86   1HB   GLU  10          2HB       GLU  10  -6.991  -8.525  -8.193
   87   2HB   GLU  10          1HB       GLU  10  -6.746  -9.600  -6.825
   88   1HG   GLU  10          2HG       GLU  10  -7.430 -11.224  -8.175
   89   2HG   GLU  10          1HG       GLU  10  -9.052 -10.570  -7.951
   90    H    GLU  11           H        GLU  11  -8.798 -10.840  -5.996
   91    HA   GLU  11           HA       GLU  11  -8.627 -10.212  -3.125
   92   1HB   GLU  11          2HB       GLU  11 -10.667 -11.813  -4.606
   93   2HB   GLU  11          1HB       GLU  11 -10.215 -12.326  -2.986
   94   1HG   GLU  11          2HG       GLU  11 -11.948 -10.970  -2.463
   95   2HG   GLU  11          1HG       GLU  11 -10.652  -9.775  -2.450
   96    H    SER  12           H        SER  12  -6.452 -10.986  -4.703
   97    HA   SER  12           HA       SER  12  -6.046 -13.820  -4.074
   98   1HB   SER  12          2HB       SER  12  -4.231 -12.019  -5.687
   99   2HB   SER  12          1HB       SER  12  -4.208 -13.781  -5.616
  100    HG   SER  12           HG       SER  12  -5.367 -13.481  -7.382
  101    H    ILE  13           H        ILE  13  -4.620 -10.626  -3.549
  102    HA   ILE  13           HA       ILE  13  -2.746 -11.771  -1.609
  103    HB   ILE  13           HB       ILE  13  -2.896  -8.945  -2.668
  104   1HG1  ILE  13          2HG1      ILE  13  -2.324 -10.617  -4.407
  105   2HG1  ILE  13          1HG1      ILE  13  -0.986  -9.530  -4.056
  106   1HG2  ILE  13          1HG2      ILE  13  -1.125 -10.326  -0.719
  107   2HG2  ILE  13          2HG2      ILE  13  -1.759  -8.680  -0.703
  108   3HG2  ILE  13          3HG2      ILE  13  -0.424  -9.100  -1.775
  109   1HD1  ILE  13          1HD1      ILE  13  -1.287 -12.327  -2.991
  110   2HD1  ILE  13          2HD1      ILE  13   0.072 -11.241  -2.701
  111   3HD1  ILE  13          3HD1      ILE  13  -0.249 -11.838  -4.329
  112    H    THR  14           H        THR  14  -5.338  -9.386  -1.880
  113    HA   THR  14           HA       THR  14  -5.304  -8.207   0.586
  114    HB   THR  14           HB       THR  14  -7.800  -8.030   0.365
  115    HG1  THR  14           1HG      THR  14  -8.802  -9.003  -1.304
  116   1HG2  THR  14          1HG2      THR  14  -5.846  -6.869  -1.245
  117   2HG2  THR  14          2HG2      THR  14  -7.495  -6.303  -0.975
  118   3HG2  THR  14          3HG2      THR  14  -7.137  -7.359  -2.342
  119    H    SER  15           H        SER  15  -6.260 -11.477  -0.183
  120    HA   SER  15           HA       SER  15  -7.413 -11.921   2.437
  121   1HB   SER  15          2HB       SER  15  -7.239 -13.422  -0.106
  122   2HB   SER  15          1HB       SER  15  -7.252 -14.403   1.359
  123    HG   SER  15           HG       SER  15  -9.175 -13.295   1.966
  124    H    SER  16           H        SER  16  -4.551 -12.994   0.625
  125    HA   SER  16           HA       SER  16  -3.515 -14.553   2.782
  126   1HB   SER  16          2HB       SER  16  -1.347 -14.252   1.268
  127   2HB   SER  16          1HB       SER  16  -2.664 -15.325   0.792
  128    HG   SER  16           HG       SER  16  -1.762 -13.068  -0.408
  129    H    LEU  17           H        LEU  17  -2.070 -11.693   1.226
  130    HA   LEU  17           HA       LEU  17  -0.187 -11.051   3.083
  131   1HB   LEU  17          2HB       LEU  17  -0.281  -9.853   1.034
  132   2HB   LEU  17          1HB       LEU  17  -1.902  -9.278   1.358
  133    HG   LEU  17           HG       LEU  17   0.141  -7.668   1.570
  134   1HD1  LEU  17          1HD1      LEU  17  -2.048  -6.919   2.012
  135   2HD1  LEU  17          2HD1      LEU  17  -1.060  -6.448   3.393
  136   3HD1  LEU  17          3HD1      LEU  17  -2.141  -7.836   3.513
  137   1HD2  LEU  17          1HD2      LEU  17   1.532  -7.868   3.299
  138   2HD2  LEU  17          2HD2      LEU  17   0.907  -9.505   3.479
  139   3HD2  LEU  17          3HD2      LEU  17   0.218  -8.190   4.428
  140    H    SER  18           H        SER  18  -3.617 -10.140   3.199
  141    HA   SER  18           HA       SER  18  -3.514  -8.481   5.442
  142   1HB   SER  18          2HB       SER  18  -5.677 -10.229   4.295
  143   2HB   SER  18          1HB       SER  18  -5.941  -9.327   5.786
  144    HG   SER  18           HG       SER  18  -5.078  -8.164   3.348
  145    H    ALA  19           H        ALA  19  -3.915 -11.992   5.209
  146    HA   ALA  19           HA       ALA  19  -4.301 -12.546   7.922
  147   1HB   ALA  19          1HB       ALA  19  -4.283 -14.053   5.704
  148   2HB   ALA  19          2HB       ALA  19  -4.156 -14.728   7.329
  149   3HB   ALA  19          3HB       ALA  19  -2.702 -14.481   6.361
  150    H    ILE  20           H        ILE  20  -1.372 -12.100   6.029
  151    HA   ILE  20           HA       ILE  20   0.502 -12.910   7.947
  152    HB   ILE  20           HB       ILE  20   0.597 -11.189   5.516
  153   1HG1  ILE  20          2HG1      ILE  20   2.703 -13.145   6.008
  154   2HG1  ILE  20          1HG1      ILE  20   1.083 -13.832   6.077
  155   1HG2  ILE  20          1HG2      ILE  20   2.598 -11.081   7.731
  156   2HG2  ILE  20          2HG2      ILE  20   1.985  -9.781   6.709
  157   3HG2  ILE  20          3HG2      ILE  20   3.138 -10.947   6.057
  158   1HD1  ILE  20          1HD1      ILE  20   2.628 -13.243   3.807
  159   2HD1  ILE  20          2HD1      ILE  20   1.270 -12.119   3.811
  160   3HD1  ILE  20          3HD1      ILE  20   0.975 -13.856   3.874
  161    H    LEU  21           H        LEU  21  -0.562  -9.586   7.152
  162    HA   LEU  21           HA       LEU  21   0.786  -8.223   9.130
  163   1HB   LEU  21          2HB       LEU  21  -2.000  -7.694   8.116
  164   2HB   LEU  21          1HB       LEU  21  -0.990  -6.537   8.962
  165    HG   LEU  21           HG       LEU  21   0.343  -7.657   6.635
  166   1HD1  LEU  21          1HD1      LEU  21  -1.457  -7.736   5.307
  167   2HD1  LEU  21          2HD1      LEU  21  -1.265  -5.983   5.262
  168   3HD1  LEU  21          3HD1      LEU  21  -2.422  -6.716   6.372
  169   1HD2  LEU  21          1HD2      LEU  21  -0.103  -5.053   7.953
  170   2HD2  LEU  21          2HD2      LEU  21   0.239  -5.017   6.223
  171   3HD2  LEU  21          3HD2      LEU  21   1.382  -5.775   7.332
  172    H    GLU  22           H        GLU  22  -2.137 -10.138   9.369
  173    HA   GLU  22           HA       GLU  22  -2.914  -9.302  11.959
  174   1HB   GLU  22          2HB       GLU  22  -3.520 -11.765  10.344
  175   2HB   GLU  22          1HB       GLU  22  -4.169 -11.521  11.958
  176   1HG   GLU  22          2HG       GLU  22  -5.238  -9.450  11.200
  177   2HG   GLU  22          1HG       GLU  22  -4.618  -9.740   9.575
  178    H    GLU  23           H        GLU  23  -0.497 -11.502  10.803
  179    HA   GLU  23           HA       GLU  23  -0.224 -12.931  13.280
  180   1HB   GLU  23          2HB       GLU  23   0.415 -14.145  11.353
  181   2HB   GLU  23          1HB       GLU  23   1.371 -12.810  10.727
  182   1HG   GLU  23          2HG       GLU  23   3.190 -13.446  11.829
  183   2HG   GLU  23          1HG       GLU  23   2.294 -13.752  13.315
  184    H    GLU  24           H        GLU  24   1.289 -10.197  11.674
  185    HA   GLU  24           HA       GLU  24   3.349  -9.908  13.646
  186   1HB   GLU  24          2HB       GLU  24   2.770  -8.811  11.091
  187   2HB   GLU  24          1HB       GLU  24   3.001  -7.487  12.224
  188   1HG   GLU  24          2HG       GLU  24   5.093  -8.021  11.181
  189   2HG   GLU  24          1HG       GLU  24   5.159  -8.462  12.885
  190    H    GLY  25           H        GLY  25   0.076  -8.940  13.388
  191   1HA   GLY  25          2HA       GLY  25  -1.177  -8.054  15.170
  192   2HA   GLY  25          1HA       GLY  25   0.315  -7.478  15.899
  193    H    TYR  26           H        TYR  26  -1.234  -6.994  12.734
  194    HA   TYR  26           HA       TYR  26  -0.892  -4.094  13.113
  195   1HB   TYR  26          2HB       TYR  26  -0.805  -5.848  10.679
  196   2HB   TYR  26          1HB       TYR  26  -1.144  -4.129  10.526
  197    HD1  TYR  26           1HD      TYR  26   0.717  -3.103   9.630
  198    HD2  TYR  26           2HD      TYR  26   1.260  -6.014  12.681
  199    HE1  TYR  26           1HE      TYR  26   3.127  -2.627   9.646
  200    HE2  TYR  26           2HE      TYR  26   3.671  -5.545  12.708
  201    HH   TYR  26           HH       TYR  26   5.214  -3.789  12.098
  202    H    HIS  27           H        HIS  27  -2.505  -3.067  11.241
  203    HA   HIS  27           HA       HIS  27  -5.188  -4.133  11.761
  204   1HB   HIS  27          2HB       HIS  27  -4.097  -1.692  12.766
  205   2HB   HIS  27          1HB       HIS  27  -5.319  -1.283  11.572
  206    HD1  HIS  27           1HD      HIS  27  -7.430  -3.400  12.112
  207    HD2  HIS  27           2HD      HIS  27  -5.401  -1.376  15.120
  208    HE1  HIS  27           1HE      HIS  27  -8.912  -3.546  14.140
  209    HE2  HIS  27           2HE      HIS  27  -7.709  -2.227  15.917
  210    HA   PRO  28           HA       PRO  28  -4.347  -3.365   7.218
  211   1HB   PRO  28          2HB       PRO  28  -5.793  -5.921   7.002
  212   2HB   PRO  28          1HB       PRO  28  -4.257  -5.434   6.281
  213   1HG   PRO  28          2HG       PRO  28  -4.377  -7.203   8.303
  214   2HG   PRO  28          1HG       PRO  28  -3.038  -6.055   8.130
  215   1HD   PRO  28          2HD       PRO  28  -5.380  -5.962   9.986
  216   2HD   PRO  28          1HD       PRO  28  -3.692  -5.500  10.270
  217    H    ASP  29           H        ASP  29  -5.822  -2.505   5.820
  218    HA   ASP  29           HA       ASP  29  -8.634  -2.786   6.561
  219   1HB   ASP  29          2HB       ASP  29  -7.547  -0.559   7.206
  220   2HB   ASP  29          1HB       ASP  29  -7.603  -0.202   5.484
  221    H    THR  30           H        THR  30  -6.469  -3.137   4.147
  222    HA   THR  30           HA       THR  30  -6.550  -3.338   1.888
  223    HB   THR  30           HB       THR  30  -8.134  -4.967   1.136
  224    HG1  THR  30           1HG      THR  30 -10.083  -4.504   1.849
  225   1HG2  THR  30          1HG2      THR  30  -6.931  -6.430   2.282
  226   2HG2  THR  30          2HG2      THR  30  -8.165  -6.337   3.539
  227   3HG2  THR  30          3HG2      THR  30  -6.731  -5.316   3.634
  228    H    ALA  31           H        ALA  31  -7.710  -3.013  -0.151
  229    HA   ALA  31           HA       ALA  31 -10.060  -1.448  -0.303
  230   1HB   ALA  31          1HB       ALA  31  -8.115   0.099   0.560
  231   2HB   ALA  31          2HB       ALA  31  -9.288   0.679  -0.623
  232   3HB   ALA  31          3HB       ALA  31  -7.696   0.137  -1.152
  233    H    LYS  32           H        LYS  32 -10.815  -1.334  -2.419
  234    HA   LYS  32           HA       LYS  32  -9.511  -3.048  -4.316
  235   1HB   LYS  32          2HB       LYS  32 -11.830  -1.192  -4.863
  236   2HB   LYS  32          1HB       LYS  32 -11.396  -2.651  -5.739
  237   1HG   LYS  32          2HG       LYS  32 -12.115  -4.044  -3.979
  238   2HG   LYS  32          1HG       LYS  32 -12.215  -2.691  -2.851
  239   1HD   LYS  32          2HD       LYS  32 -13.933  -1.788  -4.649
  240   2HD   LYS  32          1HD       LYS  32 -14.081  -3.507  -5.019
  241   1HE   LYS  32          2HE       LYS  32 -14.662  -3.986  -2.718
  242   2HE   LYS  32          1HE       LYS  32 -14.413  -2.297  -2.276
  243   1HZ   LYS  32          1HZ       LYS  32 -16.585  -3.485  -3.876
  244   2HZ   LYS  32          2HZ       LYS  32 -16.200  -1.846  -4.042
  245   3HZ   LYS  32          3HZ       LYS  32 -16.690  -2.453  -2.540
  246    H    THR  33           H        THR  33  -9.879  -1.744  -6.764
  247    HA   THR  33           HA       THR  33  -7.527  -0.455  -7.148
  248    HB   THR  33           HB       THR  33  -9.214   0.795  -8.980
  249    HG1  THR  33           1HG      THR  33 -10.986  -0.369  -8.287
  250   1HG2  THR  33          1HG2      THR  33  -7.189  -1.147  -9.018
  251   2HG2  THR  33          2HG2      THR  33  -7.858  -0.242 -10.375
  252   3HG2  THR  33          3HG2      THR  33  -8.546  -1.804  -9.935
  253    H    LEU  34           H        LEU  34  -6.941   1.706  -7.583
  254    HA   LEU  34           HA       LEU  34  -6.961   3.510  -5.701
  255   1HB   LEU  34          2HB       LEU  34  -7.472   4.474  -8.503
  256   2HB   LEU  34          1HB       LEU  34  -6.508   5.241  -7.256
  257    HG   LEU  34           HG       LEU  34  -5.802   2.666  -8.669
  258   1HD1  LEU  34          1HD1      LEU  34  -4.003   4.922  -8.976
  259   2HD1  LEU  34          2HD1      LEU  34  -5.606   5.233  -9.642
  260   3HD1  LEU  34          3HD1      LEU  34  -4.680   3.836 -10.188
  261   1HD2  LEU  34          1HD2      LEU  34  -4.991   3.560  -6.166
  262   2HD2  LEU  34          2HD2      LEU  34  -3.674   4.014  -7.248
  263   3HD2  LEU  34          3HD2      LEU  34  -4.203   2.334  -7.159
  264    H    ARG  35           H        ARG  35  -9.706   3.284  -7.950
  265    HA   ARG  35           HA       ARG  35 -11.151   5.493  -7.144
  266   1HB   ARG  35          2HB       ARG  35 -11.656   3.572  -8.898
  267   2HB   ARG  35          1HB       ARG  35 -12.621   2.929  -7.575
  268   1HG   ARG  35          2HG       ARG  35 -14.179   4.555  -7.737
  269   2HG   ARG  35          1HG       ARG  35 -13.006   5.786  -8.211
  270   1HD   ARG  35          2HD       ARG  35 -14.153   5.529 -10.177
  271   2HD   ARG  35          1HD       ARG  35 -12.865   4.348 -10.403
  272    HE   ARG  35           HE       ARG  35 -15.230   3.254  -9.192
  273   1HH1  ARG  35          1HH1      ARG  35 -13.669   4.040 -12.214
  274   2HH1  ARG  35          2HH1      ARG  35 -14.574   2.880 -13.126
  275   1HH2  ARG  35          1HH2      ARG  35 -16.421   1.728 -10.392
  276   2HH2  ARG  35          2HH2      ARG  35 -16.137   1.568 -12.093
  277    H    GLU  36           H        GLU  36 -11.531   2.191  -5.854
  278    HA   GLU  36           HA       GLU  36 -13.159   2.976  -3.680
  279   1HB   GLU  36          2HB       GLU  36 -12.548   0.599  -4.808
  280   2HB   GLU  36          1HB       GLU  36 -11.522   0.529  -3.382
  281   1HG   GLU  36          2HG       GLU  36 -13.499  -0.491  -2.715
  282   2HG   GLU  36          1HG       GLU  36 -13.618   1.142  -2.062
  283    H    ALA  37           H        ALA  37  -9.668   2.475  -4.027
  284    HA   ALA  37           HA       ALA  37  -8.990   2.649  -1.306
  285   1HB   ALA  37          1HB       ALA  37  -7.082   3.840  -3.214
  286   2HB   ALA  37          2HB       ALA  37  -7.584   2.186  -3.567
  287   3HB   ALA  37          3HB       ALA  37  -6.844   2.570  -2.013
  288    H    GLU  38           H        GLU  38  -8.752   5.220  -3.781
  289    HA   GLU  38           HA       GLU  38  -8.117   7.339  -2.182
  290   1HB   GLU  38          2HB       GLU  38  -9.727   7.098  -4.674
  291   2HB   GLU  38          1HB       GLU  38  -9.717   8.642  -3.832
  292   1HG   GLU  38          2HG       GLU  38  -7.196   8.517  -3.915
  293   2HG   GLU  38          1HG       GLU  38  -7.396   7.172  -5.035
  294    H    LYS  39           H        LYS  39 -11.335   5.967  -2.719
  295    HA   LYS  39           HA       LYS  39 -12.772   7.868  -1.223
  296   1HB   LYS  39          2HB       LYS  39 -13.877   6.254  -2.695
  297   2HB   LYS  39          1HB       LYS  39 -13.351   4.931  -1.664
  298   1HG   LYS  39          2HG       LYS  39 -14.981   7.111  -0.466
  299   2HG   LYS  39          1HG       LYS  39 -15.775   5.912  -1.488
  300   1HD   LYS  39          2HD       LYS  39 -14.500   4.195  -0.010
  301   2HD   LYS  39          1HD       LYS  39 -14.360   5.541   1.122
  302   1HE   LYS  39          2HE       LYS  39 -16.552   5.494   1.650
  303   2HE   LYS  39          1HE       LYS  39 -17.046   5.108   0.002
  304   1HZ   LYS  39          1HZ       LYS  39 -16.423   3.334   2.217
  305   2HZ   LYS  39          2HZ       LYS  39 -15.861   2.837   0.701
  306   3HZ   LYS  39          3HZ       LYS  39 -17.510   3.129   0.937
  307    H    LYS  40           H        LYS  40 -11.477   4.683  -0.297
  308    HA   LYS  40           HA       LYS  40 -12.157   4.844   2.424
  309   1HB   LYS  40          2HB       LYS  40 -10.033   3.277   0.975
  310   2HB   LYS  40          1HB       LYS  40 -10.336   3.102   2.698
  311   1HG   LYS  40          2HG       LYS  40 -12.758   2.610   2.030
  312   2HG   LYS  40          1HG       LYS  40 -12.121   2.395   0.399
  313   1HD   LYS  40          2HD       LYS  40 -11.307   0.377   0.894
  314   2HD   LYS  40          1HD       LYS  40 -10.531   0.976   2.362
  315   1HE   LYS  40          2HE       LYS  40 -13.478   0.390   2.198
  316   2HE   LYS  40          1HE       LYS  40 -12.290  -0.828   2.662
  317   1HZ   LYS  40          1HZ       LYS  40 -12.701   1.766   4.050
  318   2HZ   LYS  40          2HZ       LYS  40 -11.626   0.545   4.514
  319   3HZ   LYS  40          3HZ       LYS  40 -13.294   0.274   4.583
  320    H    ILE  41           H        ILE  41  -9.342   5.992   0.650
  321    HA   ILE  41           HA       ILE  41  -7.985   6.750   3.111
  322    HB   ILE  41           HB       ILE  41  -7.137   7.276   0.269
  323   1HG1  ILE  41          2HG1      ILE  41  -6.276   5.033   2.106
  324   2HG1  ILE  41          1HG1      ILE  41  -7.452   4.851   0.807
  325   1HG2  ILE  41          1HG2      ILE  41  -5.961   7.810   2.915
  326   2HG2  ILE  41          2HG2      ILE  41  -5.711   8.630   1.372
  327   3HG2  ILE  41          3HG2      ILE  41  -4.864   7.122   1.717
  328   1HD1  ILE  41          1HD1      ILE  41  -5.126   6.052  -0.275
  329   2HD1  ILE  41          2HD1      ILE  41  -5.813   4.464  -0.615
  330   3HD1  ILE  41          3HD1      ILE  41  -4.637   4.656   0.686
  331    H    LYS  42           H        LYS  42 -10.339   8.117   1.182
  332    HA   LYS  42           HA       LYS  42  -9.541  10.795   0.992
  333   1HB   LYS  42          2HB       LYS  42 -11.611   9.496   0.016
  334   2HB   LYS  42          1HB       LYS  42 -12.402  10.123   1.454
  335   1HG   LYS  42          2HG       LYS  42 -11.243  12.370   0.555
  336   2HG   LYS  42          1HG       LYS  42 -11.488  11.519  -0.971
  337   1HD   LYS  42          2HD       LYS  42 -13.886  11.126   0.245
  338   2HD   LYS  42          1HD       LYS  42 -13.445  12.717   0.866
  339   1HE   LYS  42          2HE       LYS  42 -12.902  12.528  -1.961
  340   2HE   LYS  42          1HE       LYS  42 -14.582  12.119  -1.615
  341   1HZ   LYS  42          1HZ       LYS  42 -14.765  14.211  -0.374
  342   2HZ   LYS  42          2HZ       LYS  42 -14.370  14.469  -1.999
  343   3HZ   LYS  42          3HZ       LYS  42 -13.179  14.607  -0.807
  344    H    GLU  43           H        GLU  43 -10.394   8.944   3.724
  345    HA   GLU  43           HA       GLU  43 -10.483  11.387   5.342
  346   1HB   GLU  43          2HB       GLU  43 -12.180   8.958   5.907
  347   2HB   GLU  43          1HB       GLU  43 -12.225  10.506   6.738
  348   1HG   GLU  43          2HG       GLU  43 -13.418  11.519   5.090
  349   2HG   GLU  43          1HG       GLU  43 -12.756  10.489   3.823
  350    H    LEU  44           H        LEU  44 -10.170   7.842   5.509
  351    HA   LEU  44           HA       LEU  44  -8.919   7.694   7.992
  352   1HB   LEU  44          2HB       LEU  44  -9.296   5.941   5.690
  353   2HB   LEU  44          1HB       LEU  44  -7.800   5.620   6.545
  354    HG   LEU  44           HG       LEU  44  -9.668   4.209   7.320
  355   1HD1  LEU  44          1HD1      LEU  44  -8.912   4.200   9.443
  356   2HD1  LEU  44          2HD1      LEU  44  -9.174   5.930   9.660
  357   3HD1  LEU  44          3HD1      LEU  44  -7.744   5.356   8.803
  358   1HD2  LEU  44          1HD2      LEU  44 -11.512   5.155   8.547
  359   2HD2  LEU  44          2HD2      LEU  44 -11.454   5.881   6.941
  360   3HD2  LEU  44          3HD2      LEU  44 -10.865   6.782   8.338
  361    H    PHE  45           H        PHE  45  -6.899   8.026   8.716
  362    HA   PHE  45           HA       PHE  45  -4.946   9.088   6.815
  363   1HB   PHE  45          2HB       PHE  45  -5.506  10.412   8.845
  364   2HB   PHE  45          1HB       PHE  45  -4.875   9.106   9.841
  365    HD1  PHE  45           1HD      PHE  45  -3.900  11.489   7.163
  366    HD2  PHE  45           2HD      PHE  45  -2.627   9.049  10.410
  367    HE1  PHE  45           1HE      PHE  45  -1.649  12.469   7.011
  368    HE2  PHE  45           2HE      PHE  45  -0.373  10.027  10.264
  369    HZ   PHE  45           HZ       PHE  45   0.118  11.739   8.563
  370    H    PHE  46           H        PHE  46  -4.869   6.673   6.151
  371    HA   PHE  46           HA       PHE  46  -3.622   4.745   7.732
  372   1HB   PHE  46          2HB       PHE  46  -3.733   5.152   4.750
  373   2HB   PHE  46          1HB       PHE  46  -2.893   3.781   5.465
  374    HD1  PHE  46           1HD      PHE  46  -5.879   4.798   4.053
  375    HD2  PHE  46           2HD      PHE  46  -4.378   2.519   7.318
  376    HE1  PHE  46           1HE      PHE  46  -8.002   3.557   4.157
  377    HE2  PHE  46           2HE      PHE  46  -6.498   1.272   7.427
  378    HZ   PHE  46           HZ       PHE  46  -8.313   1.794   5.846
  379    HA   PRO  47           HA       PRO  47   0.495   6.508   7.937
  380   1HB   PRO  47          2HB       PRO  47   1.669   4.494   9.307
  381   2HB   PRO  47          1HB       PRO  47   0.574   5.647  10.079
  382   1HG   PRO  47          2HG       PRO  47   0.026   2.872   9.107
  383   2HG   PRO  47          1HG       PRO  47  -0.487   3.648  10.616
  384   1HD   PRO  47          2HD       PRO  47  -2.119   3.390   8.458
  385   2HD   PRO  47          1HD       PRO  47  -2.242   4.740   9.604
  386    H    VAL  48           H        VAL  48  -0.332   3.375   6.673
  387    HA   VAL  48           HA       VAL  48   1.898   3.548   4.796
  388    HB   VAL  48           HB       VAL  48   1.244   0.909   6.062
  389   1HG1  VAL  48          1HG1      VAL  48   3.158   1.938   4.120
  390   2HG1  VAL  48          2HG1      VAL  48   2.616   0.286   4.412
  391   3HG1  VAL  48          3HG1      VAL  48   3.907   0.977   5.395
  392   1HG2  VAL  48          1HG2      VAL  48   1.845   2.132   7.955
  393   2HG2  VAL  48          2HG2      VAL  48   3.062   3.061   7.080
  394   3HG2  VAL  48          3HG2      VAL  48   3.347   1.359   7.447
  395    H    ILE  49           H        ILE  49   1.378   2.993   2.791
  396    HA   ILE  49           HA       ILE  49  -1.214   1.679   2.323
  397    HB   ILE  49           HB       ILE  49   0.103   3.617   0.424
  398   1HG1  ILE  49          2HG1      ILE  49  -0.426   4.780   2.528
  399   2HG1  ILE  49          1HG1      ILE  49  -1.475   5.313   1.219
  400   1HG2  ILE  49          1HG2      ILE  49  -2.387   2.040   0.465
  401   2HG2  ILE  49          2HG2      ILE  49  -1.405   2.581  -0.895
  402   3HG2  ILE  49          3HG2      ILE  49  -2.529   3.697  -0.119
  403   1HD1  ILE  49          1HD1      ILE  49  -2.119   3.726   3.644
  404   2HD1  ILE  49          2HD1      ILE  49  -3.072   3.470   2.183
  405   3HD1  ILE  49          3HD1      ILE  49  -2.985   5.076   2.908
  406    H    VAL  50           H        VAL  50  -1.343   0.195   0.630
  407    HA   VAL  50           HA       VAL  50   1.175  -0.563  -0.671
  408    HB   VAL  50           HB       VAL  50  -0.675  -2.518   0.705
  409   1HG1  VAL  50          1HG1      VAL  50   1.572  -2.855  -1.218
  410   2HG1  VAL  50          2HG1      VAL  50   0.071  -3.767  -1.065
  411   3HG1  VAL  50          3HG1      VAL  50   1.387  -4.036   0.078
  412   1HG2  VAL  50          1HG2      VAL  50   0.974  -2.836   2.320
  413   2HG2  VAL  50          2HG2      VAL  50   0.959  -1.089   2.084
  414   3HG2  VAL  50          3HG2      VAL  50   2.220  -2.067   1.335
  415    H    LEU  51           H        LEU  51   0.702  -0.146  -2.726
  416    HA   LEU  51           HA       LEU  51  -1.944  -0.758  -3.777
  417   1HB   LEU  51          2HB       LEU  51  -0.956   1.384  -4.370
  418   2HB   LEU  51          1HB       LEU  51   0.450   0.579  -5.040
  419    HG   LEU  51           HG       LEU  51  -0.889  -0.365  -6.831
  420   1HD1  LEU  51          1HD1      LEU  51  -2.981  -0.779  -5.843
  421   2HD1  LEU  51          2HD1      LEU  51  -3.278   0.470  -7.052
  422   3HD1  LEU  51          3HD1      LEU  51  -3.172   0.903  -5.346
  423   1HD2  LEU  51          1HD2      LEU  51  -0.101   2.197  -6.652
  424   2HD2  LEU  51          2HD2      LEU  51  -1.830   2.430  -6.905
  425   3HD2  LEU  51          3HD2      LEU  51  -0.883   1.517  -8.079
  426    H    ASP  52           H        ASP  52  -1.812  -3.042  -3.660
  427    HA   ASP  52           HA       ASP  52   0.219  -4.557  -4.909
  428   1HB   ASP  52          2HB       ASP  52  -1.740  -5.193  -3.204
  429   2HB   ASP  52          1HB       ASP  52  -2.523  -5.690  -4.700
  430    H    VAL  53           H        VAL  53   0.309  -3.240  -6.916
  431    HA   VAL  53           HA       VAL  53  -1.678  -3.087  -8.833
  432    HB   VAL  53           HB       VAL  53   0.315  -1.828  -9.189
  433   1HG1  VAL  53          1HG1      VAL  53   2.463  -2.601  -9.174
  434   2HG1  VAL  53          2HG1      VAL  53   2.008  -4.207  -9.739
  435   3HG1  VAL  53          3HG1      VAL  53   1.716  -3.747  -8.065
  436   1HG2  VAL  53          1HG2      VAL  53   0.431  -2.036 -11.432
  437   2HG2  VAL  53          2HG2      VAL  53  -0.878  -3.193 -11.177
  438   3HG2  VAL  53          3HG2      VAL  53   0.781  -3.764 -11.362
  439    H    TRP  54           H        TRP  54  -2.873  -5.022  -8.893
  440    HA   TRP  54           HA       TRP  54  -1.529  -7.459  -9.740
  441   1HB   TRP  54          2HB       TRP  54  -3.260  -7.694  -8.060
  442   2HB   TRP  54          1HB       TRP  54  -4.428  -6.879  -9.093
  443    HD1  TRP  54           HD       TRP  54  -6.109  -8.612  -9.929
  444    HE1  TRP  54           1HE      TRP  54  -5.990 -11.018 -10.835
  445    HE3  TRP  54           3HE      TRP  54  -1.094  -9.425  -9.401
  446    HZ2  TRP  54           2HZ      TRP  54  -4.025 -13.000 -11.268
  447    HZ3  TRP  54           3HZ      TRP  54  -0.171 -11.603 -10.084
  448    HH2  TRP  54           HH       TRP  54  -1.608 -13.352 -10.999
  449    H    MET  55           H        MET  55  -4.634  -6.201 -10.889
  450    HA   MET  55           HA       MET  55  -3.603  -5.960 -13.598
  451   1HB   MET  55          2HB       MET  55  -5.524  -8.057 -12.697
  452   2HB   MET  55          1HB       MET  55  -5.770  -7.329 -14.279
  453   1HG   MET  55          2HG       MET  55  -3.032  -8.238 -13.676
  454   2HG   MET  55          1HG       MET  55  -4.254  -9.495 -13.851
  455   1HE   MET  55          1HE       MET  55  -2.264  -6.791 -15.082
  456   2HE   MET  55          2HE       MET  55  -3.080  -6.187 -16.524
  457   3HE   MET  55          3HE       MET  55  -1.823  -7.415 -16.670
  458    HA   PRO  56           HA       PRO  56  -7.181  -3.115 -12.353
  459   1HB   PRO  56          2HB       PRO  56  -5.881  -0.889 -11.616
  460   2HB   PRO  56          1HB       PRO  56  -6.160  -2.213 -10.478
  461   1HG   PRO  56          2HG       PRO  56  -3.690  -1.537 -12.029
  462   2HG   PRO  56          1HG       PRO  56  -3.845  -2.021 -10.331
  463   1HD   PRO  56          2HD       PRO  56  -3.135  -3.738 -12.340
  464   2HD   PRO  56          1HD       PRO  56  -3.949  -4.248 -10.848
  465    H    ASP  57           H        ASP  57  -7.128  -0.524 -13.082
  466    HA   ASP  57           HA       ASP  57  -5.766  -0.213 -15.620
  467   1HB   ASP  57          2HB       ASP  57  -8.786  -0.249 -15.478
  468   2HB   ASP  57          1HB       ASP  57  -7.831   0.179 -16.894
  469    H    GLY  58           H        GLY  58  -5.812   1.137 -13.017
  470   1HA   GLY  58          2HA       GLY  58  -7.021   3.723 -13.727
  471   2HA   GLY  58          1HA       GLY  58  -6.521   3.238 -12.113
  472    H    ASP  59           H        ASP  59  -5.236   5.032 -11.751
  473    HA   ASP  59           HA       ASP  59  -2.740   5.084 -13.309
  474   1HB   ASP  59          2HB       ASP  59  -4.217   7.504 -12.251
  475   2HB   ASP  59          1HB       ASP  59  -2.673   7.526 -13.099
  476    H    GLY  60           H        GLY  60  -1.898   3.727 -11.613
  477   1HA   GLY  60          2HA       GLY  60  -1.881   4.346  -8.896
  478   2HA   GLY  60          1HA       GLY  60  -0.649   3.400  -9.717
  479    H    VAL  61           H        VAL  61   0.364   5.370 -11.445
  480    HA   VAL  61           HA       VAL  61   2.244   6.629  -9.812
  481    HB   VAL  61           HB       VAL  61   1.423   7.335 -12.637
  482   1HG1  VAL  61          1HG1      VAL  61   3.851   8.058 -11.018
  483   2HG1  VAL  61          2HG1      VAL  61   2.667   9.148 -11.739
  484   3HG1  VAL  61          3HG1      VAL  61   3.758   8.224 -12.771
  485   1HG2  VAL  61          1HG2      VAL  61   3.703   5.590 -11.722
  486   2HG2  VAL  61          2HG2      VAL  61   3.159   5.870 -13.375
  487   3HG2  VAL  61          3HG2      VAL  61   2.141   4.969 -12.253
  488    H    ASN  62           H        ASN  62  -0.783   7.783 -11.211
  489    HA   ASN  62           HA       ASN  62  -0.426  10.485 -10.317
  490   1HB   ASN  62          2HB       ASN  62  -2.182   9.146 -12.064
  491   2HB   ASN  62          1HB       ASN  62  -3.195   9.787 -10.774
  492   1HD2  ASN  62          1HD2      ASN  62  -0.279  10.970 -12.414
  493   2HD2  ASN  62          2HD2      ASN  62  -0.950  12.494 -12.873
  494    H    PHE  63           H        PHE  63  -1.605   7.550  -8.963
  495    HA   PHE  63           HA       PHE  63  -3.206   8.713  -6.897
  496   1HB   PHE  63          2HB       PHE  63  -3.573   6.418  -7.732
  497   2HB   PHE  63          1HB       PHE  63  -2.001   5.945  -7.101
  498    HD1  PHE  63           1HD      PHE  63  -4.553   8.099  -5.490
  499    HD2  PHE  63           2HD      PHE  63  -2.545   4.347  -5.500
  500    HE1  PHE  63           1HE      PHE  63  -5.598   7.538  -3.334
  501    HE2  PHE  63           2HE      PHE  63  -3.587   3.780  -3.345
  502    HZ   PHE  63           HZ       PHE  63  -5.117   5.374  -2.262
  503    H    ILE  64           H        ILE  64   0.146   7.827  -7.278
  504    HA   ILE  64           HA       ILE  64   1.058   7.578  -4.702
  505    HB   ILE  64           HB       ILE  64   2.561   9.249  -6.705
  506   1HG1  ILE  64          2HG1      ILE  64   1.862   7.386  -8.015
  507   2HG1  ILE  64          1HG1      ILE  64   3.513   7.045  -7.520
  508   1HG2  ILE  64          1HG2      ILE  64   4.428   8.750  -5.520
  509   2HG2  ILE  64          2HG2      ILE  64   3.831   7.165  -5.032
  510   3HG2  ILE  64          3HG2      ILE  64   3.248   8.614  -4.216
  511   1HD1  ILE  64          1HD1      ILE  64   1.092   5.953  -6.118
  512   2HD1  ILE  64          2HD1      ILE  64   2.776   5.480  -5.892
  513   3HD1  ILE  64          3HD1      ILE  64   1.952   5.112  -7.408
  514    H    ASP  65           H        ASP  65   0.205  10.536  -6.412
  515    HA   ASP  65           HA       ASP  65   1.180  12.316  -4.419
  516   1HB   ASP  65          2HB       ASP  65   0.790  13.007  -6.761
  517   2HB   ASP  65          1HB       ASP  65  -0.941  12.787  -6.527
  518    H    PHE  66           H        PHE  66  -2.003  10.910  -5.109
  519    HA   PHE  66           HA       PHE  66  -3.569  12.282  -3.312
  520   1HB   PHE  66          2HB       PHE  66  -4.364  10.596  -4.960
  521   2HB   PHE  66          1HB       PHE  66  -3.731   9.326  -3.923
  522    HD1  PHE  66           1HD      PHE  66  -4.677   9.153  -1.558
  523    HD2  PHE  66           2HD      PHE  66  -6.514  11.410  -4.662
  524    HE1  PHE  66           1HE      PHE  66  -6.813   9.081  -0.341
  525    HE2  PHE  66           2HE      PHE  66  -8.653  11.343  -3.450
  526    HZ   PHE  66           HZ       PHE  66  -8.805  10.177  -1.287
  527    H    ILE  67           H        ILE  67  -1.409   9.549  -2.732
  528    HA   ILE  67           HA       ILE  67  -2.124   9.076  -0.049
  529    HB   ILE  67           HB       ILE  67   0.417   8.521  -1.582
  530   1HG1  ILE  67          2HG1      ILE  67  -0.411   6.136  -1.173
  531   2HG1  ILE  67          1HG1      ILE  67  -1.927   6.866  -0.654
  532   1HG2  ILE  67          1HG2      ILE  67   1.273   8.670   0.575
  533   2HG2  ILE  67          2HG2      ILE  67   0.882   6.957   0.423
  534   3HG2  ILE  67          3HG2      ILE  67  -0.197   8.032   1.310
  535   1HD1  ILE  67          1HD1      ILE  67  -0.694   7.375  -3.342
  536   2HD1  ILE  67          2HD1      ILE  67  -2.327   7.767  -2.804
  537   3HD1  ILE  67          3HD1      ILE  67  -1.853   6.084  -3.029
  538    H    LYS  68           H        LYS  68   0.554  10.981  -1.444
  539    HA   LYS  68           HA       LYS  68   1.333  12.037   1.107
  540   1HB   LYS  68          2HB       LYS  68   2.069  12.822  -1.718
  541   2HB   LYS  68          1HB       LYS  68   2.768  13.564  -0.285
  542   1HG   LYS  68          2HG       LYS  68   2.990  10.733  -0.049
  543   2HG   LYS  68          1HG       LYS  68   3.593  11.226  -1.632
  544   1HD   LYS  68          2HD       LYS  68   5.132  12.772  -0.629
  545   2HD   LYS  68          1HD       LYS  68   4.435  12.499   0.968
  546   1HE   LYS  68          2HE       LYS  68   5.706  10.701   1.306
  547   2HE   LYS  68          1HE       LYS  68   5.279  10.020  -0.264
  548   1HZ   LYS  68          1HZ       LYS  68   7.508  11.831   0.415
  549   2HZ   LYS  68          2HZ       LYS  68   6.939  11.721  -1.175
  550   3HZ   LYS  68          3HZ       LYS  68   7.555  10.349  -0.399
  551    H    GLU  69           H        GLU  69  -1.214  12.695  -0.965
  552    HA   GLU  69           HA       GLU  69  -1.382  15.531  -0.585
  553   1HB   GLU  69          2HB       GLU  69  -2.354  14.353  -2.551
  554   2HB   GLU  69          1HB       GLU  69  -3.521  13.600  -1.477
  555   1HG   GLU  69          2HG       GLU  69  -4.133  16.022  -0.824
  556   2HG   GLU  69          1HG       GLU  69  -3.304  16.456  -2.319
  557    H    ASN  70           H        ASN  70  -3.065  12.703   0.701
  558    HA   ASN  70           HA       ASN  70  -4.071  14.369   2.910
  559   1HB   ASN  70          2HB       ASN  70  -5.596  12.093   3.006
  560   2HB   ASN  70          1HB       ASN  70  -6.072  13.588   2.209
  561   1HD2  ASN  70          1HD2      ASN  70  -5.074  13.748  -0.092
  562   2HD2  ASN  70          2HD2      ASN  70  -5.265  12.342  -1.072
  563    H    SER  71           H        SER  71  -1.504  12.711   2.476
  564    HA   SER  71           HA       SER  71  -1.318  11.774   5.169
  565   1HB   SER  71          2HB       SER  71  -1.943   9.874   3.031
  566   2HB   SER  71          1HB       SER  71  -0.493   9.442   3.937
  567    HG   SER  71           HG       SER  71  -3.110   9.873   4.932
  568    HA   PRO  72           HA       PRO  72   2.592  13.123   2.997
  569   1HB   PRO  72          2HB       PRO  72   2.840  15.035   5.189
  570   2HB   PRO  72          1HB       PRO  72   2.822  15.334   3.450
  571   1HG   PRO  72          2HG       PRO  72   0.787  16.058   5.087
  572   2HG   PRO  72          1HG       PRO  72   0.546  15.610   3.390
  573   1HD   PRO  72          2HD       PRO  72   0.079  13.995   5.865
  574   2HD   PRO  72          1HD       PRO  72  -0.893  14.092   4.381
  575    H    ASP  73           H        ASP  73   1.668  12.197   6.149
  576    HA   ASP  73           HA       ASP  73   4.438  11.485   6.835
  577   1HB   ASP  73          2HB       ASP  73   3.173  13.000   8.405
  578   2HB   ASP  73          1HB       ASP  73   2.096  11.646   8.730
  579    H    SER  74           H        SER  74   3.038   9.906   5.013
  580    HA   SER  74           HA       SER  74   2.490   7.481   6.595
  581   1HB   SER  74          2HB       SER  74   0.489   8.332   5.430
  582   2HB   SER  74          1HB       SER  74   1.348   8.235   3.894
  583    HG   SER  74           HG       SER  74  -0.080   6.368   4.917
  584    H    VAL  75           H        VAL  75   2.409   5.797   4.269
  585    HA   VAL  75           HA       VAL  75   5.069   6.012   3.096
  586    HB   VAL  75           HB       VAL  75   4.283   3.513   4.598
  587   1HG1  VAL  75          1HG1      VAL  75   6.277   4.116   2.576
  588   2HG1  VAL  75          2HG1      VAL  75   5.772   2.558   3.231
  589   3HG1  VAL  75          3HG1      VAL  75   7.009   3.504   4.060
  590   1HG2  VAL  75          1HG2      VAL  75   4.808   5.093   6.258
  591   2HG2  VAL  75          2HG2      VAL  75   6.118   5.788   5.304
  592   3HG2  VAL  75          3HG2      VAL  75   6.298   4.184   6.014
  593    H    VAL  76           H        VAL  76   5.268   5.135   1.142
  594    HA   VAL  76           HA       VAL  76   2.956   3.631   0.088
  595    HB   VAL  76           HB       VAL  76   4.680   5.281  -1.717
  596   1HG1  VAL  76          1HG1      VAL  76   2.629   3.568  -2.183
  597   2HG1  VAL  76          2HG1      VAL  76   3.091   4.891  -3.254
  598   3HG1  VAL  76          3HG1      VAL  76   1.777   5.109  -2.099
  599   1HG2  VAL  76          1HG2      VAL  76   2.764   6.295   0.289
  600   2HG2  VAL  76          2HG2      VAL  76   2.616   6.957  -1.339
  601   3HG2  VAL  76          3HG2      VAL  76   4.144   7.091  -0.468
  602    H    ILE  77           H        ILE  77   3.791   1.591   0.315
  603    HA   ILE  77           HA       ILE  77   6.441   0.897  -0.501
  604    HB   ILE  77           HB       ILE  77   4.102  -0.958  -0.037
  605   1HG1  ILE  77          2HG1      ILE  77   4.462   0.470   1.917
  606   2HG1  ILE  77          1HG1      ILE  77   4.971  -1.181   2.259
  607   1HG2  ILE  77          1HG2      ILE  77   5.521  -2.683  -0.228
  608   2HG2  ILE  77          2HG2      ILE  77   6.821  -1.836   0.610
  609   3HG2  ILE  77          3HG2      ILE  77   6.539  -1.541  -1.105
  610   1HD1  ILE  77          1HD1      ILE  77   7.318  -0.302   1.558
  611   2HD1  ILE  77          2HD1      ILE  77   6.684   0.041   3.169
  612   3HD1  ILE  77          3HD1      ILE  77   6.615   1.276   1.912
  613    H    VAL  78           H        VAL  78   3.231   0.048  -1.815
  614    HA   VAL  78           HA       VAL  78   2.565  -0.617  -3.890
  615    HB   VAL  78           HB       VAL  78   4.792   1.167  -4.882
  616   1HG1  VAL  78          1HG1      VAL  78   2.133   0.458  -6.117
  617   2HG1  VAL  78          2HG1      VAL  78   3.680  -0.259  -6.567
  618   3HG1  VAL  78          3HG1      VAL  78   3.395   1.462  -6.833
  619   1HG2  VAL  78          1HG2      VAL  78   2.225   1.794  -3.554
  620   2HG2  VAL  78          2HG2      VAL  78   2.638   2.753  -4.976
  621   3HG2  VAL  78          3HG2      VAL  78   3.736   2.704  -3.597
  622    H    ILE  79           H        ILE  79   3.077  -2.775  -3.916
  623    HA   ILE  79           HA       ILE  79   5.711  -3.517  -4.996
  624    HB   ILE  79           HB       ILE  79   3.899  -5.567  -3.807
  625   1HG1  ILE  79          2HG1      ILE  79   5.633  -3.763  -2.115
  626   2HG1  ILE  79          1HG1      ILE  79   3.884  -3.612  -2.233
  627   1HG2  ILE  79          1HG2      ILE  79   5.787  -6.796  -3.605
  628   2HG2  ILE  79          2HG2      ILE  79   6.777  -5.402  -3.172
  629   3HG2  ILE  79          3HG2      ILE  79   6.364  -5.701  -4.860
  630   1HD1  ILE  79          1HD1      ILE  79   3.821  -4.956  -0.467
  631   2HD1  ILE  79          2HD1      ILE  79   5.501  -5.453  -0.677
  632   3HD1  ILE  79          3HD1      ILE  79   4.223  -6.254  -1.591
  633    H    THR  80           H        THR  80   4.588  -6.265  -5.602
  634    HA   THR  80           HA       THR  80   3.845  -7.368  -7.441
  635    HB   THR  80           HB       THR  80   1.688  -5.674  -8.273
  636    HG1  THR  80           1HG      THR  80   1.620  -4.621  -6.380
  637   1HG2  THR  80          1HG2      THR  80   0.386  -7.492  -7.922
  638   2HG2  THR  80          2HG2      THR  80   1.217  -7.945  -6.434
  639   3HG2  THR  80          3HG2      THR  80   1.960  -8.284  -7.997
  640    H    GLY  81           H        GLY  81   3.132  -7.034  -9.843
  641   1HA   GLY  81          2HA       GLY  81   3.320  -5.322 -11.673
  642   2HA   GLY  81          1HA       GLY  81   4.878  -4.928 -10.960
  643    H    HIS  82           H        HIS  82   4.032  -5.994 -13.656
  644    HA   HIS  82           HA       HIS  82   4.812  -8.652 -13.977
  645   1HB   HIS  82          2HB       HIS  82   5.163  -6.385 -15.950
  646   2HB   HIS  82          1HB       HIS  82   5.156  -8.102 -16.337
  647    HD1  HIS  82           1HD      HIS  82   2.619  -8.191 -14.068
  648    HD2  HIS  82           2HD      HIS  82   2.898  -6.367 -17.791
  649    HE1  HIS  82           1HE      HIS  82   0.248  -7.880 -14.843
  650    HE2  HIS  82           2HE      HIS  82   0.439  -6.692 -17.057
  651    H    GLY  83           H        GLY  83   6.789  -5.765 -14.702
  652   1HA   GLY  83          2HA       GLY  83   9.183  -7.432 -14.256
  653   2HA   GLY  83          1HA       GLY  83   9.129  -6.014 -15.293
  654    H    SER  84           H        SER  84   7.596  -4.443 -13.354
  655    HA   SER  84           HA       SER  84   7.998  -2.922 -11.712
  656   1HB   SER  84          2HB       SER  84   9.213  -5.430 -10.614
  657   2HB   SER  84          1HB       SER  84   9.442  -3.912  -9.744
  658    HG   SER  84           HG       SER  84   7.587  -4.766  -8.948
  659    H    VAL  85           H        VAL  85   9.512  -2.423 -13.839
  660    HA   VAL  85           HA       VAL  85  12.118  -1.673 -12.688
  661    HB   VAL  85           HB       VAL  85  13.006  -1.805 -15.067
  662   1HG1  VAL  85          1HG1      VAL  85  12.900  -4.484 -14.863
  663   2HG1  VAL  85          2HG1      VAL  85  12.389  -4.032 -13.237
  664   3HG1  VAL  85          3HG1      VAL  85  13.939  -3.470 -13.861
  665   1HG2  VAL  85          1HG2      VAL  85  11.844  -3.336 -16.586
  666   2HG2  VAL  85          2HG2      VAL  85  10.860  -1.919 -16.219
  667   3HG2  VAL  85          3HG2      VAL  85  10.511  -3.461 -15.437
  668    H    ASP  86           H        ASP  86   9.603  -0.886 -15.056
  669    HA   ASP  86           HA       ASP  86  10.640   1.855 -15.193
  670   1HB   ASP  86          2HB       ASP  86  10.292   0.696 -17.341
  671   2HB   ASP  86          1HB       ASP  86   8.587   0.493 -16.948
  672    H    THR  87           H        THR  87   7.976  -0.035 -14.033
  673    HA   THR  87           HA       THR  87   6.255   2.268 -13.666
  674    HB   THR  87           HB       THR  87   5.578  -0.258 -14.066
  675    HG1  THR  87           1HG      THR  87   4.180   1.332 -12.186
  676   1HG2  THR  87          1HG2      THR  87   6.628  -1.180 -12.058
  677   2HG2  THR  87          2HG2      THR  87   4.877  -1.398 -12.045
  678   3HG2  THR  87          3HG2      THR  87   5.617  -0.139 -11.057
  679    H    ALA  88           H        ALA  88   8.471   0.309 -11.833
  680    HA   ALA  88           HA       ALA  88   7.848   1.185  -9.240
  681   1HB   ALA  88          1HB       ALA  88  10.324   0.619  -8.835
  682   2HB   ALA  88          2HB       ALA  88  10.341   0.115 -10.525
  683   3HB   ALA  88          3HB       ALA  88   9.260  -0.679  -9.379
  684    H    VAL  89           H        VAL  89  10.409   2.245 -11.444
  685    HA   VAL  89           HA       VAL  89  11.291   4.424  -9.935
  686    HB   VAL  89           HB       VAL  89  12.440   5.180 -11.910
  687   1HG1  VAL  89          1HG1      VAL  89  13.121   3.026 -10.749
  688   2HG1  VAL  89          2HG1      VAL  89  13.742   3.273 -12.382
  689   3HG1  VAL  89          3HG1      VAL  89  12.384   2.181 -12.111
  690   1HG2  VAL  89          1HG2      VAL  89  11.885   3.632 -14.034
  691   2HG2  VAL  89          2HG2      VAL  89  11.120   5.195 -13.751
  692   3HG2  VAL  89          3HG2      VAL  89  10.284   3.710 -13.298
  693    H    LYS  90           H        LYS  90   8.577   4.095 -12.107
  694    HA   LYS  90           HA       LYS  90   8.170   6.923 -12.416
  695   1HB   LYS  90          2HB       LYS  90   7.463   5.265 -14.117
  696   2HB   LYS  90          1HB       LYS  90   6.262   4.655 -12.986
  697   1HG   LYS  90          2HG       LYS  90   5.073   6.729 -13.029
  698   2HG   LYS  90          1HG       LYS  90   6.348   7.493 -13.979
  699   1HD   LYS  90          2HD       LYS  90   5.151   5.041 -15.116
  700   2HD   LYS  90          1HD       LYS  90   4.110   6.466 -15.056
  701   1HE   LYS  90          2HE       LYS  90   6.419   7.534 -16.009
  702   2HE   LYS  90          1HE       LYS  90   6.477   5.916 -16.708
  703   1HZ   LYS  90          1HZ       LYS  90   5.344   7.253 -18.250
  704   2HZ   LYS  90          2HZ       LYS  90   4.384   7.980 -17.062
  705   3HZ   LYS  90          3HZ       LYS  90   4.133   6.359 -17.479
  706    H    ALA  91           H        ALA  91   7.751   4.948  -9.802
  707    HA   ALA  91           HA       ALA  91   5.627   6.689  -8.744
  708   1HB   ALA  91          1HB       ALA  91   5.004   4.564  -7.362
  709   2HB   ALA  91          2HB       ALA  91   5.789   3.712  -8.691
  710   3HB   ALA  91          3HB       ALA  91   4.407   4.761  -9.010
  711    H    ILE  92           H        ILE  92   8.472   4.717  -8.060
  712    HA   ILE  92           HA       ILE  92   8.533   5.353  -5.280
  713    HB   ILE  92           HB       ILE  92  10.536   4.164  -5.127
  714   1HG1  ILE  92          2HG1      ILE  92  10.932   4.635  -8.092
  715   2HG1  ILE  92          1HG1      ILE  92  11.852   5.374  -6.787
  716   1HG2  ILE  92          1HG2      ILE  92  10.047   2.375  -7.191
  717   2HG2  ILE  92          2HG2      ILE  92   8.481   3.121  -6.884
  718   3HG2  ILE  92          3HG2      ILE  92   9.352   2.332  -5.572
  719   1HD1  ILE  92          1HD1      ILE  92  13.201   3.662  -7.677
  720   2HD1  ILE  92          2HD1      ILE  92  11.870   2.505  -7.667
  721   3HD1  ILE  92          3HD1      ILE  92  12.576   3.048  -6.146
  722    H    LYS  93           H        LYS  93  10.234   6.608  -8.129
  723    HA   LYS  93           HA       LYS  93  11.960   8.360  -6.794
  724   1HB   LYS  93          2HB       LYS  93  11.243   7.794  -9.486
  725   2HB   LYS  93          1HB       LYS  93  11.147   9.535  -9.269
  726   1HG   LYS  93          2HG       LYS  93  13.541   8.447  -8.069
  727   2HG   LYS  93          1HG       LYS  93  13.421   8.036  -9.781
  728   1HD   LYS  93          2HD       LYS  93  14.194  10.074 -10.239
  729   2HD   LYS  93          1HD       LYS  93  12.670  10.719  -9.629
  730   1HE   LYS  93          2HE       LYS  93  15.052  10.127  -7.883
  731   2HE   LYS  93          1HE       LYS  93  14.737  11.706  -8.601
  732   1HZ   LYS  93          1HZ       LYS  93  13.040  12.111  -7.189
  733   2HZ   LYS  93          2HZ       LYS  93  13.877  11.024  -6.199
  734   3HZ   LYS  93          3HZ       LYS  93  12.552  10.493  -7.106
  735    H    LYS  94           H        LYS  94   8.586   8.643  -7.645
  736    HA   LYS  94           HA       LYS  94   8.272  11.413  -7.351
  737   1HB   LYS  94          2HB       LYS  94   6.460   9.063  -7.230
  738   2HB   LYS  94          1HB       LYS  94   5.865  10.597  -6.610
  739   1HG   LYS  94          2HG       LYS  94   5.166  10.475  -8.854
  740   2HG   LYS  94          1HG       LYS  94   6.515  11.611  -8.821
  741   1HD   LYS  94          2HD       LYS  94   7.474   8.929  -9.243
  742   2HD   LYS  94          1HD       LYS  94   6.236   9.332 -10.432
  743   1HE   LYS  94          2HE       LYS  94   8.301  11.383  -9.893
  744   2HE   LYS  94          1HE       LYS  94   8.819   9.937 -10.758
  745   1HZ   LYS  94          1HZ       LYS  94   8.162  11.385 -12.426
  746   2HZ   LYS  94          2HZ       LYS  94   6.819  11.950 -11.567
  747   3HZ   LYS  94          3HZ       LYS  94   6.801  10.396 -12.236
  748    H    GLY  95           H        GLY  95   7.319   8.902  -5.002
  749   1HA   GLY  95          2HA       GLY  95   8.600  10.132  -2.806
  750   2HA   GLY  95          1HA       GLY  95   6.919  10.637  -2.852
  751    H    ALA  96           H        ALA  96   7.933   7.464  -3.938
  752    HA   ALA  96           HA       ALA  96   6.278   6.279  -1.859
  753   1HB   ALA  96          1HB       ALA  96   5.921   4.568  -3.272
  754   2HB   ALA  96          2HB       ALA  96   7.616   4.475  -3.749
  755   3HB   ALA  96          3HB       ALA  96   6.555   5.672  -4.491
  756    H    TYR  97           H        TYR  97   7.443   3.793  -1.581
  757    HA   TYR  97           HA       TYR  97   9.930   4.457  -0.149
  758   1HB   TYR  97          2HB       TYR  97   7.896   3.766   1.201
  759   2HB   TYR  97          1HB       TYR  97   8.073   2.169   0.483
  760    HD1  TYR  97           1HD      TYR  97  10.352   4.675   2.082
  761    HD2  TYR  97           2HD      TYR  97   9.060   0.628   1.869
  762    HE1  TYR  97           1HE      TYR  97  11.968   4.075   3.835
  763    HE2  TYR  97           2HE      TYR  97  10.673   0.015   3.623
  764    HH   TYR  97           HH       TYR  97  13.203   1.935   4.546
  765    H    GLU  98           H        GLU  98   9.594   3.587  -2.944
  766    HA   GLU  98           HA       GLU  98  10.884   2.393  -4.395
  767   1HB   GLU  98          2HB       GLU  98  12.812   1.428  -3.711
  768   2HB   GLU  98          1HB       GLU  98  12.431   2.247  -2.207
  769   1HG   GLU  98          2HG       GLU  98  11.151  -0.074  -1.782
  770   2HG   GLU  98          1HG       GLU  98  12.427  -0.630  -2.864
  771    H    PHE  99           H        PHE  99  10.638   0.507  -5.577
  772    HA   PHE  99           HA       PHE  99   8.264  -0.991  -4.950
  773   1HB   PHE  99          2HB       PHE  99   9.845  -0.414  -7.283
  774   2HB   PHE  99          1HB       PHE  99   9.562  -2.146  -7.176
  775    HD1  PHE  99           1HD      PHE  99   7.828  -2.831  -8.496
  776    HD2  PHE  99           2HD      PHE  99   7.525   0.909  -6.486
  777    HE1  PHE  99           1HE      PHE  99   5.577  -2.513  -9.437
  778    HE2  PHE  99           2HE      PHE  99   5.273   1.232  -7.423
  779    HZ   PHE  99           HZ       PHE  99   4.295  -0.480  -8.899
  780    H    LEU 100           H        LEU 100   8.823  -2.179  -3.091
  781    HA   LEU 100           HA       LEU 100  11.090  -3.772  -2.787
  782   1HB   LEU 100          2HB       LEU 100   9.659  -3.190  -0.932
  783   2HB   LEU 100          1HB       LEU 100   8.316  -4.057  -1.649
  784    HG   LEU 100           HG       LEU 100   9.857  -6.126  -1.448
  785   1HD1  LEU 100          1HD1      LEU 100  11.400  -6.006   0.450
  786   2HD1  LEU 100          2HD1      LEU 100  11.096  -4.274   0.582
  787   3HD1  LEU 100          3HD1      LEU 100  11.886  -4.924  -0.854
  788   1HD2  LEU 100          1HD2      LEU 100   8.822  -4.968   1.115
  789   2HD2  LEU 100          2HD2      LEU 100   8.844  -6.654   0.596
  790   3HD2  LEU 100          3HD2      LEU 100   7.745  -5.508  -0.173
  791    H    GLU 101           H        GLU 101  11.450  -5.986  -3.076
  792    HA   GLU 101           HA       GLU 101  10.554  -7.111  -5.460
  793   1HB   GLU 101          2HB       GLU 101  11.764  -8.441  -3.033
  794   2HB   GLU 101          1HB       GLU 101  11.541  -9.237  -4.585
  795   1HG   GLU 101          2HG       GLU 101  13.249  -8.119  -5.565
  796   2HG   GLU 101          1HG       GLU 101  13.007  -6.669  -4.591
  797    H    LYS 102           H        LYS 102   9.620  -9.496  -5.409
  798    HA   LYS 102           HA       LYS 102   7.351  -9.655  -3.568
  799   1HB   LYS 102          2HB       LYS 102   5.867 -10.257  -5.510
  800   2HB   LYS 102          1HB       LYS 102   6.365  -8.573  -5.447
  801   1HG   LYS 102          2HG       LYS 102   8.103 -10.338  -7.028
  802   2HG   LYS 102          1HG       LYS 102   6.471 -10.110  -7.659
  803   1HD   LYS 102          2HD       LYS 102   6.857  -7.964  -8.218
  804   2HD   LYS 102          1HD       LYS 102   7.781  -7.647  -6.748
  805   1HE   LYS 102          2HE       LYS 102   9.474  -9.295  -8.070
  806   2HE   LYS 102          1HE       LYS 102   8.691  -8.477  -9.420
  807   1HZ   LYS 102          1HZ       LYS 102   9.582  -6.784  -7.229
  808   2HZ   LYS 102          2HZ       LYS 102   9.636  -6.514  -8.897
  809   3HZ   LYS 102          3HZ       LYS 102  10.801  -7.495  -8.160
  810    HA   PRO 103           HA       PRO 103   9.606 -13.709  -4.612
  811   1HB   PRO 103          2HB       PRO 103  10.569 -14.190  -2.108
  812   2HB   PRO 103          1HB       PRO 103  11.477 -13.312  -3.343
  813   1HG   PRO 103          2HG       PRO 103   9.865 -12.243  -1.058
  814   2HG   PRO 103          1HG       PRO 103  11.456 -11.723  -1.647
  815   1HD   PRO 103          2HD       PRO 103   9.193 -10.384  -2.253
  816   2HD   PRO 103          1HD       PRO 103  10.552 -10.502  -3.388
  817    H    PHE 104           H        PHE 104   9.482 -15.685  -2.772
  818    HA   PHE 104           HA       PHE 104   6.815 -16.470  -2.776
  819   1HB   PHE 104          2HB       PHE 104   8.855 -17.942  -2.484
  820   2HB   PHE 104          1HB       PHE 104   8.881 -17.440  -0.797
  821    HD1  PHE 104           1HD      PHE 104   6.438 -18.780  -3.284
  822    HD2  PHE 104           2HD      PHE 104   7.887 -18.838   0.716
  823    HE1  PHE 104           1HE      PHE 104   4.835 -20.563  -2.733
  824    HE2  PHE 104           2HE      PHE 104   6.288 -20.622   1.275
  825    HZ   PHE 104           HZ       PHE 104   4.758 -21.487  -0.452
  826    H    SER 105           H        SER 105   5.211 -15.426  -1.794
  827    HA   SER 105           HA       SER 105   3.911 -14.523  -0.163
  828   1HB   SER 105          2HB       SER 105   5.958 -15.658   1.757
  829   2HB   SER 105          1HB       SER 105   4.320 -15.141   2.158
  830    HG   SER 105           HG       SER 105   3.617 -17.003   1.507
  831    H    VAL 106           H        VAL 106   3.854 -12.810   1.508
  832    HA   VAL 106           HA       VAL 106   5.862 -10.790   0.900
  833    HB   VAL 106           HB       VAL 106   4.359  -9.216   2.002
  834   1HG1  VAL 106          1HG1      VAL 106   2.408 -10.712   0.388
  835   2HG1  VAL 106          2HG1      VAL 106   3.959 -10.397  -0.391
  836   3HG1  VAL 106          3HG1      VAL 106   2.991  -9.056   0.222
  837   1HG2  VAL 106          1HG2      VAL 106   2.065 -10.907   2.366
  838   2HG2  VAL 106          2HG2      VAL 106   2.849  -9.821   3.513
  839   3HG2  VAL 106          3HG2      VAL 106   3.412 -11.483   3.348
  840    H    GLU 107           H        GLU 107   7.069 -12.717   2.368
  841    HA   GLU 107           HA       GLU 107   6.943 -12.244   5.178
  842   1HB   GLU 107          2HB       GLU 107   7.690 -14.391   4.510
  843   2HB   GLU 107          1HB       GLU 107   8.853 -13.723   3.375
  844   1HG   GLU 107          2HG       GLU 107  10.437 -13.591   4.919
  845   2HG   GLU 107          1HG       GLU 107   9.346 -12.859   6.095
  846    H    ARG 108           H        ARG 108   9.540 -11.632   2.797
  847    HA   ARG 108           HA       ARG 108  11.092  -9.974   4.412
  848   1HB   ARG 108          2HB       ARG 108  11.178 -10.873   1.765
  849   2HB   ARG 108          1HB       ARG 108  11.135  -9.122   1.634
  850   1HG   ARG 108          2HG       ARG 108  13.384  -9.476   1.754
  851   2HG   ARG 108          1HG       ARG 108  13.010  -9.254   3.464
  852   1HD   ARG 108          2HD       ARG 108  14.062 -11.203   3.771
  853   2HD   ARG 108          1HD       ARG 108  12.603 -11.942   3.111
  854    HE   ARG 108           HE       ARG 108  13.765 -12.460   1.204
  855   1HH1  ARG 108          1HH1      ARG 108  15.598 -10.140   3.057
  856   2HH1  ARG 108          2HH1      ARG 108  17.012 -10.279   2.067
  857   1HH2  ARG 108          1HH2      ARG 108  15.623 -12.644  -0.099
  858   2HH2  ARG 108          2HH2      ARG 108  17.026 -11.700   0.275
  859    H    PHE 109           H        PHE 109   8.195  -9.367   2.605
  860    HA   PHE 109           HA       PHE 109   8.243  -6.563   2.496
  861   1HB   PHE 109          2HB       PHE 109   6.647  -7.752   1.160
  862   2HB   PHE 109          1HB       PHE 109   5.982  -8.564   2.571
  863    HD1  PHE 109           1HD      PHE 109   6.528  -5.088   1.330
  864    HD2  PHE 109           2HD      PHE 109   3.966  -7.808   3.365
  865    HE1  PHE 109           1HE      PHE 109   4.826  -3.323   1.534
  866    HE2  PHE 109           2HE      PHE 109   2.259  -6.049   3.572
  867    HZ   PHE 109           HZ       PHE 109   2.687  -3.803   2.655
  868    H    LEU 110           H        LEU 110   6.988  -8.824   4.911
  869    HA   LEU 110           HA       LEU 110   5.763  -7.080   6.656
  870   1HB   LEU 110          2HB       LEU 110   6.717  -9.762   6.700
  871   2HB   LEU 110          1HB       LEU 110   7.086  -8.986   8.228
  872    HG   LEU 110           HG       LEU 110   4.354  -9.185   6.966
  873   1HD1  LEU 110          1HD1      LEU 110   4.087 -10.480   9.245
  874   2HD1  LEU 110          2HD1      LEU 110   5.811 -10.763   9.009
  875   3HD1  LEU 110          3HD1      LEU 110   4.656 -11.284   7.781
  876   1HD2  LEU 110          1HD2      LEU 110   4.073  -7.288   8.174
  877   2HD2  LEU 110          2HD2      LEU 110   5.426  -7.638   9.248
  878   3HD2  LEU 110          3HD2      LEU 110   3.879  -8.448   9.489
  879    H    LEU 111           H        LEU 111   9.176  -7.672   6.182
  880    HA   LEU 111           HA       LEU 111   9.976  -6.269   8.566
  881   1HB   LEU 111          2HB       LEU 111  11.568  -7.205   6.179
  882   2HB   LEU 111          1HB       LEU 111  12.265  -6.497   7.624
  883    HG   LEU 111           HG       LEU 111  10.789  -8.539   8.682
  884   1HD1  LEU 111          1HD1      LEU 111  10.282  -9.320   6.365
  885   2HD1  LEU 111          2HD1      LEU 111  11.102 -10.510   7.376
  886   3HD1  LEU 111          3HD1      LEU 111  12.007  -9.622   6.151
  887   1HD2  LEU 111          1HD2      LEU 111  13.238  -7.796   8.974
  888   2HD2  LEU 111          2HD2      LEU 111  13.592  -8.995   7.730
  889   3HD2  LEU 111          3HD2      LEU 111  12.834  -9.492   9.243
  890    H    THR 112           H        THR 112   9.664  -5.521   5.134
  891    HA   THR 112           HA       THR 112  10.963  -2.995   5.280
  892    HB   THR 112           HB       THR 112   8.936  -4.076   3.307
  893    HG1  THR 112           1HG      THR 112  11.743  -3.801   3.056
  894   1HG2  THR 112          1HG2      THR 112   9.479  -2.366   1.803
  895   2HG2  THR 112          2HG2      THR 112  10.812  -1.794   2.806
  896   3HG2  THR 112          3HG2      THR 112   9.147  -1.558   3.334
  897    H    ILE 113           H        ILE 113   7.668  -4.110   5.680
  898    HA   ILE 113           HA       ILE 113   6.415  -1.584   5.764
  899    HB   ILE 113           HB       ILE 113   5.651  -4.359   6.467
  900   1HG1  ILE 113          2HG1      ILE 113   5.256  -3.365   4.237
  901   2HG1  ILE 113          1HG1      ILE 113   3.760  -3.855   5.024
  902   1HG2  ILE 113          1HG2      ILE 113   4.335  -1.948   7.673
  903   2HG2  ILE 113          2HG2      ILE 113   4.842  -3.443   8.459
  904   3HG2  ILE 113          3HG2      ILE 113   3.445  -3.443   7.382
  905   1HD1  ILE 113          1HD1      ILE 113   4.827  -1.086   4.613
  906   2HD1  ILE 113          2HD1      ILE 113   3.536  -1.440   5.762
  907   3HD1  ILE 113          3HD1      ILE 113   3.308  -1.780   4.046
  908    H    LYS 114           H        LYS 114   7.413  -3.763   8.428
  909    HA   LYS 114           HA       LYS 114   6.549  -2.305  10.551
  910   1HB   LYS 114          2HB       LYS 114   8.610  -3.198  11.780
  911   2HB   LYS 114          1HB       LYS 114   7.474  -4.359  11.106
  912   1HG   LYS 114          2HG       LYS 114   9.061  -5.275   9.931
  913   2HG   LYS 114          1HG       LYS 114   9.399  -3.736   9.145
  914   1HD   LYS 114          2HD       LYS 114  10.824  -3.120  11.095
  915   2HD   LYS 114          1HD       LYS 114  10.572  -4.743  11.738
  916   1HE   LYS 114          2HE       LYS 114  11.480  -5.530   9.448
  917   2HE   LYS 114          1HE       LYS 114  12.096  -3.885   9.305
  918   1HZ   LYS 114          1HZ       LYS 114  12.966  -4.475  11.721
  919   2HZ   LYS 114          2HZ       LYS 114  13.858  -4.830  10.328
  920   3HZ   LYS 114          3HZ       LYS 114  12.941  -6.038  11.076
  921    H    HIS 115           H        HIS 115   9.785  -2.020   9.099
  922    HA   HIS 115           HA       HIS 115  10.628   0.183  10.557
  923   1HB   HIS 115          2HB       HIS 115  11.739  -1.404   8.660
  924   2HB   HIS 115          1HB       HIS 115  11.529   0.096   7.762
  925    HD1  HIS 115           1HD      HIS 115  14.011   0.670   7.667
  926    HD2  HIS 115           2HD      HIS 115  12.586   0.135  11.534
  927    HE1  HIS 115           1HE      HIS 115  15.847   1.487   9.179
  928    HE2  HIS 115           2HE      HIS 115  14.993   1.080  11.515
  929    H    ALA 116           H        ALA 116   8.647  -0.015   7.664
  930    HA   ALA 116           HA       ALA 116   8.720   2.629   6.810
  931   1HB   ALA 116          1HB       ALA 116   6.097   1.258   6.713
  932   2HB   ALA 116          2HB       ALA 116   7.455   0.446   5.933
  933   3HB   ALA 116          3HB       ALA 116   6.999   2.076   5.438
  934    H    PHE 117           H        PHE 117   7.008   1.155   9.476
  935    HA   PHE 117           HA       PHE 117   5.315   3.389  10.022
  936   1HB   PHE 117          2HB       PHE 117   6.009   0.836  11.419
  937   2HB   PHE 117          1HB       PHE 117   5.179   2.105  12.315
  938    HD1  PHE 117           1HD      PHE 117   2.899   2.624  11.898
  939    HD2  PHE 117           2HD      PHE 117   4.920  -0.251   9.500
  940    HE1  PHE 117           1HE      PHE 117   0.743   1.886  10.981
  941    HE2  PHE 117           2HE      PHE 117   2.766  -0.995   8.577
  942    HZ   PHE 117           HZ       PHE 117   0.672   0.080   9.316
  943    H    GLU 118           H        GLU 118   8.326   2.144  11.443
  944    HA   GLU 118           HA       GLU 118   8.514   4.448  13.205
  945   1HB   GLU 118          2HB       GLU 118  10.557   2.258  12.858
  946   2HB   GLU 118          1HB       GLU 118  10.355   3.339  14.231
  947   1HG   GLU 118          2HG       GLU 118   8.072   2.264  14.537
  948   2HG   GLU 118          1HG       GLU 118   8.627   1.033  13.404
  949    H    GLU 119           H        GLU 119   9.060   4.181  10.055
  950    HA   GLU 119           HA       GLU 119  11.507   5.814  10.136
  951   1HB   GLU 119          2HB       GLU 119  10.530   3.921   8.008
  952   2HB   GLU 119          1HB       GLU 119  11.834   5.071   7.751
  953   1HG   GLU 119          2HG       GLU 119  12.332   3.572  10.135
  954   2HG   GLU 119          1HG       GLU 119  11.997   2.474   8.798
  955    H    TYR 120           H        TYR 120   8.220   5.884   9.553
  956    HA   TYR 120           HA       TYR 120   8.415   8.526   8.394
  957   1HB   TYR 120          2HB       TYR 120   8.120   6.403   6.663
  958   2HB   TYR 120          1HB       TYR 120   6.459   6.918   6.922
  959    HD1  TYR 120           1HD      TYR 120   5.854   9.329   6.446
  960    HD2  TYR 120           2HD      TYR 120   9.570   7.627   5.271
  961    HE1  TYR 120           1HE      TYR 120   6.173  11.156   4.831
  962    HE2  TYR 120           2HE      TYR 120   9.901   9.450   3.654
  963    HH   TYR 120           HH       TYR 120   7.947  12.262   3.629
  964    H    SER 121           H        SER 121   7.614   8.711  10.677
  965    HA   SER 121           HA       SER 121   4.756   9.050  10.631
  966   1HB   SER 121          2HB       SER 121   4.180   7.608  12.433
  967   2HB   SER 121          1HB       SER 121   5.151   6.630  11.333
  968    HG   SER 121           HG       SER 121   6.040   6.249  13.273
  Start of MODEL   22
    1   1H    MET   1          1HT       MET   1  -0.221   5.237  13.439
    2   2H    MET   1          2HT       MET   1   0.179   5.839  14.996
    3   3H    MET   1          3HT       MET   1  -1.208   4.848  14.787
    4    HA   MET   1           HA       MET   1   1.523   3.947  14.192
    5   1HB   MET   1          2HB       MET   1   1.302   2.789  16.437
    6   2HB   MET   1          1HB       MET   1   1.559   4.527  16.495
    7   1HG   MET   1          2HG       MET   1  -0.502   4.951  17.331
    8   2HG   MET   1          1HG       MET   1  -1.241   3.578  16.508
    9   1HE   MET   1          1HE       MET   1  -2.067   1.663  19.551
   10   2HE   MET   1          2HE       MET   1  -2.212   1.778  17.797
   11   3HE   MET   1          3HE       MET   1  -2.666   3.147  18.810
   12    H    LYS   2           H        LYS   2   1.539   1.986  13.289
   13    HA   LYS   2           HA       LYS   2   0.860  -0.016  12.460
   14   1HB   LYS   2          2HB       LYS   2  -1.297   0.125  14.571
   15   2HB   LYS   2          1HB       LYS   2  -0.798  -1.312  13.692
   16   1HG   LYS   2          2HG       LYS   2   0.877   0.265  15.634
   17   2HG   LYS   2          1HG       LYS   2   0.138  -1.312  15.919
   18   1HD   LYS   2          2HD       LYS   2   1.923  -2.315  15.051
   19   2HD   LYS   2          1HD       LYS   2   1.671  -1.465  13.526
   20   1HE   LYS   2          2HE       LYS   2   3.163   0.208  14.056
   21   2HE   LYS   2          1HE       LYS   2   2.977  -0.034  15.793
   22   1HZ   LYS   2          1HZ       LYS   2   4.534  -1.642  15.826
   23   2HZ   LYS   2          2HZ       LYS   2   5.088  -0.871  14.426
   24   3HZ   LYS   2          3HZ       LYS   2   4.121  -2.255  14.305
   25    H    ARG   3           H        ARG   3  -1.392  -1.177  11.769
   26    HA   ARG   3           HA       ARG   3  -3.240  -1.170  10.456
   27   1HB   ARG   3          2HB       ARG   3  -3.315   1.815  10.895
   28   2HB   ARG   3          1HB       ARG   3  -4.596   0.831  10.208
   29   1HG   ARG   3          2HG       ARG   3  -5.407   0.850  12.293
   30   2HG   ARG   3          1HG       ARG   3  -4.217  -0.423  12.570
   31   1HD   ARG   3          2HD       ARG   3  -2.805   0.955  13.718
   32   2HD   ARG   3          1HD       ARG   3  -3.339   2.399  12.861
   33    HE   ARG   3           HE       ARG   3  -4.318   1.461  15.334
   34   1HH1  ARG   3          1HH1      ARG   3  -5.418   2.892  12.346
   35   2HH1  ARG   3          2HH1      ARG   3  -6.796   3.648  13.071
   36   1HH2  ARG   3          1HH2      ARG   3  -6.131   2.453  16.288
   37   2HH2  ARG   3          2HH2      ARG   3  -7.202   3.400  15.309
   38    H    VAL   4           H        VAL   4  -2.543  -1.761   8.513
   39    HA   VAL   4           HA       VAL   4  -1.293   0.268   6.776
   40    HB   VAL   4           HB       VAL   4  -1.080  -2.742   6.560
   41   1HG1  VAL   4          1HG1      VAL   4   0.020  -0.472   4.963
   42   2HG1  VAL   4          2HG1      VAL   4  -0.693  -1.989   4.417
   43   3HG1  VAL   4          3HG1      VAL   4   0.934  -1.974   5.098
   44   1HG2  VAL   4          1HG2      VAL   4   0.941  -0.754   7.602
   45   2HG2  VAL   4          2HG2      VAL   4   1.211  -2.483   7.376
   46   3HG2  VAL   4          3HG2      VAL   4   0.044  -1.922   8.572
   47    H    LEU   5           H        LEU   5  -1.802   0.026   4.412
   48    HA   LEU   5           HA       LEU   5  -4.554  -0.967   4.044
   49   1HB   LEU   5          2HB       LEU   5  -4.478   1.475   4.005
   50   2HB   LEU   5          1HB       LEU   5  -3.255   1.430   2.749
   51    HG   LEU   5           HG       LEU   5  -4.905   0.328   1.241
   52   1HD1  LEU   5          1HD1      LEU   5  -6.973  -0.263   1.873
   53   2HD1  LEU   5          2HD1      LEU   5  -7.185   1.166   2.884
   54   3HD1  LEU   5          3HD1      LEU   5  -6.300  -0.228   3.501
   55   1HD2  LEU   5          1HD2      LEU   5  -6.117   2.879   2.219
   56   2HD2  LEU   5          2HD2      LEU   5  -5.871   2.313   0.567
   57   3HD2  LEU   5          3HD2      LEU   5  -4.499   2.880   1.518
   58    H    VAL   6           H        VAL   6  -5.016  -2.167   2.274
   59    HA   VAL   6           HA       VAL   6  -2.787  -2.743   0.429
   60    HB   VAL   6           HB       VAL   6  -4.942  -4.720   1.156
   61   1HG1  VAL   6          1HG1      VAL   6  -2.521  -4.729  -0.535
   62   2HG1  VAL   6          2HG1      VAL   6  -4.037  -5.611  -0.715
   63   3HG1  VAL   6          3HG1      VAL   6  -2.815  -6.181   0.422
   64   1HG2  VAL   6          1HG2      VAL   6  -3.606  -5.677   2.812
   65   2HG2  VAL   6          2HG2      VAL   6  -3.468  -3.945   3.113
   66   3HG2  VAL   6          3HG2      VAL   6  -2.166  -4.802   2.289
   67    H    VAL   7           H        VAL   7  -3.203  -2.049  -1.563
   68    HA   VAL   7           HA       VAL   7  -6.002  -1.893  -2.450
   69    HB   VAL   7           HB       VAL   7  -3.573  -0.499  -3.598
   70   1HG1  VAL   7          1HG1      VAL   7  -5.746  -1.062  -5.016
   71   2HG1  VAL   7          2HG1      VAL   7  -4.877   0.462  -5.190
   72   3HG1  VAL   7          3HG1      VAL   7  -6.335   0.387  -4.202
   73   1HG2  VAL   7          1HG2      VAL   7  -5.753   0.480  -1.770
   74   2HG2  VAL   7          2HG2      VAL   7  -4.663   1.549  -2.652
   75   3HG2  VAL   7          3HG2      VAL   7  -4.019   0.428  -1.453
   76    H    ASP   8           H        ASP   8  -6.612  -3.612  -3.601
   77    HA   ASP   8           HA       ASP   8  -5.027  -4.450  -5.876
   78   1HB   ASP   8          2HB       ASP   8  -4.078  -5.825  -4.087
   79   2HB   ASP   8          1HB       ASP   8  -5.686  -6.381  -3.638
   80    H    ASP   9           H        ASP   9  -6.202  -5.877  -7.317
   81    HA   ASP   9           HA       ASP   9  -9.025  -5.273  -7.296
   82   1HB   ASP   9          2HB       ASP   9  -7.489  -5.213  -9.343
   83   2HB   ASP   9          1HB       ASP   9  -7.603  -6.970  -9.337
   84    H    GLU  10           H        GLU  10  -7.346  -8.345  -7.989
   85    HA   GLU  10           HA       GLU  10  -9.644  -9.817  -7.027
   86   1HB   GLU  10          2HB       GLU  10  -7.009 -10.722  -8.193
   87   2HB   GLU  10          1HB       GLU  10  -8.299 -11.817  -7.713
   88   1HG   GLU  10          2HG       GLU  10  -9.143  -9.676  -9.520
   89   2HG   GLU  10          1HG       GLU  10  -7.963 -10.792 -10.204
   90    H    GLU  11           H        GLU  11  -8.980 -11.927  -5.747
   91    HA   GLU  11           HA       GLU  11  -7.707 -10.963  -3.296
   92   1HB   GLU  11          2HB       GLU  11  -9.202 -13.558  -3.636
   93   2HB   GLU  11          1HB       GLU  11  -8.868 -12.686  -2.147
   94   1HG   GLU  11          2HG       GLU  11 -10.290 -10.814  -3.380
   95   2HG   GLU  11          1HG       GLU  11 -10.960 -12.230  -4.189
   96    H    SER  12           H        SER  12  -5.606 -11.169  -4.512
   97    HA   SER  12           HA       SER  12  -4.621 -13.940  -4.516
   98   1HB   SER  12          2HB       SER  12  -3.274 -11.537  -5.759
   99   2HB   SER  12          1HB       SER  12  -2.903 -13.239  -6.032
  100    HG   SER  12           HG       SER  12  -5.166 -13.342  -6.834
  101    H    ILE  13           H        ILE  13  -4.003 -10.702  -3.294
  102    HA   ILE  13           HA       ILE  13  -1.893 -11.796  -1.555
  103    HB   ILE  13           HB       ILE  13  -2.364  -8.966  -2.497
  104   1HG1  ILE  13          2HG1      ILE  13  -0.081  -9.234  -3.440
  105   2HG1  ILE  13          1HG1      ILE  13  -0.079 -10.909  -2.897
  106   1HG2  ILE  13          1HG2      ILE  13  -0.359  -9.986  -0.489
  107   2HG2  ILE  13          2HG2      ILE  13  -1.695  -8.878  -0.176
  108   3HG2  ILE  13          3HG2      ILE  13  -0.349  -8.371  -1.198
  109   1HD1  ILE  13          1HD1      ILE  13  -0.719 -10.226  -5.364
  110   2HD1  ILE  13          2HD1      ILE  13  -2.311 -10.029  -4.632
  111   3HD1  ILE  13          3HD1      ILE  13  -1.486 -11.585  -4.541
  112    H    THR  14           H        THR  14  -4.883  -9.975  -1.658
  113    HA   THR  14           HA       THR  14  -5.012  -9.019   0.942
  114    HB   THR  14           HB       THR  14  -7.460  -9.035   0.656
  115    HG1  THR  14           1HG      THR  14  -6.821 -10.690  -1.538
  116   1HG2  THR  14          1HG2      THR  14  -6.086  -7.305  -0.506
  117   2HG2  THR  14          2HG2      THR  14  -7.652  -7.636  -1.247
  118   3HG2  THR  14          3HG2      THR  14  -6.180  -8.299  -1.959
  119    H    SER  15           H        SER  15  -5.991 -12.192  -0.315
  120    HA   SER  15           HA       SER  15  -6.776 -13.126   2.302
  121   1HB   SER  15          2HB       SER  15  -6.493 -14.571  -0.336
  122   2HB   SER  15          1HB       SER  15  -7.135 -15.293   1.139
  123    HG   SER  15           HG       SER  15  -8.782 -13.687   1.094
  124    H    SER  16           H        SER  16  -4.398 -12.376   2.832
  125    HA   SER  16           HA       SER  16  -2.996 -14.502   3.840
  126   1HB   SER  16          2HB       SER  16  -2.280 -13.914   1.025
  127   2HB   SER  16          1HB       SER  16  -0.948 -14.206   2.143
  128    HG   SER  16           HG       SER  16  -1.812 -16.112   1.075
  129    H    LEU  17           H        LEU  17  -2.163 -11.565   2.022
  130    HA   LEU  17           HA       LEU  17  -0.105 -10.694   3.712
  131   1HB   LEU  17          2HB       LEU  17  -0.365  -9.813   1.482
  132   2HB   LEU  17          1HB       LEU  17  -1.953  -9.184   1.862
  133    HG   LEU  17           HG       LEU  17   0.094  -7.583   1.721
  134   1HD1  LEU  17          1HD1      LEU  17  -2.129  -6.881   2.309
  135   2HD1  LEU  17          2HD1      LEU  17  -0.951  -6.099   3.362
  136   3HD1  LEU  17          3HD1      LEU  17  -1.911  -7.451   3.959
  137   1HD2  LEU  17          1HD2      LEU  17   1.163  -7.191   3.900
  138   2HD2  LEU  17          2HD2      LEU  17   1.555  -8.777   3.238
  139   3HD2  LEU  17          3HD2      LEU  17   0.371  -8.630   4.536
  140    H    SER  18           H        SER  18  -3.501  -9.581   3.562
  141    HA   SER  18           HA       SER  18  -3.421  -7.873   5.754
  142   1HB   SER  18          2HB       SER  18  -5.756  -9.577   4.844
  143   2HB   SER  18          1HB       SER  18  -5.861  -8.144   5.864
  144    HG   SER  18           HG       SER  18  -5.831  -6.986   4.124
  145    H    ALA  19           H        ALA  19  -4.026 -11.352   5.611
  146    HA   ALA  19           HA       ALA  19  -4.643 -11.722   8.340
  147   1HB   ALA  19          1HB       ALA  19  -5.247 -13.579   7.185
  148   2HB   ALA  19          2HB       ALA  19  -3.645 -14.116   7.689
  149   3HB   ALA  19          3HB       ALA  19  -3.887 -13.461   6.069
  150    H    ILE  20           H        ILE  20  -1.624 -11.747   6.534
  151    HA   ILE  20           HA       ILE  20   0.092 -12.710   8.515
  152    HB   ILE  20           HB       ILE  20   0.515 -10.872   6.171
  153   1HG1  ILE  20          2HG1      ILE  20   1.768 -13.550   6.696
  154   2HG1  ILE  20          1HG1      ILE  20   0.148 -13.408   6.018
  155   1HG2  ILE  20          1HG2      ILE  20   3.032 -11.374   6.715
  156   2HG2  ILE  20          2HG2      ILE  20   2.429 -11.495   8.368
  157   3HG2  ILE  20          3HG2      ILE  20   2.206 -10.003   7.455
  158   1HD1  ILE  20          1HD1      ILE  20   2.650 -13.257   4.697
  159   2HD1  ILE  20          2HD1      ILE  20   1.837 -11.700   4.537
  160   3HD1  ILE  20          3HD1      ILE  20   1.027 -13.176   4.009
  161    H    LEU  21           H        LEU  21  -0.322  -9.287   7.593
  162    HA   LEU  21           HA       LEU  21   1.038  -8.109   9.661
  163   1HB   LEU  21          2HB       LEU  21  -1.554  -7.091   8.519
  164   2HB   LEU  21          1HB       LEU  21  -0.289  -6.138   9.268
  165    HG   LEU  21           HG       LEU  21   0.710  -7.694   7.030
  166   1HD1  LEU  21          1HD1      LEU  21  -0.786  -7.299   5.461
  167   2HD1  LEU  21          2HD1      LEU  21  -0.724  -5.569   5.793
  168   3HD1  LEU  21          3HD1      LEU  21  -1.862  -6.596   6.665
  169   1HD2  LEU  21          1HD2      LEU  21   0.712  -4.802   7.843
  170   2HD2  LEU  21          2HD2      LEU  21   1.485  -5.389   6.371
  171   3HD2  LEU  21          3HD2      LEU  21   2.031  -5.968   7.945
  172    H    GLU  22           H        GLU  22  -2.229  -9.416   9.662
  173    HA   GLU  22           HA       GLU  22  -3.057  -8.417  12.159
  174   1HB   GLU  22          2HB       GLU  22  -3.902 -10.778  10.511
  175   2HB   GLU  22          1HB       GLU  22  -4.605 -10.471  12.092
  176   1HG   GLU  22          2HG       GLU  22  -5.379  -8.294  11.344
  177   2HG   GLU  22          1HG       GLU  22  -4.641  -8.562   9.766
  178    H    GLU  23           H        GLU  23  -1.038 -11.120  11.253
  179    HA   GLU  23           HA       GLU  23  -1.145 -12.383  13.830
  180   1HB   GLU  23          2HB       GLU  23  -0.659 -13.843  12.041
  181   2HB   GLU  23          1HB       GLU  23   0.537 -12.750  11.359
  182   1HG   GLU  23          2HG       GLU  23   2.181 -13.614  12.574
  183   2HG   GLU  23          1HG       GLU  23   1.211 -13.621  14.046
  184    H    GLU  24           H        GLU  24   0.888 -10.074  12.163
  185    HA   GLU  24           HA       GLU  24   2.925 -10.031  14.177
  186   1HB   GLU  24          2HB       GLU  24   2.341  -8.137  11.900
  187   2HB   GLU  24          1HB       GLU  24   3.768  -8.057  12.926
  188   1HG   GLU  24          2HG       GLU  24   3.194 -10.625  11.566
  189   2HG   GLU  24          1HG       GLU  24   3.767  -9.281  10.582
  190    H    GLY  25           H        GLY  25  -0.189  -8.799  14.049
  191   1HA   GLY  25          2HA       GLY  25  -1.200  -7.641  15.839
  192   2HA   GLY  25          1HA       GLY  25   0.382  -7.027  16.295
  193    H    TYR  26           H        TYR  26  -1.491  -6.954  13.276
  194    HA   TYR  26           HA       TYR  26  -1.236  -4.016  13.290
  195   1HB   TYR  26          2HB       TYR  26  -0.922  -5.983  11.036
  196   2HB   TYR  26          1HB       TYR  26  -1.293  -4.294  10.730
  197    HD1  TYR  26           1HD      TYR  26   0.339  -2.572  11.862
  198    HD2  TYR  26           2HD      TYR  26   1.283  -6.652  11.121
  199    HE1  TYR  26           1HE      TYR  26   2.735  -2.025  11.938
  200    HE2  TYR  26           2HE      TYR  26   3.680  -6.118  11.193
  201    HH   TYR  26           HH       TYR  26   4.943  -3.503  12.512
  202    H    HIS  27           H        HIS  27  -2.749  -3.241  11.325
  203    HA   HIS  27           HA       HIS  27  -5.351  -4.559  11.457
  204   1HB   HIS  27          2HB       HIS  27  -4.823  -2.348  13.033
  205   2HB   HIS  27          1HB       HIS  27  -5.552  -1.634  11.600
  206    HD1  HIS  27           1HD      HIS  27  -8.032  -2.252  11.100
  207    HD2  HIS  27           2HD      HIS  27  -6.550  -3.809  14.656
  208    HE1  HIS  27           1HE      HIS  27 -10.048  -3.035  12.382
  209    HE2  HIS  27           2HE      HIS  27  -9.120  -4.048  14.494
  210    HA   PRO  28           HA       PRO  28  -4.211  -3.101   7.264
  211   1HB   PRO  28          2HB       PRO  28  -4.360  -5.453   5.983
  212   2HB   PRO  28          1HB       PRO  28  -2.938  -4.976   6.916
  213   1HG   PRO  28          2HG       PRO  28  -5.109  -6.881   7.613
  214   2HG   PRO  28          1HG       PRO  28  -3.390  -6.940   8.021
  215   1HD   PRO  28          2HD       PRO  28  -5.451  -6.075   9.705
  216   2HD   PRO  28          1HD       PRO  28  -3.720  -5.785   9.950
  217    H    ASP  29           H        ASP  29  -5.477  -2.648   5.529
  218    HA   ASP  29           HA       ASP  29  -8.205  -3.726   5.484
  219   1HB   ASP  29          2HB       ASP  29  -7.619  -1.165   6.310
  220   2HB   ASP  29          1HB       ASP  29  -8.020  -0.951   4.610
  221    H    THR  30           H        THR  30  -8.904  -4.293   3.476
  222    HA   THR  30           HA       THR  30  -7.021  -3.820   1.287
  223    HB   THR  30           HB       THR  30  -8.091  -5.667   0.142
  224    HG1  THR  30           1HG      THR  30 -10.218  -5.373   0.838
  225   1HG2  THR  30          1HG2      THR  30  -6.984  -7.206   1.287
  226   2HG2  THR  30          2HG2      THR  30  -8.041  -7.030   2.687
  227   3HG2  THR  30          3HG2      THR  30  -6.656  -5.956   2.488
  228    H    ALA  31           H        ALA  31  -7.662  -3.036  -0.710
  229    HA   ALA  31           HA       ALA  31 -10.384  -2.044  -1.027
  230   1HB   ALA  31          1HB       ALA  31  -9.377  -0.164   0.038
  231   2HB   ALA  31          2HB       ALA  31  -9.498   0.217  -1.680
  232   3HB   ALA  31          3HB       ALA  31  -7.949  -0.270  -0.991
  233    H    LYS  32           H        LYS  32 -10.986  -1.751  -3.187
  234    HA   LYS  32           HA       LYS  32  -9.583  -3.281  -5.090
  235   1HB   LYS  32          2HB       LYS  32 -11.664  -1.158  -5.643
  236   2HB   LYS  32          1HB       LYS  32 -11.212  -2.486  -6.702
  237   1HG   LYS  32          2HG       LYS  32 -12.006  -4.050  -4.899
  238   2HG   LYS  32          1HG       LYS  32 -12.674  -2.635  -4.084
  239   1HD   LYS  32          2HD       LYS  32 -14.432  -2.557  -5.464
  240   2HD   LYS  32          1HD       LYS  32 -13.411  -2.738  -6.893
  241   1HE   LYS  32          2HE       LYS  32 -13.262  -5.230  -6.051
  242   2HE   LYS  32          1HE       LYS  32 -14.775  -4.814  -5.247
  243   1HZ   LYS  32          1HZ       LYS  32 -15.427  -3.941  -7.573
  244   2HZ   LYS  32          2HZ       LYS  32 -15.484  -5.606  -7.272
  245   3HZ   LYS  32          3HZ       LYS  32 -14.184  -4.945  -8.127
  246    H    THR  33           H        THR  33  -9.686  -1.566  -7.425
  247    HA   THR  33           HA       THR  33  -7.138  -0.648  -7.542
  248    HB   THR  33           HB       THR  33  -7.955   0.851  -9.412
  249    HG1  THR  33           1HG      THR  33 -10.454  -0.333  -8.802
  250   1HG2  THR  33          1HG2      THR  33  -7.553  -1.780  -9.475
  251   2HG2  THR  33          2HG2      THR  33  -8.106  -0.857 -10.874
  252   3HG2  THR  33          3HG2      THR  33  -9.268  -1.747  -9.890
  253    H    LEU  34           H        LEU  34  -6.518   1.685  -8.037
  254    HA   LEU  34           HA       LEU  34  -6.327   3.131  -5.751
  255   1HB   LEU  34          2HB       LEU  34  -6.412   4.308  -8.525
  256   2HB   LEU  34          1HB       LEU  34  -5.651   5.022  -7.114
  257    HG   LEU  34           HG       LEU  34  -4.771   2.325  -8.075
  258   1HD1  LEU  34          1HD1      LEU  34  -3.362   3.152  -9.694
  259   2HD1  LEU  34          2HD1      LEU  34  -3.418   4.796  -9.057
  260   3HD1  LEU  34          3HD1      LEU  34  -4.802   4.141  -9.933
  261   1HD2  LEU  34          1HD2      LEU  34  -4.084   3.921  -5.934
  262   2HD2  LEU  34          2HD2      LEU  34  -2.795   4.214  -7.102
  263   3HD2  LEU  34          3HD2      LEU  34  -3.149   2.569  -6.573
  264    H    ARG  35           H        ARG  35  -9.017   3.164  -7.988
  265    HA   ARG  35           HA       ARG  35 -10.251   5.543  -7.145
  266   1HB   ARG  35          2HB       ARG  35 -11.388   2.975  -8.256
  267   2HB   ARG  35          1HB       ARG  35 -12.384   4.382  -7.913
  268   1HG   ARG  35          2HG       ARG  35  -9.991   4.794  -9.608
  269   2HG   ARG  35          1HG       ARG  35 -11.351   3.914 -10.309
  270   1HD   ARG  35          2HD       ARG  35 -12.843   5.762  -9.763
  271   2HD   ARG  35          1HD       ARG  35 -11.504   6.636  -9.018
  272    HE   ARG  35           HE       ARG  35 -12.078   6.401 -11.825
  273   1HH1  ARG  35          1HH1      ARG  35  -9.585   6.992  -9.455
  274   2HH1  ARG  35          2HH1      ARG  35  -8.571   7.864 -10.556
  275   1HH2  ARG  35          1HH2      ARG  35 -10.746   7.546 -13.273
  276   2HH2  ARG  35          2HH2      ARG  35  -9.230   8.178 -12.725
  277    H    GLU  36           H        GLU  36 -11.048   2.199  -6.199
  278    HA   GLU  36           HA       GLU  36 -12.706   2.875  -4.047
  279   1HB   GLU  36          2HB       GLU  36 -12.366   0.595  -5.207
  280   2HB   GLU  36          1HB       GLU  36 -11.014   0.385  -4.101
  281   1HG   GLU  36          2HG       GLU  36 -12.812  -0.697  -3.078
  282   2HG   GLU  36          1HG       GLU  36 -12.669   0.844  -2.233
  283    H    ALA  37           H        ALA  37  -9.217   2.366  -4.270
  284    HA   ALA  37           HA       ALA  37  -8.621   2.395  -1.526
  285   1HB   ALA  37          1HB       ALA  37  -6.372   3.363  -2.356
  286   2HB   ALA  37          2HB       ALA  37  -7.047   3.139  -3.969
  287   3HB   ALA  37          3HB       ALA  37  -6.846   1.754  -2.899
  288    H    GLU  38           H        GLU  38  -8.718   5.075  -3.876
  289    HA   GLU  38           HA       GLU  38  -8.006   7.169  -2.263
  290   1HB   GLU  38          2HB       GLU  38  -9.899   6.932  -4.553
  291   2HB   GLU  38          1HB       GLU  38  -9.854   8.439  -3.649
  292   1HG   GLU  38          2HG       GLU  38  -7.400   8.530  -4.070
  293   2HG   GLU  38          1HG       GLU  38  -7.590   7.135  -5.131
  294    H    LYS  39           H        LYS  39 -11.253   5.765  -2.622
  295    HA   LYS  39           HA       LYS  39 -12.553   7.439  -0.792
  296   1HB   LYS  39          2HB       LYS  39 -13.757   5.909  -2.283
  297   2HB   LYS  39          1HB       LYS  39 -13.095   4.529  -1.418
  298   1HG   LYS  39          2HG       LYS  39 -14.597   6.518   0.174
  299   2HG   LYS  39          1HG       LYS  39 -15.519   5.505  -0.937
  300   1HD   LYS  39          2HD       LYS  39 -14.430   3.510   0.093
  301   2HD   LYS  39          1HD       LYS  39 -13.700   4.586   1.285
  302   1HE   LYS  39          2HE       LYS  39 -15.535   4.186   2.501
  303   2HE   LYS  39          1HE       LYS  39 -16.334   5.306   1.398
  304   1HZ   LYS  39          1HZ       LYS  39 -16.564   2.418   1.597
  305   2HZ   LYS  39          2HZ       LYS  39 -16.527   3.039   0.024
  306   3HZ   LYS  39          3HZ       LYS  39 -17.709   3.566   1.113
  307    H    LYS  40           H        LYS  40 -11.176   4.193  -0.280
  308    HA   LYS  40           HA       LYS  40 -11.529   4.076   2.479
  309   1HB   LYS  40          2HB       LYS  40  -9.336   2.823   0.823
  310   2HB   LYS  40          1HB       LYS  40  -9.768   2.353   2.462
  311   1HG   LYS  40          2HG       LYS  40 -12.067   2.322   0.711
  312   2HG   LYS  40          1HG       LYS  40 -10.768   1.296   0.102
  313   1HD   LYS  40          2HD       LYS  40 -11.014  -0.202   1.761
  314   2HD   LYS  40          1HD       LYS  40 -11.248   1.048   2.984
  315   1HE   LYS  40          2HE       LYS  40 -13.348   0.199   0.994
  316   2HE   LYS  40          1HE       LYS  40 -13.226  -0.429   2.637
  317   1HZ   LYS  40          1HZ       LYS  40 -13.907   2.307   1.759
  318   2HZ   LYS  40          2HZ       LYS  40 -13.349   2.008   3.327
  319   3HZ   LYS  40          3HZ       LYS  40 -14.775   1.277   2.785
  320    H    ILE  41           H        ILE  41  -9.152   5.789   0.599
  321    HA   ILE  41           HA       ILE  41  -7.540   6.325   2.987
  322    HB   ILE  41           HB       ILE  41  -7.016   7.235   0.168
  323   1HG1  ILE  41          2HG1      ILE  41  -5.514   4.990   1.443
  324   2HG1  ILE  41          1HG1      ILE  41  -7.100   4.654   0.759
  325   1HG2  ILE  41          1HG2      ILE  41  -5.423   7.259   2.706
  326   2HG2  ILE  41          2HG2      ILE  41  -5.758   8.585   1.592
  327   3HG2  ILE  41          3HG2      ILE  41  -4.635   7.306   1.128
  328   1HD1  ILE  41          1HD1      ILE  41  -6.337   5.519  -1.400
  329   2HD1  ILE  41          2HD1      ILE  41  -5.354   4.167  -0.839
  330   3HD1  ILE  41          3HD1      ILE  41  -4.744   5.816  -0.706
  331    H    LYS  42           H        LYS  42 -10.170   7.660   1.420
  332    HA   LYS  42           HA       LYS  42  -9.441  10.418   2.046
  333   1HB   LYS  42          2HB       LYS  42 -11.386   9.121   0.263
  334   2HB   LYS  42          1HB       LYS  42 -11.951  10.588   1.052
  335   1HG   LYS  42          2HG       LYS  42  -9.279  10.846  -0.073
  336   2HG   LYS  42          1HG       LYS  42 -10.513  10.467  -1.275
  337   1HD   LYS  42          2HD       LYS  42 -11.750  12.385   0.229
  338   2HD   LYS  42          1HD       LYS  42 -10.069  12.918   0.266
  339   1HE   LYS  42          2HE       LYS  42 -10.738  13.945  -1.654
  340   2HE   LYS  42          1HE       LYS  42 -10.230  12.396  -2.323
  341   1HZ   LYS  42          1HZ       LYS  42 -12.556  11.660  -2.193
  342   2HZ   LYS  42          2HZ       LYS  42 -12.366  13.002  -3.204
  343   3HZ   LYS  42          3HZ       LYS  42 -13.010  13.196  -1.651
  344    H    GLU  43           H        GLU  43 -10.033   8.312   4.071
  345    HA   GLU  43           HA       GLU  43 -12.027   9.848   5.557
  346   1HB   GLU  43          2HB       GLU  43 -12.075   6.840   5.290
  347   2HB   GLU  43          1HB       GLU  43 -13.103   7.782   6.361
  348   1HG   GLU  43          2HG       GLU  43 -14.334   8.670   4.605
  349   2HG   GLU  43          1HG       GLU  43 -13.090   8.293   3.415
  350    H    LEU  44           H        LEU  44  -9.942   6.969   5.868
  351    HA   LEU  44           HA       LEU  44  -9.189   7.879   8.547
  352   1HB   LEU  44          2HB       LEU  44  -9.814   5.682   8.775
  353   2HB   LEU  44          1HB       LEU  44  -9.283   5.249   7.163
  354    HG   LEU  44           HG       LEU  44  -7.182   5.931   9.153
  355   1HD1  LEU  44          1HD1      LEU  44  -7.365   3.305   9.607
  356   2HD1  LEU  44          2HD1      LEU  44  -9.077   3.683   9.411
  357   3HD1  LEU  44          3HD1      LEU  44  -8.126   4.516  10.640
  358   1HD2  LEU  44          1HD2      LEU  44  -6.079   4.033   7.951
  359   2HD2  LEU  44          2HD2      LEU  44  -6.487   5.415   6.933
  360   3HD2  LEU  44          3HD2      LEU  44  -7.491   3.967   6.896
  361    H    PHE  45           H        PHE  45  -6.965   7.912   9.178
  362    HA   PHE  45           HA       PHE  45  -5.233   8.821   7.035
  363   1HB   PHE  45          2HB       PHE  45  -5.495   9.972   9.303
  364   2HB   PHE  45          1HB       PHE  45  -4.529   8.656   9.963
  365    HD1  PHE  45           1HD      PHE  45  -4.485  11.797   8.243
  366    HD2  PHE  45           2HD      PHE  45  -2.198   8.304   9.065
  367    HE1  PHE  45           1HE      PHE  45  -2.430  13.001   7.624
  368    HE2  PHE  45           2HE      PHE  45  -0.140   9.500   8.447
  369    HZ   PHE  45           HZ       PHE  45  -0.253  11.853   7.727
  370    H    PHE  46           H        PHE  46  -4.938   6.754   5.994
  371    HA   PHE  46           HA       PHE  46  -3.788   4.537   7.330
  372   1HB   PHE  46          2HB       PHE  46  -4.189   5.310   4.470
  373   2HB   PHE  46          1HB       PHE  46  -3.111   3.969   4.846
  374    HD1  PHE  46           1HD      PHE  46  -6.285   4.658   3.832
  375    HD2  PHE  46           2HD      PHE  46  -4.245   2.395   6.804
  376    HE1  PHE  46           1HE      PHE  46  -8.224   3.152   4.012
  377    HE2  PHE  46           2HE      PHE  46  -6.180   0.885   6.988
  378    HZ   PHE  46           HZ       PHE  46  -8.173   1.266   5.593
  379    HA   PRO  47           HA       PRO  47   0.320   6.338   7.583
  380   1HB   PRO  47          2HB       PRO  47   1.470   4.299   8.949
  381   2HB   PRO  47          1HB       PRO  47   0.424   5.497   9.721
  382   1HG   PRO  47          2HG       PRO  47  -0.213   2.717   8.826
  383   2HG   PRO  47          1HG       PRO  47  -0.710   3.563  10.302
  384   1HD   PRO  47          2HD       PRO  47  -2.329   3.267   8.130
  385   2HD   PRO  47          1HD       PRO  47  -2.444   4.635   9.252
  386    H    VAL  48           H        VAL  48  -0.259   2.963   6.647
  387    HA   VAL  48           HA       VAL  48   1.957   3.212   4.729
  388    HB   VAL  48           HB       VAL  48   1.131   0.649   6.081
  389   1HG1  VAL  48          1HG1      VAL  48   2.208   0.272   3.970
  390   2HG1  VAL  48          2HG1      VAL  48   3.350  -0.114   5.256
  391   3HG1  VAL  48          3HG1      VAL  48   3.498   1.406   4.374
  392   1HG2  VAL  48          1HG2      VAL  48   2.007   2.302   7.696
  393   2HG2  VAL  48          2HG2      VAL  48   3.485   2.411   6.739
  394   3HG2  VAL  48          3HG2      VAL  48   3.049   0.891   7.520
  395    H    ILE  49           H        ILE  49   1.422   2.939   2.682
  396    HA   ILE  49           HA       ILE  49  -1.110   1.574   2.039
  397    HB   ILE  49           HB       ILE  49   0.226   3.575   0.232
  398   1HG1  ILE  49          2HG1      ILE  49  -0.219   4.627   2.456
  399   2HG1  ILE  49          1HG1      ILE  49  -1.147   5.339   1.140
  400   1HG2  ILE  49          1HG2      ILE  49  -2.675   2.811   0.466
  401   2HG2  ILE  49          2HG2      ILE  49  -1.538   2.004  -0.613
  402   3HG2  ILE  49          3HG2      ILE  49  -1.894   3.718  -0.830
  403   1HD1  ILE  49          1HD1      ILE  49  -2.384   4.970   3.291
  404   2HD1  ILE  49          2HD1      ILE  49  -2.260   3.239   2.974
  405   3HD1  ILE  49          3HD1      ILE  49  -3.133   4.281   1.851
  406    H    VAL  50           H        VAL  50  -1.062  -0.093   0.632
  407    HA   VAL  50           HA       VAL  50   1.437  -0.585  -0.846
  408    HB   VAL  50           HB       VAL  50  -0.135  -2.682   0.657
  409   1HG1  VAL  50          1HG1      VAL  50   2.424  -3.577  -0.231
  410   2HG1  VAL  50          2HG1      VAL  50   1.535  -2.936  -1.613
  411   3HG1  VAL  50          3HG1      VAL  50   0.830  -4.216  -0.627
  412   1HG2  VAL  50          1HG2      VAL  50   2.713  -2.214   1.239
  413   2HG2  VAL  50          2HG2      VAL  50   1.374  -2.571   2.329
  414   3HG2  VAL  50          3HG2      VAL  50   1.613  -0.929   1.733
  415    H    LEU  51           H        LEU  51   0.930  -0.407  -2.910
  416    HA   LEU  51           HA       LEU  51  -1.685  -1.030  -3.935
  417   1HB   LEU  51          2HB       LEU  51  -0.110   0.806  -4.752
  418   2HB   LEU  51          1HB       LEU  51   0.796  -0.467  -5.546
  419    HG   LEU  51           HG       LEU  51  -1.026  -0.975  -7.005
  420   1HD1  LEU  51          1HD1      LEU  51  -2.917  -0.850  -5.595
  421   2HD1  LEU  51          2HD1      LEU  51  -3.155   0.373  -6.843
  422   3HD1  LEU  51          3HD1      LEU  51  -2.625   0.849  -5.230
  423   1HD2  LEU  51          1HD2      LEU  51  -0.396   1.932  -6.686
  424   2HD2  LEU  51          2HD2      LEU  51  -1.511   1.385  -7.938
  425   3HD2  LEU  51          3HD2      LEU  51   0.152   0.798  -7.920
  426    H    ASP  52           H        ASP  52  -1.790  -2.426  -6.002
  427    HA   ASP  52           HA       ASP  52  -0.055  -4.782  -5.754
  428   1HB   ASP  52          2HB       ASP  52  -2.450  -4.918  -4.661
  429   2HB   ASP  52          1HB       ASP  52  -2.959  -5.190  -6.325
  430    H    VAL  53           H        VAL  53  -2.679  -3.403  -7.750
  431    HA   VAL  53           HA       VAL  53  -2.944  -3.255 -10.009
  432    HB   VAL  53           HB       VAL  53   0.053  -3.579 -10.224
  433   1HG1  VAL  53          1HG1      VAL  53  -0.129  -2.856 -12.344
  434   2HG1  VAL  53          2HG1      VAL  53  -1.409  -1.709 -11.954
  435   3HG1  VAL  53          3HG1      VAL  53  -1.795  -3.412 -12.194
  436   1HG2  VAL  53          1HG2      VAL  53  -0.236  -1.882  -8.598
  437   2HG2  VAL  53          2HG2      VAL  53  -1.569  -1.152  -9.491
  438   3HG2  VAL  53          3HG2      VAL  53   0.074  -1.056 -10.124
  439    H    TRP  54           H        TRP  54  -3.304  -5.774  -8.888
  440    HA   TRP  54           HA       TRP  54  -1.907  -7.847 -10.168
  441   1HB   TRP  54          2HB       TRP  54  -3.210  -8.289  -8.182
  442   2HB   TRP  54          1HB       TRP  54  -4.691  -7.782  -8.984
  443    HD1  TRP  54           HD       TRP  54  -6.135  -9.756  -9.709
  444    HE1  TRP  54           1HE      TRP  54  -5.721 -12.196 -10.415
  445    HE3  TRP  54           3HE      TRP  54  -1.032  -9.823  -9.444
  446    HZ2  TRP  54           2HZ      TRP  54  -3.523 -13.921 -10.808
  447    HZ3  TRP  54           3HZ      TRP  54   0.151 -11.908 -10.001
  448    HH2  TRP  54           HH       TRP  54  -1.070 -13.915 -10.668
  449    H    MET  55           H        MET  55  -5.365  -7.693 -10.770
  450    HA   MET  55           HA       MET  55  -5.020  -8.479 -13.479
  451   1HB   MET  55          2HB       MET  55  -6.960  -9.162 -12.128
  452   2HB   MET  55          1HB       MET  55  -7.506  -7.492 -12.070
  453   1HG   MET  55          2HG       MET  55  -8.795  -8.240 -13.773
  454   2HG   MET  55          1HG       MET  55  -7.380  -7.735 -14.695
  455   1HE   MET  55          1HE       MET  55  -9.889  -9.607 -14.882
  456   2HE   MET  55          2HE       MET  55  -9.600 -11.345 -14.799
  457   3HE   MET  55          3HE       MET  55  -9.233 -10.460 -16.280
  458    HA   PRO  56           HA       PRO  56  -6.480  -3.985 -14.476
  459   1HB   PRO  56          2HB       PRO  56  -6.274  -2.114 -12.541
  460   2HB   PRO  56          1HB       PRO  56  -7.716  -3.122 -12.729
  461   1HG   PRO  56          2HG       PRO  56  -5.418  -3.440 -10.832
  462   2HG   PRO  56          1HG       PRO  56  -7.158  -3.579 -10.512
  463   1HD   PRO  56          2HD       PRO  56  -5.568  -5.735 -10.880
  464   2HD   PRO  56          1HD       PRO  56  -7.272  -5.714 -11.373
  465    H    ASP  57           H        ASP  57  -5.281  -1.616 -14.176
  466    HA   ASP  57           HA       ASP  57  -2.484  -1.810 -13.627
  467   1HB   ASP  57          2HB       ASP  57  -3.087  -2.848 -16.026
  468   2HB   ASP  57          1HB       ASP  57  -2.919  -1.154 -16.474
  469    H    GLY  58           H        GLY  58  -4.061  -0.092 -12.450
  470   1HA   GLY  58          2HA       GLY  58  -4.662   2.309 -13.767
  471   2HA   GLY  58          1HA       GLY  58  -4.426   2.131 -12.034
  472    H    ASP  59           H        ASP  59  -3.314   3.651 -14.744
  473    HA   ASP  59           HA       ASP  59  -0.535   3.797 -13.876
  474   1HB   ASP  59          2HB       ASP  59  -0.286   5.234 -15.944
  475   2HB   ASP  59          1HB       ASP  59  -0.783   3.571 -16.238
  476    H    GLY  60           H        GLY  60  -2.648   4.919 -12.219
  477   1HA   GLY  60          2HA       GLY  60  -2.694   7.751 -12.512
  478   2HA   GLY  60          1HA       GLY  60  -3.189   6.845 -11.089
  479    H    VAL  61           H        VAL  61  -0.187   7.656 -12.840
  480    HA   VAL  61           HA       VAL  61   1.632   7.314 -10.822
  481    HB   VAL  61           HB       VAL  61   1.699   9.585 -12.809
  482   1HG1  VAL  61          1HG1      VAL  61   3.837   8.107 -11.299
  483   2HG1  VAL  61          2HG1      VAL  61   3.408   9.813 -11.169
  484   3HG1  VAL  61          3HG1      VAL  61   4.158   9.201 -12.644
  485   1HG2  VAL  61          1HG2      VAL  61   1.783   6.714 -13.220
  486   2HG2  VAL  61          2HG2      VAL  61   3.237   7.516 -13.815
  487   3HG2  VAL  61          3HG2      VAL  61   1.652   8.020 -14.398
  488    H    ASN  62           H        ASN  62  -0.376  10.144 -11.483
  489    HA   ASN  62           HA       ASN  62   0.684  11.857  -9.546
  490   1HB   ASN  62          2HB       ASN  62  -1.411  11.934 -11.411
  491   2HB   ASN  62          1HB       ASN  62  -2.168  12.235  -9.850
  492   1HD2  ASN  62          1HD2      ASN  62  -0.253  13.498 -12.355
  493   2HD2  ASN  62          2HD2      ASN  62   0.064  15.045 -11.654
  494    H    PHE  63           H        PHE  63  -1.231   9.031  -9.176
  495    HA   PHE  63           HA       PHE  63  -2.741   9.513  -6.931
  496   1HB   PHE  63          2HB       PHE  63  -2.710   7.368  -8.200
  497   2HB   PHE  63          1HB       PHE  63  -1.171   6.977  -7.437
  498    HD1  PHE  63           1HD      PHE  63  -4.562   8.138  -6.400
  499    HD2  PHE  63           2HD      PHE  63  -1.273   5.546  -5.638
  500    HE1  PHE  63           1HE      PHE  63  -5.761   7.187  -4.477
  501    HE2  PHE  63           2HE      PHE  63  -2.472   4.588  -3.713
  502    HZ   PHE  63           HZ       PHE  63  -4.725   5.410  -3.132
  503    H    ILE  64           H        ILE  64   0.715   8.702  -7.074
  504    HA   ILE  64           HA       ILE  64   1.288   8.347  -4.411
  505    HB   ILE  64           HB       ILE  64   3.017   9.960  -6.290
  506   1HG1  ILE  64          2HG1      ILE  64   3.691   7.144  -6.019
  507   2HG1  ILE  64          1HG1      ILE  64   2.081   7.364  -6.696
  508   1HG2  ILE  64          1HG2      ILE  64   4.769   9.598  -4.874
  509   2HG2  ILE  64          2HG2      ILE  64   4.091   8.100  -4.237
  510   3HG2  ILE  64          3HG2      ILE  64   3.453   9.655  -3.703
  511   1HD1  ILE  64          1HD1      ILE  64   4.715   7.954  -7.843
  512   2HD1  ILE  64          2HD1      ILE  64   3.460   9.149  -8.156
  513   3HD1  ILE  64          3HD1      ILE  64   3.213   7.467  -8.627
  514    H    ASP  65           H        ASP  65   0.500  11.298  -6.089
  515    HA   ASP  65           HA       ASP  65   1.362  13.104  -4.082
  516   1HB   ASP  65          2HB       ASP  65   0.340  13.337  -6.652
  517   2HB   ASP  65          1HB       ASP  65  -0.934  14.018  -5.644
  518    H    PHE  66           H        PHE  66  -1.887  11.823  -4.894
  519    HA   PHE  66           HA       PHE  66  -3.396  12.999  -2.965
  520   1HB   PHE  66          2HB       PHE  66  -4.534  11.664  -4.512
  521   2HB   PHE  66          1HB       PHE  66  -3.471  10.288  -4.257
  522    HD1  PHE  66           1HD      PHE  66  -3.777   8.828  -2.307
  523    HD2  PHE  66           2HD      PHE  66  -6.454  12.025  -3.156
  524    HE1  PHE  66           1HE      PHE  66  -5.437   7.838  -0.790
  525    HE2  PHE  66           2HE      PHE  66  -8.120  11.040  -1.640
  526    HZ   PHE  66           HZ       PHE  66  -7.615   8.943  -0.456
  527    H    ILE  67           H        ILE  67  -1.371  10.107  -2.608
  528    HA   ILE  67           HA       ILE  67  -2.074   9.524   0.053
  529    HB   ILE  67           HB       ILE  67   0.406   8.897  -1.545
  530   1HG1  ILE  67          2HG1      ILE  67  -0.718   6.530  -0.999
  531   2HG1  ILE  67          1HG1      ILE  67  -2.159   7.535  -0.895
  532   1HG2  ILE  67          1HG2      ILE  67   1.391   8.716   0.497
  533   2HG2  ILE  67          2HG2      ILE  67   0.608   7.137   0.441
  534   3HG2  ILE  67          3HG2      ILE  67  -0.139   8.460   1.336
  535   1HD1  ILE  67          1HD1      ILE  67  -0.657   8.186  -3.253
  536   2HD1  ILE  67          2HD1      ILE  67  -2.320   7.620  -3.099
  537   3HD1  ILE  67          3HD1      ILE  67  -0.998   6.456  -3.185
  538    H    LYS  68           H        LYS  68   0.616  11.443  -1.287
  539    HA   LYS  68           HA       LYS  68   1.563  12.203   1.316
  540   1HB   LYS  68          2HB       LYS  68   2.220  13.462  -1.353
  541   2HB   LYS  68          1HB       LYS  68   3.148  13.597   0.135
  542   1HG   LYS  68          2HG       LYS  68   2.824  10.835  -0.502
  543   2HG   LYS  68          1HG       LYS  68   3.414  11.693  -1.927
  544   1HD   LYS  68          2HD       LYS  68   5.436  11.413  -0.987
  545   2HD   LYS  68          1HD       LYS  68   4.963  12.776   0.030
  546   1HE   LYS  68          2HE       LYS  68   3.853  10.805   1.443
  547   2HE   LYS  68          1HE       LYS  68   5.150   9.888   0.676
  548   1HZ   LYS  68          1HZ       LYS  68   5.326  12.105   2.594
  549   2HZ   LYS  68          2HZ       LYS  68   6.588  11.879   1.489
  550   3HZ   LYS  68          3HZ       LYS  68   6.173  10.642   2.564
  551    H    GLU  69           H        GLU  69  -0.954  13.252  -0.695
  552    HA   GLU  69           HA       GLU  69  -0.976  16.014   0.011
  553   1HB   GLU  69          2HB       GLU  69  -2.086  14.922  -2.010
  554   2HB   GLU  69          1HB       GLU  69  -3.349  14.411  -0.900
  555   1HG   GLU  69          2HG       GLU  69  -3.714  16.788  -0.303
  556   2HG   GLU  69          1HG       GLU  69  -2.545  17.236  -1.542
  557    H    ASN  70           H        ASN  70  -2.896  13.211   1.031
  558    HA   ASN  70           HA       ASN  70  -3.719  14.724   3.414
  559   1HB   ASN  70          2HB       ASN  70  -5.064  12.223   2.413
  560   2HB   ASN  70          1HB       ASN  70  -5.714  13.467   3.477
  561   1HD2  ASN  70          1HD2      ASN  70  -4.544  12.933   0.184
  562   2HD2  ASN  70          2HD2      ASN  70  -5.590  14.083  -0.566
  563    H    SER  71           H        SER  71  -1.284  12.893   2.743
  564    HA   SER  71           HA       SER  71  -1.120  11.749   5.372
  565   1HB   SER  71          2HB       SER  71  -1.898  10.089   3.112
  566   2HB   SER  71          1HB       SER  71  -0.407   9.515   3.856
  567    HG   SER  71           HG       SER  71  -2.977   9.504   4.823
  568    HA   PRO  72           HA       PRO  72   2.834  13.135   3.265
  569   1HB   PRO  72          2HB       PRO  72   3.136  14.818   5.643
  570   2HB   PRO  72          1HB       PRO  72   3.203  15.273   3.939
  571   1HG   PRO  72          2HG       PRO  72   1.149  15.980   5.538
  572   2HG   PRO  72          1HG       PRO  72   0.936  15.643   3.810
  573   1HD   PRO  72          2HD       PRO  72   0.332  13.905   6.172
  574   2HD   PRO  72          1HD       PRO  72  -0.600  14.144   4.679
  575    H    ASP  73           H        ASP  73   1.892  12.033   6.363
  576    HA   ASP  73           HA       ASP  73   4.619  11.147   6.984
  577   1HB   ASP  73          2HB       ASP  73   2.886  12.437   8.596
  578   2HB   ASP  73          1HB       ASP  73   2.486  10.767   8.984
  579    H    SER  74           H        SER  74   2.992   9.864   4.981
  580    HA   SER  74           HA       SER  74   2.440   7.273   6.264
  581   1HB   SER  74          2HB       SER  74   0.488   8.213   5.151
  582   2HB   SER  74          1HB       SER  74   1.402   8.406   3.656
  583    HG   SER  74           HG       SER  74   1.029   6.393   3.210
  584    H    VAL  75           H        VAL  75   2.590   5.495   4.384
  585    HA   VAL  75           HA       VAL  75   5.206   5.826   3.072
  586    HB   VAL  75           HB       VAL  75   4.313   3.284   4.438
  587   1HG1  VAL  75          1HG1      VAL  75   6.529   4.014   2.631
  588   2HG1  VAL  75          2HG1      VAL  75   5.759   2.452   2.911
  589   3HG1  VAL  75          3HG1      VAL  75   6.976   3.051   4.039
  590   1HG2  VAL  75          1HG2      VAL  75   5.062   5.434   5.802
  591   2HG2  VAL  75          2HG2      VAL  75   6.665   4.849   5.361
  592   3HG2  VAL  75          3HG2      VAL  75   5.567   3.812   6.271
  593    H    VAL  76           H        VAL  76   5.442   5.002   1.101
  594    HA   VAL  76           HA       VAL  76   3.152   3.552  -0.071
  595    HB   VAL  76           HB       VAL  76   4.817   5.443  -1.701
  596   1HG1  VAL  76          1HG1      VAL  76   2.460   3.776  -2.099
  597   2HG1  VAL  76          2HG1      VAL  76   3.581   4.457  -3.278
  598   3HG1  VAL  76          3HG1      VAL  76   2.249   5.434  -2.661
  599   1HG2  VAL  76          1HG2      VAL  76   2.555   6.094   0.138
  600   2HG2  VAL  76          2HG2      VAL  76   2.752   6.996  -1.366
  601   3HG2  VAL  76          3HG2      VAL  76   4.046   6.986  -0.167
  602    H    ILE  77           H        ILE  77   3.876   1.531  -0.303
  603    HA   ILE  77           HA       ILE  77   6.602   1.039  -1.212
  604    HB   ILE  77           HB       ILE  77   4.454  -0.949  -0.449
  605   1HG1  ILE  77          2HG1      ILE  77   5.133   0.524   1.424
  606   2HG1  ILE  77          1HG1      ILE  77   5.616  -1.149   1.680
  607   1HG2  ILE  77          1HG2      ILE  77   5.856  -2.595  -0.995
  608   2HG2  ILE  77          2HG2      ILE  77   7.226  -1.795  -0.223
  609   3HG2  ILE  77          3HG2      ILE  77   6.778  -1.378  -1.877
  610   1HD1  ILE  77          1HD1      ILE  77   7.726   0.252   0.359
  611   2HD1  ILE  77          2HD1      ILE  77   7.721  -0.530   1.941
  612   3HD1  ILE  77          3HD1      ILE  77   7.215   1.152   1.788
  613    H    VAL  78           H        VAL  78   3.263   0.431  -2.225
  614    HA   VAL  78           HA       VAL  78   2.357  -0.248  -4.209
  615    HB   VAL  78           HB       VAL  78   4.610   1.401  -5.367
  616   1HG1  VAL  78          1HG1      VAL  78   1.851   0.934  -6.483
  617   2HG1  VAL  78          2HG1      VAL  78   3.252  -0.037  -6.933
  618   3HG1  VAL  78          3HG1      VAL  78   3.230   1.692  -7.278
  619   1HG2  VAL  78          1HG2      VAL  78   1.891   2.500  -4.858
  620   2HG2  VAL  78          2HG2      VAL  78   3.448   3.324  -4.928
  621   3HG2  VAL  78          3HG2      VAL  78   3.017   2.372  -3.507
  622    H    ILE  79           H        ILE  79   2.658  -2.429  -4.324
  623    HA   ILE  79           HA       ILE  79   5.035  -3.359  -5.807
  624    HB   ILE  79           HB       ILE  79   3.418  -5.159  -4.031
  625   1HG1  ILE  79          2HG1      ILE  79   5.850  -3.601  -3.147
  626   2HG1  ILE  79          1HG1      ILE  79   4.198  -3.189  -2.700
  627   1HG2  ILE  79          1HG2      ILE  79   5.907  -6.088  -3.899
  628   2HG2  ILE  79          2HG2      ILE  79   6.014  -5.259  -5.451
  629   3HG2  ILE  79          3HG2      ILE  79   4.804  -6.518  -5.206
  630   1HD1  ILE  79          1HD1      ILE  79   3.985  -4.995  -1.300
  631   2HD1  ILE  79          2HD1      ILE  79   5.686  -4.576  -1.088
  632   3HD1  ILE  79          3HD1      ILE  79   5.233  -5.923  -2.132
  633    H    THR  80           H        THR  80   4.712  -4.973  -7.400
  634    HA   THR  80           HA       THR  80   2.008  -5.823  -8.003
  635    HB   THR  80           HB       THR  80   1.831  -4.853 -10.151
  636    HG1  THR  80           1HG      THR  80   4.466  -3.853  -9.887
  637   1HG2  THR  80          1HG2      THR  80   1.423  -3.233  -8.321
  638   2HG2  THR  80          2HG2      THR  80   1.940  -2.492  -9.836
  639   3HG2  THR  80          3HG2      THR  80   3.085  -2.672  -8.507
  640    H    GLY  81           H        GLY  81   5.259  -5.620  -9.494
  641   1HA   GLY  81          2HA       GLY  81   5.991  -8.244  -9.304
  642   2HA   GLY  81          1HA       GLY  81   4.955  -8.203 -10.722
  643    H    HIS  82           H        HIS  82   7.064  -9.005 -11.641
  644    HA   HIS  82           HA       HIS  82   9.153  -7.056 -12.000
  645   1HB   HIS  82          2HB       HIS  82  10.144  -8.797 -13.498
  646   2HB   HIS  82          1HB       HIS  82   9.802  -9.366 -11.868
  647    HD1  HIS  82           1HD      HIS  82   7.882  -9.309 -15.166
  648    HD2  HIS  82           2HD      HIS  82   8.670 -11.808 -11.940
  649    HE1  HIS  82           1HE      HIS  82   6.687 -11.462 -15.674
  650    HE2  HIS  82           2HE      HIS  82   7.258 -12.990 -13.756
  651    H    GLY  83           H        GLY  83   6.277  -7.987 -13.676
  652   1HA   GLY  83          2HA       GLY  83   7.095  -6.945 -16.237
  653   2HA   GLY  83          1HA       GLY  83   5.480  -7.472 -15.791
  654    H    SER  84           H        SER  84   7.699  -4.906 -14.682
  655    HA   SER  84           HA       SER  84   6.335  -2.735 -15.713
  656   1HB   SER  84          2HB       SER  84   4.752  -3.907 -13.761
  657   2HB   SER  84          1HB       SER  84   5.548  -2.593 -12.897
  658    HG   SER  84           HG       SER  84   3.521  -2.074 -14.023
  659    H    VAL  85           H        VAL  85   8.900  -3.066 -15.574
  660    HA   VAL  85           HA       VAL  85  10.175  -2.157 -13.200
  661    HB   VAL  85           HB       VAL  85  12.186  -1.896 -14.615
  662   1HG1  VAL  85          1HG1      VAL  85  10.626  -4.455 -14.936
  663   2HG1  VAL  85          2HG1      VAL  85  11.771  -4.050 -13.656
  664   3HG1  VAL  85          3HG1      VAL  85  12.341  -4.286 -15.308
  665   1HG2  VAL  85          1HG2      VAL  85  11.742  -1.274 -16.732
  666   2HG2  VAL  85          2HG2      VAL  85  10.167  -2.070 -16.747
  667   3HG2  VAL  85          3HG2      VAL  85  11.634  -3.010 -17.020
  668    H    ASP  86           H        ASP  86   8.711  -0.546 -15.901
  669    HA   ASP  86           HA       ASP  86  10.018   1.982 -15.311
  670   1HB   ASP  86          2HB       ASP  86   7.806   1.435 -17.302
  671   2HB   ASP  86          1HB       ASP  86   8.857   2.847 -17.244
  672    H    THR  87           H        THR  87   7.219   0.308 -14.305
  673    HA   THR  87           HA       THR  87   5.707   2.708 -13.689
  674    HB   THR  87           HB       THR  87   4.801   0.269 -14.232
  675    HG1  THR  87           1HG      THR  87   2.902   0.855 -13.120
  676   1HG2  THR  87          1HG2      THR  87   5.963  -0.631 -12.110
  677   2HG2  THR  87          2HG2      THR  87   4.301  -1.116 -12.445
  678   3HG2  THR  87          3HG2      THR  87   4.630   0.138 -11.251
  679    H    ALA  88           H        ALA  88   7.805   0.408 -12.134
  680    HA   ALA  88           HA       ALA  88   7.393   1.114  -9.455
  681   1HB   ALA  88          1HB       ALA  88   9.971   0.205 -10.733
  682   2HB   ALA  88          2HB       ALA  88   8.668  -0.871 -10.231
  683   3HB   ALA  88          3HB       ALA  88   9.536   0.085  -9.031
  684    H    VAL  89           H        VAL  89  10.031   2.103 -11.617
  685    HA   VAL  89           HA       VAL  89  11.060   4.113  -9.981
  686    HB   VAL  89           HB       VAL  89  12.270   4.898 -11.904
  687   1HG1  VAL  89          1HG1      VAL  89  12.466   2.402 -10.950
  688   2HG1  VAL  89          2HG1      VAL  89  13.517   3.036 -12.217
  689   3HG1  VAL  89          3HG1      VAL  89  12.123   2.043 -12.643
  690   1HG2  VAL  89          1HG2      VAL  89  11.755   4.069 -14.186
  691   2HG2  VAL  89          2HG2      VAL  89  10.486   5.093 -13.513
  692   3HG2  VAL  89          3HG2      VAL  89  10.278   3.342 -13.550
  693    H    LYS  90           H        LYS  90   8.353   4.096 -12.182
  694    HA   LYS  90           HA       LYS  90   8.086   6.957 -12.284
  695   1HB   LYS  90          2HB       LYS  90   7.318   5.457 -14.105
  696   2HB   LYS  90          1HB       LYS  90   6.086   4.820 -13.025
  697   1HG   LYS  90          2HG       LYS  90   4.916   6.858 -12.986
  698   2HG   LYS  90          1HG       LYS  90   6.270   7.737 -13.700
  699   1HD   LYS  90          2HD       LYS  90   4.644   5.599 -15.077
  700   2HD   LYS  90          1HD       LYS  90   4.469   7.337 -15.325
  701   1HE   LYS  90          2HE       LYS  90   5.953   7.112 -16.974
  702   2HE   LYS  90          1HE       LYS  90   7.164   6.909 -15.709
  703   1HZ   LYS  90          1HZ       LYS  90   7.026   5.142 -17.516
  704   2HZ   LYS  90          2HZ       LYS  90   5.622   4.610 -16.737
  705   3HZ   LYS  90          3HZ       LYS  90   7.100   4.607 -15.913
  706    H    ALA  91           H        ALA  91   7.556   4.770  -9.861
  707    HA   ALA  91           HA       ALA  91   5.389   6.397  -8.707
  708   1HB   ALA  91          1HB       ALA  91   4.316   4.565  -7.958
  709   2HB   ALA  91          2HB       ALA  91   5.813   3.703  -7.604
  710   3HB   ALA  91          3HB       ALA  91   5.201   3.765  -9.257
  711    H    ILE  92           H        ILE  92   8.386   4.633  -8.038
  712    HA   ILE  92           HA       ILE  92   8.507   5.452  -5.304
  713    HB   ILE  92           HB       ILE  92  10.615   4.396  -5.175
  714   1HG1  ILE  92          2HG1      ILE  92  10.694   4.591  -8.190
  715   2HG1  ILE  92          1HG1      ILE  92  11.775   5.375  -7.045
  716   1HG2  ILE  92          1HG2      ILE  92  10.200   2.203  -6.239
  717   2HG2  ILE  92          2HG2      ILE  92   8.886   2.932  -7.158
  718   3HG2  ILE  92          3HG2      ILE  92   8.788   2.847  -5.402
  719   1HD1  ILE  92          1HD1      ILE  92  13.033   3.611  -7.849
  720   2HD1  ILE  92          2HD1      ILE  92  11.659   2.505  -7.866
  721   3HD1  ILE  92          3HD1      ILE  92  12.392   2.978  -6.333
  722    H    LYS  93           H        LYS  93  10.159   6.518  -8.267
  723    HA   LYS  93           HA       LYS  93  11.790   8.457  -7.064
  724   1HB   LYS  93          2HB       LYS  93  11.431   7.513  -9.621
  725   2HB   LYS  93          1HB       LYS  93  10.820   9.157  -9.744
  726   1HG   LYS  93          2HG       LYS  93  13.557   8.311  -8.819
  727   2HG   LYS  93          1HG       LYS  93  13.147   9.120 -10.333
  728   1HD   LYS  93          2HD       LYS  93  12.584  10.325  -7.633
  729   2HD   LYS  93          1HD       LYS  93  14.098  10.586  -8.500
  730   1HE   LYS  93          2HE       LYS  93  11.324  11.314  -9.430
  731   2HE   LYS  93          1HE       LYS  93  12.602  12.424  -8.938
  732   1HZ   LYS  93          1HZ       LYS  93  13.876  11.174 -10.852
  733   2HZ   LYS  93          2HZ       LYS  93  12.867  12.492 -11.178
  734   3HZ   LYS  93          3HZ       LYS  93  12.304  10.917 -11.424
  735    H    LYS  94           H        LYS  94   8.420   8.456  -7.881
  736    HA   LYS  94           HA       LYS  94   8.003  11.254  -7.888
  737   1HB   LYS  94          2HB       LYS  94   6.425   8.895  -8.151
  738   2HB   LYS  94          1HB       LYS  94   5.654   9.971  -6.994
  739   1HG   LYS  94          2HG       LYS  94   4.832  10.355  -9.249
  740   2HG   LYS  94          1HG       LYS  94   5.682  11.771  -8.629
  741   1HD   LYS  94          2HD       LYS  94   7.740  10.661  -9.827
  742   2HD   LYS  94          1HD       LYS  94   6.484   9.855 -10.769
  743   1HE   LYS  94          2HE       LYS  94   6.686  12.840 -10.392
  744   2HE   LYS  94          1HE       LYS  94   7.318  11.968 -11.788
  745   1HZ   LYS  94          1HZ       LYS  94   4.569  12.606 -11.087
  746   2HZ   LYS  94          2HZ       LYS  94   4.823  11.080 -11.768
  747   3HZ   LYS  94          3HZ       LYS  94   5.295  12.469 -12.609
  748    H    GLY  95           H        GLY  95   7.088   8.860  -5.397
  749   1HA   GLY  95          2HA       GLY  95   8.150  10.441  -3.275
  750   2HA   GLY  95          1HA       GLY  95   6.412  10.646  -3.399
  751    H    ALA  96           H        ALA  96   7.661   7.545  -4.295
  752    HA   ALA  96           HA       ALA  96   6.376   6.403  -1.950
  753   1HB   ALA  96          1HB       ALA  96   5.927   4.616  -3.218
  754   2HB   ALA  96          2HB       ALA  96   7.585   4.512  -3.813
  755   3HB   ALA  96          3HB       ALA  96   6.440   5.613  -4.578
  756    H    TYR  97           H        TYR  97   7.727   4.069  -1.563
  757    HA   TYR  97           HA       TYR  97  10.260   5.041  -0.461
  758   1HB   TYR  97          2HB       TYR  97   8.813   4.229   1.254
  759   2HB   TYR  97          1HB       TYR  97   8.451   2.767   0.347
  760    HD1  TYR  97           1HD      TYR  97  11.333   4.553   1.914
  761    HD2  TYR  97           2HD      TYR  97   9.583   0.818   0.875
  762    HE1  TYR  97           1HE      TYR  97  13.138   3.382   3.105
  763    HE2  TYR  97           2HE      TYR  97  11.380  -0.364   2.065
  764    HH   TYR  97           HH       TYR  97  13.104   0.610   4.230
  765    H    GLU  98           H        GLU  98   8.961   2.941  -2.785
  766    HA   GLU  98           HA       GLU  98  11.004   2.363  -4.350
  767   1HB   GLU  98          2HB       GLU  98  12.056   0.239  -3.556
  768   2HB   GLU  98          1HB       GLU  98  12.452   1.626  -2.558
  769   1HG   GLU  98          2HG       GLU  98  10.459   0.820  -1.103
  770   2HG   GLU  98          1HG       GLU  98  10.704  -0.709  -1.943
  771    H    PHE  99           H        PHE  99  10.968  -0.403  -4.819
  772    HA   PHE  99           HA       PHE  99   8.112  -1.045  -5.047
  773   1HB   PHE  99          2HB       PHE  99   9.745  -0.222  -7.174
  774   2HB   PHE  99          1HB       PHE  99   9.581  -1.964  -7.360
  775    HD1  PHE  99           1HD      PHE  99   7.885  -2.657  -8.723
  776    HD2  PHE  99           2HD      PHE  99   7.381   0.930  -6.489
  777    HE1  PHE  99           1HE      PHE  99   5.673  -2.335  -9.750
  778    HE2  PHE  99           2HE      PHE  99   5.167   1.257  -7.512
  779    HZ   PHE  99           HZ       PHE  99   4.308  -0.377  -9.140
  780    H    LEU 100           H        LEU 100   8.104  -2.704  -3.598
  781    HA   LEU 100           HA       LEU 100  10.147  -4.615  -3.303
  782   1HB   LEU 100          2HB       LEU 100   8.196  -3.981  -1.733
  783   2HB   LEU 100          1HB       LEU 100   7.260  -5.131  -2.666
  784    HG   LEU 100           HG       LEU 100   8.602  -6.955  -1.955
  785   1HD1  LEU 100          1HD1      LEU 100  10.809  -6.425  -1.944
  786   2HD1  LEU 100          2HD1      LEU 100  10.497  -6.263  -0.216
  787   3HD1  LEU 100          3HD1      LEU 100  10.538  -4.830  -1.243
  788   1HD2  LEU 100          1HD2      LEU 100   8.366  -6.847   0.472
  789   2HD2  LEU 100          2HD2      LEU 100   6.952  -6.179  -0.342
  790   3HD2  LEU 100          3HD2      LEU 100   8.148  -5.100   0.375
  791    H    GLU 101           H        GLU 101   9.697  -7.028  -3.595
  792    HA   GLU 101           HA       GLU 101   8.939  -7.442  -6.383
  793   1HB   GLU 101          2HB       GLU 101  10.546  -9.015  -4.395
  794   2HB   GLU 101          1HB       GLU 101   9.924  -9.787  -5.848
  795   1HG   GLU 101          2HG       GLU 101  11.417  -8.779  -7.180
  796   2HG   GLU 101          1HG       GLU 101  11.321  -7.251  -6.306
  797    H    LYS 102           H        LYS 102   6.938  -8.046  -6.816
  798    HA   LYS 102           HA       LYS 102   5.104  -8.982  -4.893
  799   1HB   LYS 102          2HB       LYS 102   4.425  -7.787  -6.925
  800   2HB   LYS 102          1HB       LYS 102   4.953  -9.146  -7.906
  801   1HG   LYS 102          2HG       LYS 102   3.054  -9.884  -5.817
  802   2HG   LYS 102          1HG       LYS 102   2.413  -8.733  -6.989
  803   1HD   LYS 102          2HD       LYS 102   3.261 -10.276  -8.795
  804   2HD   LYS 102          1HD       LYS 102   3.584 -11.457  -7.524
  805   1HE   LYS 102          2HE       LYS 102   1.028 -10.779  -6.950
  806   2HE   LYS 102          1HE       LYS 102   1.031 -10.585  -8.702
  807   1HZ   LYS 102          1HZ       LYS 102   1.631 -12.818  -9.007
  808   2HZ   LYS 102          2HZ       LYS 102   0.426 -12.853  -7.820
  809   3HZ   LYS 102          3HZ       LYS 102   2.051 -13.031  -7.383
  810    HA   PRO 103           HA       PRO 103   5.721 -13.327  -6.935
  811   1HB   PRO 103          2HB       PRO 103   8.073 -13.765  -8.223
  812   2HB   PRO 103          1HB       PRO 103   6.613 -13.197  -9.041
  813   1HG   PRO 103          2HG       PRO 103   8.982 -11.638  -8.090
  814   2HG   PRO 103          1HG       PRO 103   8.082 -11.491  -9.611
  815   1HD   PRO 103          2HD       PRO 103   7.713  -9.804  -7.532
  816   2HD   PRO 103          1HD       PRO 103   6.404 -10.245  -8.643
  817    H    PHE 104           H        PHE 104   7.877 -11.501  -5.120
  818    HA   PHE 104           HA       PHE 104   9.508 -13.695  -4.192
  819   1HB   PHE 104          2HB       PHE 104   9.970 -11.045  -4.306
  820   2HB   PHE 104          1HB       PHE 104   9.400 -11.165  -2.644
  821    HD1  PHE 104           1HD      PHE 104  11.643 -13.152  -4.875
  822    HD2  PHE 104           2HD      PHE 104  11.070 -11.289  -1.092
  823    HE1  PHE 104           1HE      PHE 104  13.874 -13.910  -4.169
  824    HE2  PHE 104           2HE      PHE 104  13.300 -12.043  -0.379
  825    HZ   PHE 104           HZ       PHE 104  14.705 -13.356  -1.918
  826    H    SER 105           H        SER 105   9.695 -13.440  -1.527
  827    HA   SER 105           HA       SER 105   7.176 -14.558  -0.637
  828   1HB   SER 105          2HB       SER 105   9.211 -15.706   0.018
  829   2HB   SER 105          1HB       SER 105   9.841 -14.236   0.763
  830    HG   SER 105           HG       SER 105   8.282 -16.103   1.846
  831    H    VAL 106           H        VAL 106   5.668 -13.518   0.488
  832    HA   VAL 106           HA       VAL 106   5.757 -10.755   0.950
  833    HB   VAL 106           HB       VAL 106   3.658 -12.026   0.712
  834   1HG1  VAL 106          1HG1      VAL 106   4.222 -13.014   3.505
  835   2HG1  VAL 106          2HG1      VAL 106   4.306 -13.989   2.037
  836   3HG1  VAL 106          3HG1      VAL 106   2.763 -13.316   2.562
  837   1HG2  VAL 106          1HG2      VAL 106   3.291 -10.860   3.386
  838   2HG2  VAL 106          2HG2      VAL 106   2.496 -10.477   1.859
  839   3HG2  VAL 106          3HG2      VAL 106   4.091  -9.813   2.214
  840    H    GLU 107           H        GLU 107   7.027 -13.355   2.800
  841    HA   GLU 107           HA       GLU 107   6.883 -12.316   5.389
  842   1HB   GLU 107          2HB       GLU 107   7.704 -14.626   4.514
  843   2HB   GLU 107          1HB       GLU 107   9.275 -13.839   4.440
  844   1HG   GLU 107          2HG       GLU 107   8.496 -13.160   6.931
  845   2HG   GLU 107          1HG       GLU 107   7.705 -14.726   6.754
  846    H    ARG 108           H        ARG 108   9.252 -11.832   2.811
  847    HA   ARG 108           HA       ARG 108  11.071 -10.273   4.301
  848   1HB   ARG 108          2HB       ARG 108  11.679 -11.293   2.162
  849   2HB   ARG 108          1HB       ARG 108  10.508 -10.279   1.328
  850   1HG   ARG 108          2HG       ARG 108  11.896  -8.531   1.256
  851   2HG   ARG 108          1HG       ARG 108  12.439  -8.771   2.918
  852   1HD   ARG 108          2HD       ARG 108  14.317  -9.731   2.218
  853   2HD   ARG 108          1HD       ARG 108  13.414 -10.897   1.255
  854    HE   ARG 108           HE       ARG 108  13.355  -8.676  -0.277
  855   1HH1  ARG 108          1HH1      ARG 108  15.948 -10.405   1.294
  856   2HH1  ARG 108          2HH1      ARG 108  17.127  -9.967   0.104
  857   1HH2  ARG 108          1HH2      ARG 108  14.905  -8.100  -1.842
  858   2HH2  ARG 108          2HH2      ARG 108  16.536  -8.659  -1.677
  859    H    PHE 109           H        PHE 109   8.146  -9.509   2.531
  860    HA   PHE 109           HA       PHE 109   8.397  -6.716   2.446
  861   1HB   PHE 109          2HB       PHE 109   6.702  -7.739   1.107
  862   2HB   PHE 109          1HB       PHE 109   5.982  -8.531   2.502
  863    HD1  PHE 109           1HD      PHE 109   7.016  -4.990   2.007
  864    HD2  PHE 109           2HD      PHE 109   3.826  -7.728   2.666
  865    HE1  PHE 109           1HE      PHE 109   5.461  -3.104   2.279
  866    HE2  PHE 109           2HE      PHE 109   2.263  -5.847   2.937
  867    HZ   PHE 109           HZ       PHE 109   3.081  -3.534   2.746
  868    H    LEU 110           H        LEU 110   7.149  -8.898   4.912
  869    HA   LEU 110           HA       LEU 110   6.007  -7.066   6.654
  870   1HB   LEU 110          2HB       LEU 110   6.709  -9.792   6.686
  871   2HB   LEU 110          1HB       LEU 110   7.334  -9.074   8.160
  872    HG   LEU 110           HG       LEU 110   4.468  -8.980   7.225
  873   1HD1  LEU 110          1HD1      LEU 110   5.672 -10.394   9.590
  874   2HD1  LEU 110          2HD1      LEU 110   5.292 -11.174   8.055
  875   3HD1  LEU 110          3HD1      LEU 110   4.001 -10.468   9.028
  876   1HD2  LEU 110          1HD2      LEU 110   5.513  -7.006   8.588
  877   2HD2  LEU 110          2HD2      LEU 110   5.387  -8.137   9.935
  878   3HD2  LEU 110          3HD2      LEU 110   3.942  -7.667   9.039
  879    H    LEU 111           H        LEU 111   9.371  -7.989   6.235
  880    HA   LEU 111           HA       LEU 111  10.435  -6.792   8.530
  881   1HB   LEU 111          2HB       LEU 111  11.593  -7.388   5.829
  882   2HB   LEU 111          1HB       LEU 111  12.544  -6.627   7.089
  883    HG   LEU 111           HG       LEU 111  11.204  -9.032   8.034
  884   1HD1  LEU 111          1HD1      LEU 111  12.526  -9.128   5.441
  885   2HD1  LEU 111          2HD1      LEU 111  11.505 -10.323   6.242
  886   3HD1  LEU 111          3HD1      LEU 111  13.225 -10.239   6.619
  887   1HD2  LEU 111          1HD2      LEU 111  12.933  -8.033   9.324
  888   2HD2  LEU 111          2HD2      LEU 111  14.042  -8.031   7.952
  889   3HD2  LEU 111          3HD2      LEU 111  13.567  -9.557   8.700
  890    H    THR 112           H        THR 112   9.842  -5.461   5.298
  891    HA   THR 112           HA       THR 112  10.988  -2.919   5.867
  892    HB   THR 112           HB       THR 112   9.008  -3.731   3.728
  893    HG1  THR 112           1HG      THR 112  11.033  -4.829   3.664
  894   1HG2  THR 112          1HG2      THR 112   9.926  -1.813   2.467
  895   2HG2  THR 112          2HG2      THR 112  10.753  -1.292   3.936
  896   3HG2  THR 112          3HG2      THR 112   8.991  -1.346   3.888
  897    H    ILE 113           H        ILE 113   7.651  -4.131   5.766
  898    HA   ILE 113           HA       ILE 113   6.179  -1.891   6.174
  899    HB   ILE 113           HB       ILE 113   5.865  -4.687   7.179
  900   1HG1  ILE 113          2HG1      ILE 113   5.334  -4.080   4.841
  901   2HG1  ILE 113          1HG1      ILE 113   3.924  -4.664   5.717
  902   1HG2  ILE 113          1HG2      ILE 113   4.142  -2.362   8.002
  903   2HG2  ILE 113          2HG2      ILE 113   4.962  -3.531   9.038
  904   3HG2  ILE 113          3HG2      ILE 113   3.592  -4.038   8.051
  905   1HD1  ILE 113          1HD1      ILE 113   3.530  -2.113   6.152
  906   2HD1  ILE 113          2HD1      ILE 113   3.047  -2.861   4.629
  907   3HD1  ILE 113          3HD1      ILE 113   4.545  -1.935   4.720
  908    H    LYS 114           H        LYS 114   7.488  -3.851   8.858
  909    HA   LYS 114           HA       LYS 114   6.754  -2.282  10.976
  910   1HB   LYS 114          2HB       LYS 114   7.934  -4.480  11.107
  911   2HB   LYS 114          1HB       LYS 114   9.431  -3.653  10.708
  912   1HG   LYS 114          2HG       LYS 114   7.851  -2.676  13.028
  913   2HG   LYS 114          1HG       LYS 114   8.762  -4.176  13.198
  914   1HD   LYS 114          2HD       LYS 114   9.878  -1.493  12.379
  915   2HD   LYS 114          1HD       LYS 114  10.086  -2.275  13.946
  916   1HE   LYS 114          2HE       LYS 114  11.218  -3.069  11.282
  917   2HE   LYS 114          1HE       LYS 114  12.074  -2.716  12.782
  918   1HZ   LYS 114          1HZ       LYS 114  12.143  -4.964  12.844
  919   2HZ   LYS 114          2HZ       LYS 114  10.726  -5.164  11.942
  920   3HZ   LYS 114          3HZ       LYS 114  10.635  -4.766  13.584
  921    H    HIS 115           H        HIS 115   9.809  -2.045   9.166
  922    HA   HIS 115           HA       HIS 115  10.783   0.238  10.444
  923   1HB   HIS 115          2HB       HIS 115  11.410  -1.281   8.035
  924   2HB   HIS 115          1HB       HIS 115  11.801   0.430   7.906
  925    HD1  HIS 115           1HD      HIS 115  12.111  -1.135  11.252
  926    HD2  HIS 115           2HD      HIS 115  14.552  -0.258   8.006
  927    HE1  HIS 115           1HE      HIS 115  14.466  -1.400  12.092
  928    HE2  HIS 115           2HE      HIS 115  15.926  -0.771  10.137
  929    H    ALA 116           H        ALA 116   8.409  -0.135   7.926
  930    HA   ALA 116           HA       ALA 116   8.471   2.509   6.920
  931   1HB   ALA 116          1HB       ALA 116   5.958   0.895   6.949
  932   2HB   ALA 116          2HB       ALA 116   7.332   0.362   5.981
  933   3HB   ALA 116          3HB       ALA 116   6.605   1.941   5.687
  934    H    PHE 117           H        PHE 117   6.816   1.000   9.620
  935    HA   PHE 117           HA       PHE 117   5.099   3.210  10.168
  936   1HB   PHE 117          2HB       PHE 117   5.815   0.661  11.554
  937   2HB   PHE 117          1HB       PHE 117   4.981   1.920  12.461
  938    HD1  PHE 117           1HD      PHE 117   2.789   2.782  11.571
  939    HD2  PHE 117           2HD      PHE 117   4.640  -0.758  10.105
  940    HE1  PHE 117           1HE      PHE 117   0.636   2.048  10.645
  941    HE2  PHE 117           2HE      PHE 117   2.485  -1.497   9.170
  942    HZ   PHE 117           HZ       PHE 117   0.479  -0.091   9.442
  943    H    GLU 118           H        GLU 118   8.406   2.664  10.736
  944    HA   GLU 118           HA       GLU 118   8.810   3.889  13.210
  945   1HB   GLU 118          2HB       GLU 118  10.534   3.625  10.772
  946   2HB   GLU 118          1HB       GLU 118  11.094   4.495  12.192
  947   1HG   GLU 118          2HG       GLU 118  10.404   2.316  13.445
  948   2HG   GLU 118          1HG       GLU 118  10.546   1.590  11.845
  949    H    GLU 119           H        GLU 119   7.878   5.258  10.198
  950    HA   GLU 119           HA       GLU 119   8.666   7.949  11.013
  951   1HB   GLU 119          2HB       GLU 119   7.366   6.984   8.461
  952   2HB   GLU 119          1HB       GLU 119   7.920   8.624   8.769
  953   1HG   GLU 119          2HG       GLU 119  10.082   6.872   9.286
  954   2HG   GLU 119          1HG       GLU 119   9.372   6.417   7.737
  955    H    TYR 120           H        TYR 120   6.745   6.786  12.652
  956    HA   TYR 120           HA       TYR 120   4.634   8.725  12.424
  957   1HB   TYR 120          2HB       TYR 120   3.998   6.644  10.995
  958   2HB   TYR 120          1HB       TYR 120   3.713   5.871  12.551
  959    HD1  TYR 120           1HD      TYR 120   1.802   6.434  13.883
  960    HD2  TYR 120           2HD      TYR 120   2.618   8.569  10.295
  961    HE1  TYR 120           1HE      TYR 120  -0.446   7.427  13.969
  962    HE2  TYR 120           2HE      TYR 120   0.374   9.570  10.373
  963    HH   TYR 120           HH       TYR 120  -2.064   8.453  12.500
  964    H    SER 121           H        SER 121   6.768   7.932  14.284
  965    HA   SER 121           HA       SER 121   5.188   7.099  16.618
  966   1HB   SER 121          2HB       SER 121   7.518   6.835  17.668
  967   2HB   SER 121          1HB       SER 121   7.064   5.677  16.417
  968    HG   SER 121           HG       SER 121   8.911   6.297  15.596
  Start of MODEL   23
    1   1H    MET   1          1HT       MET   1   0.142   1.932  17.403
    2   2H    MET   1          2HT       MET   1  -0.328   0.310  17.099
    3   3H    MET   1          3HT       MET   1  -1.195   1.257  18.237
    4    HA   MET   1           HA       MET   1  -2.500   1.201  16.355
    5   1HB   MET   1          2HB       MET   1  -0.924   3.681  16.873
    6   2HB   MET   1          1HB       MET   1  -2.008   3.672  15.488
    7   1HG   MET   1          2HG       MET   1  -3.878   3.107  16.950
    8   2HG   MET   1          1HG       MET   1  -2.792   3.105  18.338
    9   1HE   MET   1          1HE       MET   1  -4.703   6.300  19.182
   10   2HE   MET   1          2HE       MET   1  -4.427   4.589  19.513
   11   3HE   MET   1          3HE       MET   1  -5.526   5.071  18.221
   12    H    LYS   2           H        LYS   2  -2.040  -0.212  14.717
   13    HA   LYS   2           HA       LYS   2  -0.466   0.877  12.498
   14   1HB   LYS   2          2HB       LYS   2  -0.256  -2.014  13.330
   15   2HB   LYS   2          1HB       LYS   2   0.705  -1.169  12.125
   16   1HG   LYS   2          2HG       LYS   2   0.760  -0.334  14.999
   17   2HG   LYS   2          1HG       LYS   2   1.758  -1.665  14.409
   18   1HD   LYS   2          2HD       LYS   2   2.789  -0.184  12.771
   19   2HD   LYS   2          1HD       LYS   2   1.765   1.146  13.314
   20   1HE   LYS   2          2HE       LYS   2   3.155   1.624  14.982
   21   2HE   LYS   2          1HE       LYS   2   3.148  -0.048  15.541
   22   1HZ   LYS   2          1HZ       LYS   2   5.075  -0.492  14.506
   23   2HZ   LYS   2          2HZ       LYS   2   5.302   1.184  14.571
   24   3HZ   LYS   2          3HZ       LYS   2   4.717   0.465  13.157
   25    H    ARG   3           H        ARG   3  -1.669   0.911  10.726
   26    HA   ARG   3           HA       ARG   3  -3.439  -1.317  10.115
   27   1HB   ARG   3          2HB       ARG   3  -4.535   1.482   9.963
   28   2HB   ARG   3          1HB       ARG   3  -5.409  -0.039   9.864
   29   1HG   ARG   3          2HG       ARG   3  -5.934   0.769  11.975
   30   2HG   ARG   3          1HG       ARG   3  -4.657  -0.408  12.285
   31   1HD   ARG   3          2HD       ARG   3  -3.454   1.165  13.287
   32   2HD   ARG   3          1HD       ARG   3  -3.419   2.094  11.790
   33    HE   ARG   3           HE       ARG   3  -5.148   2.523  14.081
   34   1HH1  ARG   3          1HH1      ARG   3  -4.466   3.288  10.741
   35   2HH1  ARG   3          2HH1      ARG   3  -5.375   4.760  10.766
   36   1HH2  ARG   3          1HH2      ARG   3  -6.343   4.458  14.109
   37   2HH2  ARG   3          2HH2      ARG   3  -6.440   5.425  12.674
   38    H    VAL   4           H        VAL   4  -1.864  -1.669   8.461
   39    HA   VAL   4           HA       VAL   4  -1.221   0.296   6.515
   40    HB   VAL   4           HB       VAL   4  -1.062  -2.704   6.187
   41   1HG1  VAL   4          1HG1      VAL   4   0.063  -0.366   4.721
   42   2HG1  VAL   4          2HG1      VAL   4  -0.615  -1.869   4.095
   43   3HG1  VAL   4          3HG1      VAL   4   1.000  -1.857   4.804
   44   1HG2  VAL   4          1HG2      VAL   4   0.975  -0.813   7.366
   45   2HG2  VAL   4          2HG2      VAL   4   1.240  -2.522   7.021
   46   3HG2  VAL   4          3HG2      VAL   4   0.067  -2.042   8.247
   47    H    LEU   5           H        LEU   5  -1.774   0.156   4.197
   48    HA   LEU   5           HA       LEU   5  -4.532  -0.801   3.802
   49   1HB   LEU   5          2HB       LEU   5  -4.478   1.617   3.839
   50   2HB   LEU   5          1HB       LEU   5  -3.181   1.642   2.659
   51    HG   LEU   5           HG       LEU   5  -4.759   0.590   1.014
   52   1HD1  LEU   5          1HD1      LEU   5  -7.199   1.421   2.197
   53   2HD1  LEU   5          2HD1      LEU   5  -6.380   0.349   3.332
   54   3HD1  LEU   5          3HD1      LEU   5  -6.715  -0.196   1.691
   55   1HD2  LEU   5          1HD2      LEU   5  -6.276   2.855   1.170
   56   2HD2  LEU   5          2HD2      LEU   5  -4.680   2.749   0.427
   57   3HD2  LEU   5          3HD2      LEU   5  -4.842   3.308   2.091
   58    H    VAL   6           H        VAL   6  -4.958  -2.025   2.058
   59    HA   VAL   6           HA       VAL   6  -2.733  -2.520   0.185
   60    HB   VAL   6           HB       VAL   6  -4.886  -4.511   0.890
   61   1HG1  VAL   6          1HG1      VAL   6  -3.932  -5.091  -1.175
   62   2HG1  VAL   6          2HG1      VAL   6  -3.090  -6.093   0.006
   63   3HG1  VAL   6          3HG1      VAL   6  -2.308  -4.654  -0.646
   64   1HG2  VAL   6          1HG2      VAL   6  -3.664  -5.371   2.602
   65   2HG2  VAL   6          2HG2      VAL   6  -3.157  -3.689   2.741
   66   3HG2  VAL   6          3HG2      VAL   6  -2.125  -4.854   1.913
   67    H    VAL   7           H        VAL   7  -3.149  -2.523  -1.971
   68    HA   VAL   7           HA       VAL   7  -5.933  -2.046  -2.809
   69    HB   VAL   7           HB       VAL   7  -3.509  -0.765  -4.076
   70   1HG1  VAL   7          1HG1      VAL   7  -6.469  -0.373  -4.475
   71   2HG1  VAL   7          2HG1      VAL   7  -5.315  -1.034  -5.633
   72   3HG1  VAL   7          3HG1      VAL   7  -5.222   0.664  -5.166
   73   1HG2  VAL   7          1HG2      VAL   7  -5.199   0.079  -1.811
   74   2HG2  VAL   7          2HG2      VAL   7  -4.865   1.308  -3.031
   75   3HG2  VAL   7          3HG2      VAL   7  -3.532   0.501  -2.205
   76    H    ASP   8           H        ASP   8  -6.628  -3.602  -4.111
   77    HA   ASP   8           HA       ASP   8  -5.151  -4.506  -6.360
   78   1HB   ASP   8          2HB       ASP   8  -3.925  -5.741  -4.618
   79   2HB   ASP   8          1HB       ASP   8  -5.432  -6.454  -4.058
   80    H    ASP   9           H        ASP   9  -6.331  -6.162  -7.594
   81    HA   ASP   9           HA       ASP   9  -9.195  -5.794  -7.252
   82   1HB   ASP   9          2HB       ASP   9  -8.269  -5.472  -9.479
   83   2HB   ASP   9          1HB       ASP   9  -7.609  -7.104  -9.473
   84    H    GLU  10           H        GLU  10  -8.364  -7.246  -5.192
   85    HA   GLU  10           HA       GLU  10  -9.338  -9.952  -5.811
   86   1HB   GLU  10          2HB       GLU  10  -6.764  -9.277  -4.878
   87   2HB   GLU  10          1HB       GLU  10  -7.616  -9.963  -3.501
   88   1HG   GLU  10          2HG       GLU  10  -8.271 -11.832  -5.190
   89   2HG   GLU  10          1HG       GLU  10  -6.888 -11.227  -6.101
   90    H    GLU  11           H        GLU  11 -11.052 -10.546  -4.650
   91    HA   GLU  11           HA       GLU  11 -12.081  -8.781  -2.620
   92   1HB   GLU  11          2HB       GLU  11 -13.075 -11.233  -4.015
   93   2HB   GLU  11          1HB       GLU  11 -13.850 -10.728  -2.519
   94   1HG   GLU  11          2HG       GLU  11 -13.465  -8.623  -4.541
   95   2HG   GLU  11          1HG       GLU  11 -14.605  -9.901  -4.958
   96    H    SER  12           H        SER  12 -12.521  -9.313  -0.461
   97    HA   SER  12           HA       SER  12 -12.069 -10.169   1.594
   98   1HB   SER  12          2HB       SER  12 -11.328 -12.840   0.507
   99   2HB   SER  12          1HB       SER  12 -12.388 -12.425   1.853
  100    HG   SER  12           HG       SER  12 -14.004 -12.547   0.533
  101    H    ILE  13           H        ILE  13 -10.087  -8.727   1.192
  102    HA   ILE  13           HA       ILE  13  -7.881  -8.294   1.454
  103    HB   ILE  13           HB       ILE  13  -7.917 -10.978   2.767
  104   1HG1  ILE  13          2HG1      ILE  13  -9.668  -9.439   3.617
  105   2HG1  ILE  13          1HG1      ILE  13  -8.474  -9.875   4.835
  106   1HG2  ILE  13          1HG2      ILE  13  -5.663 -10.395   2.573
  107   2HG2  ILE  13          2HG2      ILE  13  -6.102  -9.893   4.205
  108   3HG2  ILE  13          3HG2      ILE  13  -5.988  -8.696   2.915
  109   1HD1  ILE  13          1HD1      ILE  13  -7.314  -7.697   4.261
  110   2HD1  ILE  13          2HD1      ILE  13  -8.857  -7.582   5.106
  111   3HD1  ILE  13          3HD1      ILE  13  -8.778  -7.277   3.371
  112    H    THR  14           H        THR  14  -5.636  -9.121   1.033
  113    HA   THR  14           HA       THR  14  -5.624 -10.576  -1.484
  114    HB   THR  14           HB       THR  14  -3.237  -9.846  -1.589
  115    HG1  THR  14           1HG      THR  14  -3.841  -8.342   0.730
  116   1HG2  THR  14          1HG2      THR  14  -3.632  -7.646  -2.180
  117   2HG2  THR  14          2HG2      THR  14  -4.865  -7.429  -0.939
  118   3HG2  THR  14          3HG2      THR  14  -5.215  -8.400  -2.369
  119    H    SER  15           H        SER  15  -4.425 -12.451  -1.845
  120    HA   SER  15           HA       SER  15  -4.417 -14.359   0.168
  121   1HB   SER  15          2HB       SER  15  -3.247 -14.174  -2.556
  122   2HB   SER  15          1HB       SER  15  -2.626 -15.445  -1.503
  123    HG   SER  15           HG       SER  15  -4.340 -16.399  -2.382
  124    H    SER  16           H        SER  16  -3.033 -15.013   1.689
  125    HA   SER  16           HA       SER  16  -1.098 -15.310   2.874
  126   1HB   SER  16          2HB       SER  16   0.445 -13.403   1.159
  127   2HB   SER  16          1HB       SER  16   0.993 -14.862   1.985
  128    HG   SER  16           HG       SER  16   0.767 -15.060  -0.337
  129    H    LEU  17           H        LEU  17  -1.684 -11.983   1.760
  130    HA   LEU  17           HA       LEU  17  -0.414 -10.590   3.764
  131   1HB   LEU  17          2HB       LEU  17  -2.223 -10.032   1.695
  132   2HB   LEU  17          1HB       LEU  17  -2.963  -9.376   3.136
  133    HG   LEU  17           HG       LEU  17  -0.824  -8.306   1.521
  134   1HD1  LEU  17          1HD1      LEU  17  -2.432  -6.800   1.931
  135   2HD1  LEU  17          2HD1      LEU  17  -1.361  -6.391   3.271
  136   3HD1  LEU  17          3HD1      LEU  17  -2.771  -7.414   3.547
  137   1HD2  LEU  17          1HD2      LEU  17   0.528  -7.444   3.473
  138   2HD2  LEU  17          2HD2      LEU  17   0.786  -9.132   3.042
  139   3HD2  LEU  17          3HD2      LEU  17  -0.205  -8.723   4.438
  140    H    SER  18           H        SER  18  -3.826 -11.627   3.752
  141    HA   SER  18           HA       SER  18  -4.655 -10.693   6.178
  142   1HB   SER  18          2HB       SER  18  -6.168 -11.834   4.659
  143   2HB   SER  18          1HB       SER  18  -5.327 -13.362   4.919
  144    HG   SER  18           HG       SER  18  -6.525 -11.911   7.031
  145    H    ALA  19           H        ALA  19  -3.692 -14.109   5.846
  146    HA   ALA  19           HA       ALA  19  -3.432 -14.744   8.488
  147   1HB   ALA  19          1HB       ALA  19  -2.194 -15.759   6.002
  148   2HB   ALA  19          2HB       ALA  19  -3.154 -16.600   7.221
  149   3HB   ALA  19          3HB       ALA  19  -1.450 -16.255   7.523
  150    H    ILE  20           H        ILE  20  -1.018 -13.177   6.442
  151    HA   ILE  20           HA       ILE  20   1.101 -13.207   8.299
  152    HB   ILE  20           HB       ILE  20   0.513 -11.438   5.935
  153   1HG1  ILE  20          2HG1      ILE  20   2.841 -13.271   6.144
  154   2HG1  ILE  20          1HG1      ILE  20   1.246 -13.980   5.916
  155   1HG2  ILE  20          1HG2      ILE  20   2.563 -11.129   8.015
  156   2HG2  ILE  20          2HG2      ILE  20   1.891  -9.943   6.896
  157   3HG2  ILE  20          3HG2      ILE  20   3.151 -11.051   6.354
  158   1HD1  ILE  20          1HD1      ILE  20   2.975 -12.828   3.990
  159   2HD1  ILE  20          2HD1      ILE  20   1.505 -11.857   4.075
  160   3HD1  ILE  20          3HD1      ILE  20   1.402 -13.588   3.752
  161    H    LEU  21           H        LEU  21  -0.776 -10.339   7.298
  162    HA   LEU  21           HA       LEU  21   0.011  -8.614   9.271
  163   1HB   LEU  21          2HB       LEU  21  -2.794  -8.813   8.196
  164   2HB   LEU  21          1HB       LEU  21  -2.023  -7.388   8.868
  165    HG   LEU  21           HG       LEU  21  -0.527  -8.511   6.635
  166   1HD1  LEU  21          1HD1      LEU  21  -3.201  -8.792   6.273
  167   2HD1  LEU  21          2HD1      LEU  21  -2.027  -8.550   4.982
  168   3HD1  LEU  21          3HD1      LEU  21  -2.924  -7.176   5.624
  169   1HD2  LEU  21          1HD2      LEU  21  -1.136  -5.979   7.843
  170   2HD2  LEU  21          2HD2      LEU  21  -1.398  -5.905   6.101
  171   3HD2  LEU  21          3HD2      LEU  21   0.167  -6.410   6.736
  172    H    GLU  22           H        GLU  22  -2.245 -11.263   9.520
  173    HA   GLU  22           HA       GLU  22  -3.362 -10.489  12.030
  174   1HB   GLU  22          2HB       GLU  22  -3.370 -13.063  10.478
  175   2HB   GLU  22          1HB       GLU  22  -4.125 -12.918  12.060
  176   1HG   GLU  22          2HG       GLU  22  -5.480 -11.023  11.119
  177   2HG   GLU  22          1HG       GLU  22  -4.854 -11.470   9.532
  178    H    GLU  23           H        GLU  23  -0.485 -12.144  11.047
  179    HA   GLU  23           HA       GLU  23  -0.033 -13.395  13.602
  180   1HB   GLU  23          2HB       GLU  23   0.848 -14.565  11.739
  181   2HB   GLU  23          1HB       GLU  23   1.587 -13.114  11.077
  182   1HG   GLU  23          2HG       GLU  23   3.460 -13.438  12.208
  183   2HG   GLU  23          1HG       GLU  23   2.591 -13.715  13.716
  184    H    GLU  24           H        GLU  24   1.032 -10.526  11.865
  185    HA   GLU  24           HA       GLU  24   2.941  -9.778  13.873
  186   1HB   GLU  24          2HB       GLU  24   2.609  -9.118  11.248
  187   2HB   GLU  24          1HB       GLU  24   2.020  -7.674  12.059
  188   1HG   GLU  24          2HG       GLU  24   4.729  -8.943  12.367
  189   2HG   GLU  24          1HG       GLU  24   4.352  -7.420  11.562
  190    H    GLY  25           H        GLY  25  -0.423  -9.233  13.282
  191   1HA   GLY  25          2HA       GLY  25  -1.957  -8.437  14.863
  192   2HA   GLY  25          1HA       GLY  25  -0.619  -7.783  15.796
  193    H    TYR  26           H        TYR  26  -1.787  -7.321  12.464
  194    HA   TYR  26           HA       TYR  26  -1.687  -4.414  12.934
  195   1HB   TYR  26          2HB       TYR  26  -1.277  -6.056  10.442
  196   2HB   TYR  26          1HB       TYR  26  -1.612  -4.336  10.368
  197    HD1  TYR  26           1HD      TYR  26   0.814  -5.659   9.239
  198    HD2  TYR  26           2HD      TYR  26   0.110  -3.934  13.064
  199    HE1  TYR  26           1HE      TYR  26   3.214  -5.184   9.458
  200    HE2  TYR  26           2HE      TYR  26   2.506  -3.452  13.292
  201    HH   TYR  26           HH       TYR  26   4.501  -3.080  11.410
  202    H    HIS  27           H        HIS  27  -3.098  -3.346  11.073
  203    HA   HIS  27           HA       HIS  27  -5.735  -4.629  10.987
  204   1HB   HIS  27          2HB       HIS  27  -5.091  -2.340  12.521
  205   2HB   HIS  27          1HB       HIS  27  -5.991  -1.753  11.127
  206    HD1  HIS  27           1HD      HIS  27  -8.462  -2.557  10.891
  207    HD2  HIS  27           2HD      HIS  27  -6.569  -3.786  14.380
  208    HE1  HIS  27           1HE      HIS  27 -10.299  -3.378  12.399
  209    HE2  HIS  27           2HE      HIS  27  -9.119  -4.206  14.465
  210    HA   PRO  28           HA       PRO  28  -4.349  -3.195   6.860
  211   1HB   PRO  28          2HB       PRO  28  -4.578  -5.517   5.557
  212   2HB   PRO  28          1HB       PRO  28  -3.194  -5.172   6.601
  213   1HG   PRO  28          2HG       PRO  28  -5.609  -6.843   7.144
  214   2HG   PRO  28          1HG       PRO  28  -3.921  -7.133   7.594
  215   1HD   PRO  28          2HD       PRO  28  -5.863  -6.088   9.273
  216   2HD   PRO  28          1HD       PRO  28  -4.115  -5.917   9.512
  217    H    ASP  29           H        ASP  29  -5.591  -2.406   5.296
  218    HA   ASP  29           HA       ASP  29  -8.348  -3.403   5.032
  219   1HB   ASP  29          2HB       ASP  29  -8.233  -1.153   6.105
  220   2HB   ASP  29          1HB       ASP  29  -7.427  -0.547   4.664
  221    H    THR  30           H        THR  30  -8.645  -4.320   3.098
  222    HA   THR  30           HA       THR  30  -6.860  -3.534   0.913
  223    HB   THR  30           HB       THR  30  -7.476  -5.658  -0.137
  224    HG1  THR  30           1HG      THR  30  -9.351  -6.401   0.425
  225   1HG2  THR  30          1HG2      THR  30  -5.923  -6.711   1.024
  226   2HG2  THR  30          2HG2      THR  30  -6.998  -6.859   2.414
  227   3HG2  THR  30          3HG2      THR  30  -5.999  -5.420   2.224
  228    H    ALA  31           H        ALA  31  -7.565  -2.434  -0.772
  229    HA   ALA  31           HA       ALA  31 -10.443  -1.959  -1.039
  230   1HB   ALA  31          1HB       ALA  31  -9.957   0.065  -2.022
  231   2HB   ALA  31          2HB       ALA  31  -8.396  -0.484  -2.634
  232   3HB   ALA  31          3HB       ALA  31  -8.591  -0.113  -0.921
  233    H    LYS  32           H        LYS  32 -10.529  -1.202  -3.716
  234    HA   LYS  32           HA       LYS  32  -9.798  -3.679  -5.123
  235   1HB   LYS  32          2HB       LYS  32 -12.228  -2.381  -6.121
  236   2HB   LYS  32          1HB       LYS  32 -11.899  -4.082  -5.821
  237   1HG   LYS  32          2HG       LYS  32 -12.588  -3.956  -3.612
  238   2HG   LYS  32          1HG       LYS  32 -12.383  -2.207  -3.548
  239   1HD   LYS  32          2HD       LYS  32 -14.395  -1.796  -4.548
  240   2HD   LYS  32          1HD       LYS  32 -14.355  -3.292  -5.483
  241   1HE   LYS  32          2HE       LYS  32 -16.092  -3.494  -3.860
  242   2HE   LYS  32          1HE       LYS  32 -14.764  -4.540  -3.359
  243   1HZ   LYS  32          1HZ       LYS  32 -15.855  -3.086  -1.598
  244   2HZ   LYS  32          2HZ       LYS  32 -15.036  -1.789  -2.313
  245   3HZ   LYS  32          3HZ       LYS  32 -14.165  -3.084  -1.661
  246    H    THR  33           H        THR  33  -9.448  -0.377  -5.021
  247    HA   THR  33           HA       THR  33  -8.092  -0.264  -7.493
  248    HB   THR  33           HB       THR  33  -9.870   1.743  -8.113
  249    HG1  THR  33           1HG      THR  33 -11.922   0.720  -8.006
  250   1HG2  THR  33          1HG2      THR  33  -8.860  -0.121  -9.562
  251   2HG2  THR  33          2HG2      THR  33 -10.437   0.535 -10.000
  252   3HG2  THR  33          3HG2      THR  33 -10.328  -1.013  -9.165
  253    H    LEU  34           H        LEU  34  -7.868   2.322  -8.031
  254    HA   LEU  34           HA       LEU  34  -6.605   3.363  -5.668
  255   1HB   LEU  34          2HB       LEU  34  -6.976   4.628  -8.387
  256   2HB   LEU  34          1HB       LEU  34  -5.931   5.234  -7.116
  257    HG   LEU  34           HG       LEU  34  -5.548   2.495  -8.298
  258   1HD1  LEU  34          1HD1      LEU  34  -4.039   4.922  -9.204
  259   2HD1  LEU  34          2HD1      LEU  34  -5.508   4.385 -10.021
  260   3HD1  LEU  34          3HD1      LEU  34  -4.106   3.319  -9.937
  261   1HD2  LEU  34          1HD2      LEU  34  -4.461   3.608  -6.093
  262   2HD2  LEU  34          2HD2      LEU  34  -3.302   4.125  -7.317
  263   3HD2  LEU  34          3HD2      LEU  34  -3.645   2.411  -7.096
  264    H    ARG  35           H        ARG  35  -9.562   3.926  -7.431
  265    HA   ARG  35           HA       ARG  35 -10.233   6.389  -6.167
  266   1HB   ARG  35          2HB       ARG  35 -11.251   4.964  -8.278
  267   2HB   ARG  35          1HB       ARG  35 -12.471   4.690  -7.042
  268   1HG   ARG  35          2HG       ARG  35 -12.156   7.344  -6.788
  269   2HG   ARG  35          1HG       ARG  35 -11.761   7.150  -8.497
  270   1HD   ARG  35          2HD       ARG  35 -13.871   6.125  -8.942
  271   2HD   ARG  35          1HD       ARG  35 -14.245   6.019  -7.222
  272    HE   ARG  35           HE       ARG  35 -13.822   8.712  -7.952
  273   1HH1  ARG  35          1HH1      ARG  35 -16.148   6.134  -8.309
  274   2HH1  ARG  35          2HH1      ARG  35 -17.498   7.207  -8.468
  275   1HH2  ARG  35          1HH2      ARG  35 -15.597  10.123  -8.160
  276   2HH2  ARG  35          2HH2      ARG  35 -17.186   9.471  -8.383
  277    H    GLU  36           H        GLU  36 -11.087   2.998  -5.599
  278    HA   GLU  36           HA       GLU  36 -12.791   3.432  -3.403
  279   1HB   GLU  36          2HB       GLU  36 -11.400   1.127  -4.613
  280   2HB   GLU  36          1HB       GLU  36 -11.746   0.961  -2.898
  281   1HG   GLU  36          2HG       GLU  36 -13.517   0.005  -4.253
  282   2HG   GLU  36          1HG       GLU  36 -14.104   1.377  -3.315
  283    H    ALA  37           H        ALA  37  -9.301   3.080  -3.692
  284    HA   ALA  37           HA       ALA  37  -8.792   2.869  -0.896
  285   1HB   ALA  37          1HB       ALA  37  -6.688   4.042  -2.598
  286   2HB   ALA  37          2HB       ALA  37  -7.286   2.461  -3.103
  287   3HB   ALA  37          3HB       ALA  37  -6.619   2.676  -1.485
  288    H    GLU  38           H        GLU  38  -8.639   5.580  -3.204
  289    HA   GLU  38           HA       GLU  38  -7.735   7.589  -1.590
  290   1HB   GLU  38          2HB       GLU  38  -9.775   7.590  -3.785
  291   2HB   GLU  38          1HB       GLU  38  -9.377   9.074  -2.931
  292   1HG   GLU  38          2HG       GLU  38  -7.066   8.884  -3.604
  293   2HG   GLU  38          1HG       GLU  38  -7.395   7.336  -4.381
  294    H    LYS  39           H        LYS  39 -11.091   6.474  -1.888
  295    HA   LYS  39           HA       LYS  39 -12.229   8.255  -0.049
  296   1HB   LYS  39          2HB       LYS  39 -13.589   6.857  -1.522
  297   2HB   LYS  39          1HB       LYS  39 -13.025   5.409  -0.700
  298   1HG   LYS  39          2HG       LYS  39 -14.268   7.416   1.044
  299   2HG   LYS  39          1HG       LYS  39 -15.343   6.686  -0.150
  300   1HD   LYS  39          2HD       LYS  39 -13.954   4.523   0.832
  301   2HD   LYS  39          1HD       LYS  39 -14.159   5.539   2.260
  302   1HE   LYS  39          2HE       LYS  39 -16.084   4.264   2.297
  303   2HE   LYS  39          1HE       LYS  39 -16.622   5.717   1.456
  304   1HZ   LYS  39          1HZ       LYS  39 -16.064   3.042   0.352
  305   2HZ   LYS  39          2HZ       LYS  39 -15.995   4.405  -0.646
  306   3HZ   LYS  39          3HZ       LYS  39 -17.435   4.012   0.149
  307    H    LYS  40           H        LYS  40 -11.047   4.936   0.432
  308    HA   LYS  40           HA       LYS  40 -11.410   4.882   3.222
  309   1HB   LYS  40          2HB       LYS  40  -9.381   3.327   1.611
  310   2HB   LYS  40          1HB       LYS  40 -10.027   2.896   3.189
  311   1HG   LYS  40          2HG       LYS  40 -12.248   3.207   1.511
  312   2HG   LYS  40          1HG       LYS  40 -11.051   2.306   0.579
  313   1HD   LYS  40          2HD       LYS  40 -11.041   0.532   2.054
  314   2HD   LYS  40          1HD       LYS  40 -11.597   1.520   3.407
  315   1HE   LYS  40          2HE       LYS  40 -13.817   1.555   2.592
  316   2HE   LYS  40          1HE       LYS  40 -13.328   0.916   1.023
  317   1HZ   LYS  40          1HZ       LYS  40 -14.324  -0.838   2.244
  318   2HZ   LYS  40          2HZ       LYS  40 -13.380  -0.528   3.612
  319   3HZ   LYS  40          3HZ       LYS  40 -12.660  -1.149   2.213
  320    H    ILE  41           H        ILE  41  -8.945   6.305   1.253
  321    HA   ILE  41           HA       ILE  41  -7.094   6.547   3.500
  322    HB   ILE  41           HB       ILE  41  -6.806   7.523   0.665
  323   1HG1  ILE  41          2HG1      ILE  41  -5.276   5.230   1.831
  324   2HG1  ILE  41          1HG1      ILE  41  -6.919   4.960   1.262
  325   1HG2  ILE  41          1HG2      ILE  41  -4.974   7.547   3.031
  326   2HG2  ILE  41          2HG2      ILE  41  -5.345   8.844   1.895
  327   3HG2  ILE  41          3HG2      ILE  41  -4.325   7.495   1.392
  328   1HD1  ILE  41          1HD1      ILE  41  -5.858   4.495  -0.662
  329   2HD1  ILE  41          2HD1      ILE  41  -4.447   5.467  -0.245
  330   3HD1  ILE  41          3HD1      ILE  41  -5.905   6.246  -0.861
  331    H    LYS  42           H        LYS  42  -9.592   8.356   2.024
  332    HA   LYS  42           HA       LYS  42  -8.554  10.870   3.104
  333   1HB   LYS  42          2HB       LYS  42  -9.901  10.278   0.744
  334   2HB   LYS  42          1HB       LYS  42 -11.091  11.093   1.746
  335   1HG   LYS  42          2HG       LYS  42  -8.445  12.358   1.679
  336   2HG   LYS  42          1HG       LYS  42  -9.316  12.347   0.144
  337   1HD   LYS  42          2HD       LYS  42 -11.083  13.599   0.998
  338   2HD   LYS  42          1HD       LYS  42 -10.684  13.199   2.670
  339   1HE   LYS  42          2HE       LYS  42  -8.829  14.812   0.947
  340   2HE   LYS  42          1HE       LYS  42 -10.152  15.565   1.837
  341   1HZ   LYS  42          1HZ       LYS  42  -7.657  14.461   2.815
  342   2HZ   LYS  42          2HZ       LYS  42  -9.017  14.095   3.751
  343   3HZ   LYS  42          3HZ       LYS  42  -8.611  15.708   3.444
  344    H    GLU  43           H        GLU  43  -9.758   8.564   4.635
  345    HA   GLU  43           HA       GLU  43 -11.602  10.204   6.189
  346   1HB   GLU  43          2HB       GLU  43 -12.280   7.616   4.886
  347   2HB   GLU  43          1HB       GLU  43 -13.000   8.004   6.441
  348   1HG   GLU  43          2HG       GLU  43 -13.768  10.169   5.412
  349   2HG   GLU  43          1HG       GLU  43 -13.263   9.511   3.857
  350    H    LEU  44           H        LEU  44 -10.058   6.968   6.080
  351    HA   LEU  44           HA       LEU  44  -9.723   7.140   8.987
  352   1HB   LEU  44          2HB       LEU  44  -8.831   4.684   7.618
  353   2HB   LEU  44          1HB       LEU  44  -9.710   4.872   9.119
  354    HG   LEU  44           HG       LEU  44 -11.407   3.948   7.982
  355   1HD1  LEU  44          1HD1      LEU  44 -11.834   6.340   6.310
  356   2HD1  LEU  44          2HD1      LEU  44 -11.776   6.585   8.057
  357   3HD1  LEU  44          3HD1      LEU  44 -12.951   5.475   7.359
  358   1HD2  LEU  44          1HD2      LEU  44 -11.133   3.195   5.909
  359   2HD2  LEU  44          2HD2      LEU  44  -9.571   4.012   5.918
  360   3HD2  LEU  44          3HD2      LEU  44 -10.987   4.825   5.252
  361    H    PHE  45           H        PHE  45  -8.245   8.348   6.659
  362    HA   PHE  45           HA       PHE  45  -6.036   8.509   5.850
  363   1HB   PHE  45          2HB       PHE  45  -6.220  10.399   7.169
  364   2HB   PHE  45          1HB       PHE  45  -6.349   9.476   8.656
  365    HD1  PHE  45           1HD      PHE  45  -3.948  10.449   5.995
  366    HD2  PHE  45           2HD      PHE  45  -4.484   9.185  10.023
  367    HE1  PHE  45           1HE      PHE  45  -1.561  10.853   6.436
  368    HE2  PHE  45           2HE      PHE  45  -2.099   9.586  10.471
  369    HZ   PHE  45           HZ       PHE  45  -0.633  10.423   8.676
  370    H    PHE  46           H        PHE  46  -5.362   6.372   5.426
  371    HA   PHE  46           HA       PHE  46  -4.311   4.646   7.408
  372   1HB   PHE  46          2HB       PHE  46  -4.048   4.707   4.407
  373   2HB   PHE  46          1HB       PHE  46  -3.288   3.464   5.393
  374    HD1  PHE  46           1HD      PHE  46  -6.038   4.163   3.448
  375    HD2  PHE  46           2HD      PHE  46  -5.012   2.400   7.182
  376    HE1  PHE  46           1HE      PHE  46  -8.124   2.864   3.402
  377    HE2  PHE  46           2HE      PHE  46  -7.102   1.097   7.143
  378    HZ   PHE  46           HZ       PHE  46  -8.660   1.330   5.253
  379    HA   PRO  47           HA       PRO  47  -0.204   6.280   7.727
  380   1HB   PRO  47          2HB       PRO  47   0.892   3.970   8.881
  381   2HB   PRO  47          1HB       PRO  47   0.131   5.307   9.739
  382   1HG   PRO  47          2HG       PRO  47  -0.825   2.652   9.499
  383   2HG   PRO  47          1HG       PRO  47  -1.658   4.031  10.229
  384   1HD   PRO  47          2HD       PRO  47  -2.019   2.801   7.569
  385   2HD   PRO  47          1HD       PRO  47  -3.155   3.757   8.540
  386    H    VAL  48           H        VAL  48  -0.358   2.875   6.675
  387    HA   VAL  48           HA       VAL  48   1.843   3.433   4.800
  388    HB   VAL  48           HB       VAL  48   1.095   0.744   5.951
  389   1HG1  VAL  48          1HG1      VAL  48   2.529   1.315   3.695
  390   2HG1  VAL  48          2HG1      VAL  48   2.668  -0.164   4.645
  391   3HG1  VAL  48          3HG1      VAL  48   3.793   1.167   4.915
  392   1HG2  VAL  48          1HG2      VAL  48   1.880   2.030   7.776
  393   2HG2  VAL  48          2HG2      VAL  48   3.185   2.727   6.815
  394   3HG2  VAL  48          3HG2      VAL  48   3.229   1.019   7.257
  395    H    ILE  49           H        ILE  49   1.387   3.266   2.697
  396    HA   ILE  49           HA       ILE  49  -1.095   1.871   1.924
  397    HB   ILE  49           HB       ILE  49   0.312   3.986   0.298
  398   1HG1  ILE  49          2HG1      ILE  49  -0.393   4.932   2.465
  399   2HG1  ILE  49          1HG1      ILE  49  -1.337   5.586   1.130
  400   1HG2  ILE  49          1HG2      ILE  49  -2.589   3.396   0.100
  401   2HG2  ILE  49          2HG2      ILE  49  -1.460   2.222  -0.574
  402   3HG2  ILE  49          3HG2      ILE  49  -1.444   3.890  -1.148
  403   1HD1  ILE  49          1HD1      ILE  49  -2.178   4.006   3.434
  404   2HD1  ILE  49          2HD1      ILE  49  -2.859   3.466   1.899
  405   3HD1  ILE  49          3HD1      ILE  49  -3.090   5.132   2.429
  406    H    VAL  50           H        VAL  50  -0.909   0.095   0.716
  407    HA   VAL  50           HA       VAL  50   1.569  -0.286  -0.833
  408    HB   VAL  50           HB       VAL  50   0.097  -2.441   0.685
  409   1HG1  VAL  50          1HG1      VAL  50   2.703  -2.587  -0.827
  410   2HG1  VAL  50          2HG1      VAL  50   1.159  -3.196  -1.420
  411   3HG1  VAL  50          3HG1      VAL  50   1.895  -3.907   0.016
  412   1HG2  VAL  50          1HG2      VAL  50   1.776  -2.395   2.290
  413   2HG2  VAL  50          2HG2      VAL  50   1.488  -0.685   1.965
  414   3HG2  VAL  50          3HG2      VAL  50   2.881  -1.496   1.249
  415    H    LEU  51           H        LEU  51   0.975  -0.069  -2.869
  416    HA   LEU  51           HA       LEU  51  -1.593  -0.924  -3.857
  417   1HB   LEU  51          2HB       LEU  51  -0.413   1.084  -4.720
  418   2HB   LEU  51          1HB       LEU  51   0.831   0.041  -5.379
  419    HG   LEU  51           HG       LEU  51  -0.839  -0.996  -6.869
  420   1HD1  LEU  51          1HD1      LEU  51  -2.927  -0.853  -5.972
  421   2HD1  LEU  51          2HD1      LEU  51  -2.985   0.546  -7.044
  422   3HD1  LEU  51          3HD1      LEU  51  -2.660   0.765  -5.325
  423   1HD2  LEU  51          1HD2      LEU  51  -0.296   1.936  -6.929
  424   2HD2  LEU  51          2HD2      LEU  51  -1.345   1.221  -8.153
  425   3HD2  LEU  51          3HD2      LEU  51   0.317   0.655  -7.975
  426    H    ASP  52           H        ASP  52  -1.715  -2.361  -5.824
  427    HA   ASP  52           HA       ASP  52   0.273  -4.526  -5.680
  428   1HB   ASP  52          2HB       ASP  52  -1.883  -5.080  -4.510
  429   2HB   ASP  52          1HB       ASP  52  -2.689  -4.953  -6.072
  430    H    VAL  53           H        VAL  53  -2.479  -3.400  -7.668
  431    HA   VAL  53           HA       VAL  53  -2.687  -3.114  -9.926
  432    HB   VAL  53           HB       VAL  53   0.299  -3.521 -10.130
  433   1HG1  VAL  53          1HG1      VAL  53  -1.175  -3.524 -12.202
  434   2HG1  VAL  53          2HG1      VAL  53   0.180  -2.396 -12.184
  435   3HG1  VAL  53          3HG1      VAL  53  -1.455  -1.814 -11.868
  436   1HG2  VAL  53          1HG2      VAL  53   0.030  -1.810  -8.506
  437   2HG2  VAL  53          2HG2      VAL  53  -1.252  -1.036  -9.437
  438   3HG2  VAL  53          3HG2      VAL  53   0.409  -1.009 -10.031
  439    H    TRP  54           H        TRP  54  -3.651  -5.385  -9.454
  440    HA   TRP  54           HA       TRP  54  -2.095  -7.504 -10.739
  441   1HB   TRP  54          2HB       TRP  54  -3.112  -8.066  -8.601
  442   2HB   TRP  54          1HB       TRP  54  -4.701  -7.615  -9.207
  443    HD1  TRP  54           HD       TRP  54  -6.043  -9.775  -9.471
  444    HE1  TRP  54           1HE      TRP  54  -5.615 -12.102 -10.484
  445    HE3  TRP  54           3HE      TRP  54  -1.110  -9.231 -10.704
  446    HZ2  TRP  54           2HZ      TRP  54  -3.470 -13.519 -11.652
  447    HZ3  TRP  54           3HZ      TRP  54   0.055 -11.119 -11.765
  448    HH2  TRP  54           HH       TRP  54  -1.101 -13.219 -12.228
  449    H    MET  55           H        MET  55  -5.611  -7.110 -10.796
  450    HA   MET  55           HA       MET  55  -5.645  -7.774 -13.602
  451   1HB   MET  55          2HB       MET  55  -7.981  -7.082 -11.823
  452   2HB   MET  55          1HB       MET  55  -8.032  -7.928 -13.364
  453   1HG   MET  55          2HG       MET  55  -6.364  -9.530 -11.973
  454   2HG   MET  55          1HG       MET  55  -7.389  -8.919 -10.677
  455   1HE   MET  55          1HE       MET  55  -7.632 -12.225 -11.266
  456   2HE   MET  55          2HE       MET  55  -9.327 -12.060 -10.807
  457   3HE   MET  55          3HE       MET  55  -8.099 -11.066 -10.023
  458    HA   PRO  56           HA       PRO  56  -7.329  -3.299 -13.855
  459   1HB   PRO  56          2HB       PRO  56  -6.722  -1.546 -11.936
  460   2HB   PRO  56          1HB       PRO  56  -8.067  -2.679 -11.751
  461   1HG   PRO  56          2HG       PRO  56  -5.311  -2.802 -10.604
  462   2HG   PRO  56          1HG       PRO  56  -6.859  -3.207  -9.844
  463   1HD   PRO  56          2HD       PRO  56  -5.103  -5.043 -10.930
  464   2HD   PRO  56          1HD       PRO  56  -6.833  -5.332 -10.676
  465    H    ASP  57           H        ASP  57  -6.256  -0.960 -13.915
  466    HA   ASP  57           HA       ASP  57  -3.429  -0.800 -13.947
  467   1HB   ASP  57          2HB       ASP  57  -3.708  -2.264 -15.911
  468   2HB   ASP  57          1HB       ASP  57  -4.767  -1.066 -16.648
  469    H    GLY  58           H        GLY  58  -4.939   0.889 -12.713
  470   1HA   GLY  58          2HA       GLY  58  -5.785   3.080 -14.420
  471   2HA   GLY  58          1HA       GLY  58  -5.934   3.000 -12.672
  472    H    ASP  59           H        ASP  59  -2.817   2.202 -13.769
  473    HA   ASP  59           HA       ASP  59  -0.804   3.237 -13.566
  474   1HB   ASP  59          2HB       ASP  59  -2.571   5.300 -14.777
  475   2HB   ASP  59          1HB       ASP  59  -1.017   5.844 -14.151
  476    H    GLY  60           H        GLY  60  -0.506   2.991 -11.364
  477   1HA   GLY  60          2HA       GLY  60  -1.678   4.697  -9.417
  478   2HA   GLY  60          1HA       GLY  60  -0.325   3.608  -9.156
  479    H    VAL  61           H        VAL  61   0.787   5.306 -11.635
  480    HA   VAL  61           HA       VAL  61   2.693   6.744 -10.278
  481    HB   VAL  61           HB       VAL  61   1.552   7.576 -12.943
  482   1HG1  VAL  61          1HG1      VAL  61   4.168   7.977 -11.542
  483   2HG1  VAL  61          2HG1      VAL  61   3.097   9.179 -12.263
  484   3HG1  VAL  61          3HG1      VAL  61   4.034   8.100 -13.298
  485   1HG2  VAL  61          1HG2      VAL  61   3.394   5.308 -12.242
  486   2HG2  VAL  61          2HG2      VAL  61   3.392   6.049 -13.842
  487   3HG2  VAL  61          3HG2      VAL  61   1.932   5.277 -13.227
  488    H    ASN  62           H        ASN  62  -0.377   7.971 -11.613
  489    HA   ASN  62           HA       ASN  62  -0.007  10.587 -10.576
  490   1HB   ASN  62          2HB       ASN  62  -2.318  10.876 -11.400
  491   2HB   ASN  62          1HB       ASN  62  -1.243  10.214 -12.614
  492   1HD2  ASN  62          1HD2      ASN  62  -3.886   9.552 -10.445
  493   2HD2  ASN  62          2HD2      ASN  62  -4.390   8.078 -11.193
  494    H    PHE  63           H        PHE  63  -0.787   7.730  -9.049
  495    HA   PHE  63           HA       PHE  63  -2.776   8.846  -7.256
  496   1HB   PHE  63          2HB       PHE  63  -2.957   6.497  -8.001
  497   2HB   PHE  63          1HB       PHE  63  -1.432   6.138  -7.197
  498    HD1  PHE  63           1HD      PHE  63  -4.193   8.279  -5.967
  499    HD2  PHE  63           2HD      PHE  63  -2.082   4.608  -5.553
  500    HE1  PHE  63           1HE      PHE  63  -5.404   7.824  -3.877
  501    HE2  PHE  63           2HE      PHE  63  -3.293   4.144  -3.462
  502    HZ   PHE  63           HZ       PHE  63  -4.958   5.755  -2.624
  503    H    ILE  64           H        ILE  64   0.597   7.764  -7.122
  504    HA   ILE  64           HA       ILE  64   1.169   7.862  -4.468
  505    HB   ILE  64           HB       ILE  64   2.915   9.040  -6.632
  506   1HG1  ILE  64          2HG1      ILE  64   3.809   6.479  -5.889
  507   2HG1  ILE  64          1HG1      ILE  64   2.064   6.332  -6.082
  508   1HG2  ILE  64          1HG2      ILE  64   4.737   8.241  -5.018
  509   2HG2  ILE  64          2HG2      ILE  64   3.457   8.195  -3.804
  510   3HG2  ILE  64          3HG2      ILE  64   3.861   9.715  -4.603
  511   1HD1  ILE  64          1HD1      ILE  64   3.987   7.403  -8.131
  512   2HD1  ILE  64          2HD1      ILE  64   2.241   7.267  -8.327
  513   3HD1  ILE  64          3HD1      ILE  64   3.221   5.814  -8.145
  514    H    ASP  65           H        ASP  65   0.465  10.577  -6.545
  515    HA   ASP  65           HA       ASP  65   1.422  12.612  -4.822
  516   1HB   ASP  65          2HB       ASP  65   0.761  12.757  -7.328
  517   2HB   ASP  65          1HB       ASP  65  -0.876  12.997  -6.725
  518    H    PHE  66           H        PHE  66  -1.903  11.407  -5.407
  519    HA   PHE  66           HA       PHE  66  -3.265  12.924  -3.580
  520   1HB   PHE  66          2HB       PHE  66  -4.492  11.470  -5.015
  521   2HB   PHE  66          1HB       PHE  66  -3.646  10.048  -4.418
  522    HD1  PHE  66           1HD      PHE  66  -4.093   9.264  -2.075
  523    HD2  PHE  66           2HD      PHE  66  -6.461  12.234  -3.994
  524    HE1  PHE  66           1HE      PHE  66  -5.892   8.881  -0.442
  525    HE2  PHE  66           2HE      PHE  66  -8.264  11.857  -2.364
  526    HZ   PHE  66           HZ       PHE  66  -7.981  10.179  -0.584
  527    H    ILE  67           H        ILE  67  -1.367  10.001  -2.999
  528    HA   ILE  67           HA       ILE  67  -2.042   9.630  -0.302
  529    HB   ILE  67           HB       ILE  67   0.461   8.902  -1.825
  530   1HG1  ILE  67          2HG1      ILE  67  -0.604   6.569  -1.334
  531   2HG1  ILE  67          1HG1      ILE  67  -2.075   7.495  -1.054
  532   1HG2  ILE  67          1HG2      ILE  67   1.407   8.779   0.226
  533   2HG2  ILE  67          2HG2      ILE  67   0.543   7.242   0.282
  534   3HG2  ILE  67          3HG2      ILE  67  -0.146   8.671   1.056
  535   1HD1  ILE  67          1HD1      ILE  67  -0.554   7.951  -3.564
  536   2HD1  ILE  67          2HD1      ILE  67  -2.285   8.078  -3.251
  537   3HD1  ILE  67          3HD1      ILE  67  -1.530   6.492  -3.404
  538    H    LYS  68           H        LYS  68   0.663  11.437  -1.776
  539    HA   LYS  68           HA       LYS  68   1.574  12.374   0.784
  540   1HB   LYS  68          2HB       LYS  68   2.303  13.356  -1.984
  541   2HB   LYS  68          1HB       LYS  68   3.171  13.711  -0.496
  542   1HG   LYS  68          2HG       LYS  68   2.798  10.857  -1.157
  543   2HG   LYS  68          1HG       LYS  68   3.892  11.779  -2.190
  544   1HD   LYS  68          2HD       LYS  68   5.459  11.930  -0.592
  545   2HD   LYS  68          1HD       LYS  68   4.271  12.277   0.666
  546   1HE   LYS  68          2HE       LYS  68   4.969  10.238   1.393
  547   2HE   LYS  68          1HE       LYS  68   3.694   9.715   0.293
  548   1HZ   LYS  68          1HZ       LYS  68   6.614   9.621  -0.076
  549   2HZ   LYS  68          2HZ       LYS  68   5.596   9.673  -1.428
  550   3HZ   LYS  68          3HZ       LYS  68   5.467   8.402  -0.319
  551    H    GLU  69           H        GLU  69  -0.803  13.369  -1.469
  552    HA   GLU  69           HA       GLU  69  -0.819  16.149  -0.940
  553   1HB   GLU  69          2HB       GLU  69  -1.923  14.927  -2.878
  554   2HB   GLU  69          1HB       GLU  69  -3.204  14.506  -1.751
  555   1HG   GLU  69          2HG       GLU  69  -3.233  17.095  -1.318
  556   2HG   GLU  69          1HG       GLU  69  -2.495  17.144  -2.919
  557    H    ASN  70           H        ASN  70  -2.790  13.473   0.313
  558    HA   ASN  70           HA       ASN  70  -3.555  15.202   2.572
  559   1HB   ASN  70          2HB       ASN  70  -5.098  12.756   1.750
  560   2HB   ASN  70          1HB       ASN  70  -5.646  14.143   2.687
  561   1HD2  ASN  70          1HD2      ASN  70  -4.523  13.202  -0.529
  562   2HD2  ASN  70          2HD2      ASN  70  -5.476  14.354  -1.394
  563    H    SER  71           H        SER  71  -1.232  13.224   2.083
  564    HA   SER  71           HA       SER  71  -1.215  12.177   4.752
  565   1HB   SER  71          2HB       SER  71  -2.049  10.474   2.547
  566   2HB   SER  71          1HB       SER  71  -0.617   9.838   3.354
  567    HG   SER  71           HG       SER  71  -2.179   9.062   4.599
  568    HA   PRO  72           HA       PRO  72   2.893  13.139   2.771
  569   1HB   PRO  72          2HB       PRO  72   3.298  14.989   4.976
  570   2HB   PRO  72          1HB       PRO  72   3.298  15.317   3.243
  571   1HG   PRO  72          2HG       PRO  72   1.348  16.193   4.924
  572   2HG   PRO  72          1HG       PRO  72   1.067  15.839   3.210
  573   1HD   PRO  72          2HD       PRO  72   0.436  14.180   5.620
  574   2HD   PRO  72          1HD       PRO  72  -0.520  14.437   4.145
  575    H    ASP  73           H        ASP  73   1.753  12.221   5.845
  576    HA   ASP  73           HA       ASP  73   4.410  11.405   6.752
  577   1HB   ASP  73          2HB       ASP  73   2.020  12.300   8.070
  578   2HB   ASP  73          1HB       ASP  73   2.525  10.741   8.709
  579    H    SER  74           H        SER  74   1.945  10.122   4.978
  580    HA   SER  74           HA       SER  74   1.902   7.485   6.143
  581   1HB   SER  74          2HB       SER  74  -0.100   8.364   5.035
  582   2HB   SER  74          1HB       SER  74   0.791   8.501   3.519
  583    HG   SER  74           HG       SER  74   0.734   6.373   3.266
  584    H    VAL  75           H        VAL  75   2.185   5.620   4.414
  585    HA   VAL  75           HA       VAL  75   4.812   6.039   3.149
  586    HB   VAL  75           HB       VAL  75   3.696   3.442   4.230
  587   1HG1  VAL  75          1HG1      VAL  75   6.309   4.176   2.931
  588   2HG1  VAL  75          2HG1      VAL  75   5.169   2.912   2.468
  589   3HG1  VAL  75          3HG1      VAL  75   6.125   2.740   3.939
  590   1HG2  VAL  75          1HG2      VAL  75   4.570   5.486   5.756
  591   2HG2  VAL  75          2HG2      VAL  75   6.094   4.657   5.437
  592   3HG2  VAL  75          3HG2      VAL  75   4.759   3.786   6.190
  593    H    VAL  76           H        VAL  76   5.246   4.741   1.242
  594    HA   VAL  76           HA       VAL  76   2.889   3.780  -0.201
  595    HB   VAL  76           HB       VAL  76   4.727   5.507  -1.776
  596   1HG1  VAL  76          1HG1      VAL  76   2.508   4.086  -2.379
  597   2HG1  VAL  76          2HG1      VAL  76   3.061   5.494  -3.287
  598   3HG1  VAL  76          3HG1      VAL  76   1.806   5.674  -2.060
  599   1HG2  VAL  76          1HG2      VAL  76   2.522   6.646  -0.061
  600   2HG2  VAL  76          2HG2      VAL  76   3.508   7.530  -1.226
  601   3HG2  VAL  76          3HG2      VAL  76   4.249   6.858   0.226
  602    H    ILE  77           H        ILE  77   3.883   1.720   0.123
  603    HA   ILE  77           HA       ILE  77   6.484   1.135  -0.889
  604    HB   ILE  77           HB       ILE  77   4.245  -0.824  -0.371
  605   1HG1  ILE  77          2HG1      ILE  77   4.595   0.520   1.625
  606   2HG1  ILE  77          1HG1      ILE  77   5.267  -1.088   1.876
  607   1HG2  ILE  77          1HG2      ILE  77   6.063  -1.780  -1.635
  608   2HG2  ILE  77          2HG2      ILE  77   6.105  -2.404   0.014
  609   3HG2  ILE  77          3HG2      ILE  77   7.240  -1.149  -0.483
  610   1HD1  ILE  77          1HD1      ILE  77   7.345   0.491   0.837
  611   2HD1  ILE  77          2HD1      ILE  77   7.174  -0.148   2.472
  612   3HD1  ILE  77          3HD1      ILE  77   6.544   1.451   2.081
  613    H    VAL  78           H        VAL  78   3.189   0.633  -2.103
  614    HA   VAL  78           HA       VAL  78   2.384   0.033  -4.158
  615    HB   VAL  78           HB       VAL  78   4.736   1.552  -5.273
  616   1HG1  VAL  78          1HG1      VAL  78   1.881   1.451  -6.223
  617   2HG1  VAL  78          2HG1      VAL  78   3.132   0.349  -6.797
  618   3HG1  VAL  78          3HG1      VAL  78   3.287   2.083  -7.078
  619   1HG2  VAL  78          1HG2      VAL  78   2.347   2.556  -3.782
  620   2HG2  VAL  78          2HG2      VAL  78   3.054   3.524  -5.076
  621   3HG2  VAL  78          3HG2      VAL  78   4.031   3.070  -3.679
  622    H    ILE  79           H        ILE  79   2.831  -2.203  -3.976
  623    HA   ILE  79           HA       ILE  79   5.222  -3.134  -5.419
  624    HB   ILE  79           HB       ILE  79   3.435  -4.908  -3.780
  625   1HG1  ILE  79          2HG1      ILE  79   5.853  -3.435  -2.730
  626   2HG1  ILE  79          1HG1      ILE  79   4.190  -2.962  -2.395
  627   1HG2  ILE  79          1HG2      ILE  79   5.805  -5.985  -3.487
  628   2HG2  ILE  79          2HG2      ILE  79   6.172  -5.062  -4.944
  629   3HG2  ILE  79          3HG2      ILE  79   4.872  -6.253  -4.958
  630   1HD1  ILE  79          1HD1      ILE  79   5.229  -4.249  -0.573
  631   2HD1  ILE  79          2HD1      ILE  79   5.392  -5.621  -1.670
  632   3HD1  ILE  79          3HD1      ILE  79   3.790  -5.026  -1.233
  633    H    THR  80           H        THR  80   4.994  -4.816  -6.989
  634    HA   THR  80           HA       THR  80   2.348  -5.595  -7.846
  635    HB   THR  80           HB       THR  80   2.345  -4.607  -9.985
  636    HG1  THR  80           1HG      THR  80   4.099  -3.811 -10.964
  637   1HG2  THR  80          1HG2      THR  80   1.810  -2.949  -8.270
  638   2HG2  THR  80          2HG2      THR  80   2.590  -2.222  -9.674
  639   3HG2  THR  80          3HG2      THR  80   3.510  -2.489  -8.193
  640    H    GLY  81           H        GLY  81   2.825  -6.614 -10.297
  641   1HA   GLY  81          2HA       GLY  81   5.308  -8.103 -10.317
  642   2HA   GLY  81          1HA       GLY  81   3.885  -9.068  -9.956
  643    H    HIS  82           H        HIS  82   2.025  -7.850 -11.639
  644    HA   HIS  82           HA       HIS  82   2.774  -9.035 -14.145
  645   1HB   HIS  82          2HB       HIS  82   0.394  -8.697 -12.864
  646   2HB   HIS  82          1HB       HIS  82   0.316  -7.406 -14.058
  647    HD1  HIS  82           1HD      HIS  82   1.473 -11.034 -14.270
  648    HD2  HIS  82           2HD      HIS  82  -1.057  -8.347 -16.177
  649    HE1  HIS  82           1HE      HIS  82   0.478 -12.302 -16.199
  650    HE2  HIS  82           2HE      HIS  82  -1.114 -10.681 -17.289
  651    H    GLY  83           H        GLY  83   4.647  -7.349 -14.140
  652   1HA   GLY  83          2HA       GLY  83   4.194  -5.589 -16.296
  653   2HA   GLY  83          1HA       GLY  83   4.199  -4.668 -14.800
  654    H    SER  84           H        SER  84   6.071  -3.593 -15.752
  655    HA   SER  84           HA       SER  84   8.532  -5.188 -15.457
  656   1HB   SER  84          2HB       SER  84   9.537  -3.340 -16.945
  657   2HB   SER  84          1HB       SER  84   8.473  -4.517 -17.716
  658    HG   SER  84           HG       SER  84   7.742  -1.918 -16.833
  659    H    VAL  85           H        VAL  85  10.471  -3.790 -14.882
  660    HA   VAL  85           HA       VAL  85   9.984  -2.542 -12.393
  661    HB   VAL  85           HB       VAL  85  12.099  -3.680 -12.905
  662   1HG1  VAL  85          1HG1      VAL  85  12.046  -2.400 -15.281
  663   2HG1  VAL  85          2HG1      VAL  85  13.491  -3.137 -14.589
  664   3HG1  VAL  85          3HG1      VAL  85  13.209  -1.407 -14.405
  665   1HG2  VAL  85          1HG2      VAL  85  12.568  -0.763 -12.303
  666   2HG2  VAL  85          2HG2      VAL  85  13.568  -2.130 -11.812
  667   3HG2  VAL  85          3HG2      VAL  85  11.950  -1.933 -11.136
  668    H    ASP  86           H        ASP  86   9.791  -1.344 -15.572
  669    HA   ASP  86           HA       ASP  86  10.619   1.321 -15.187
  670   1HB   ASP  86          2HB       ASP  86  10.297   0.312 -17.412
  671   2HB   ASP  86          1HB       ASP  86   8.561   0.243 -17.126
  672    H    THR  87           H        THR  87   7.764  -0.358 -14.193
  673    HA   THR  87           HA       THR  87   6.184   2.042 -13.885
  674    HB   THR  87           HB       THR  87   5.379  -0.461 -14.229
  675    HG1  THR  87           1HG      THR  87   4.078   1.475 -13.960
  676   1HG2  THR  87          1HG2      THR  87   6.436  -0.974 -11.851
  677   2HG2  THR  87          2HG2      THR  87   4.959  -1.756 -12.416
  678   3HG2  THR  87          3HG2      THR  87   4.863  -0.383 -11.314
  679    H    ALA  88           H        ALA  88   8.310   0.051 -11.992
  680    HA   ALA  88           HA       ALA  88   7.685   0.986  -9.420
  681   1HB   ALA  88          1HB       ALA  88  10.164   0.366  -9.000
  682   2HB   ALA  88          2HB       ALA  88  10.132  -0.217 -10.663
  683   3HB   ALA  88          3HB       ALA  88   9.040  -0.911  -9.467
  684    H    VAL  89           H        VAL  89  10.335   1.922 -11.581
  685    HA   VAL  89           HA       VAL  89  11.208   4.124 -10.097
  686    HB   VAL  89           HB       VAL  89  12.436   4.803 -12.062
  687   1HG1  VAL  89          1HG1      VAL  89  13.117   2.745 -10.804
  688   2HG1  VAL  89          2HG1      VAL  89  13.700   2.825 -12.467
  689   3HG1  VAL  89          3HG1      VAL  89  12.327   1.794 -12.062
  690   1HG2  VAL  89          1HG2      VAL  89  11.951   3.185 -14.143
  691   2HG2  VAL  89          2HG2      VAL  89  11.172   4.755 -13.944
  692   3HG2  VAL  89          3HG2      VAL  89  10.324   3.283 -13.469
  693    H    LYS  90           H        LYS  90   8.505   3.728 -12.211
  694    HA   LYS  90           HA       LYS  90   8.106   6.596 -12.533
  695   1HB   LYS  90          2HB       LYS  90   7.674   4.947 -14.386
  696   2HB   LYS  90          1HB       LYS  90   6.318   4.343 -13.446
  697   1HG   LYS  90          2HG       LYS  90   5.250   6.528 -13.554
  698   2HG   LYS  90          1HG       LYS  90   6.623   7.161 -14.463
  699   1HD   LYS  90          2HD       LYS  90   5.039   4.794 -15.419
  700   2HD   LYS  90          1HD       LYS  90   4.556   6.450 -15.789
  701   1HE   LYS  90          2HE       LYS  90   5.909   6.309 -17.556
  702   2HE   LYS  90          1HE       LYS  90   7.246   6.406 -16.412
  703   1HZ   LYS  90          1HZ       LYS  90   7.193   4.475 -18.069
  704   2HZ   LYS  90          2HZ       LYS  90   6.007   3.809 -17.064
  705   3HZ   LYS  90          3HZ       LYS  90   7.552   4.125 -16.453
  706    H    ALA  91           H        ALA  91   8.058   5.673  -9.877
  707    HA   ALA  91           HA       ALA  91   5.596   6.759  -8.989
  708   1HB   ALA  91          1HB       ALA  91   4.838   4.687  -7.762
  709   2HB   ALA  91          2HB       ALA  91   5.948   3.779  -8.788
  710   3HB   ALA  91          3HB       ALA  91   4.610   4.671  -9.511
  711    H    ILE  92           H        ILE  92   8.419   4.787  -8.218
  712    HA   ILE  92           HA       ILE  92   8.412   5.448  -5.440
  713    HB   ILE  92           HB       ILE  92  10.418   4.239  -5.240
  714   1HG1  ILE  92          2HG1      ILE  92  10.777   4.547  -8.233
  715   2HG1  ILE  92          1HG1      ILE  92  11.725   5.351  -6.987
  716   1HG2  ILE  92          1HG2      ILE  92   9.929   2.305  -7.061
  717   2HG2  ILE  92          2HG2      ILE  92   8.397   3.174  -7.099
  718   3HG2  ILE  92          3HG2      ILE  92   9.001   2.522  -5.578
  719   1HD1  ILE  92          1HD1      ILE  92  13.074   3.600  -6.759
  720   2HD1  ILE  92          2HD1      ILE  92  12.352   2.990  -8.249
  721   3HD1  ILE  92          3HD1      ILE  92  11.724   2.467  -6.685
  722    H    LYS  93           H        LYS  93   9.808   6.838  -8.313
  723    HA   LYS  93           HA       LYS  93  11.720   8.492  -7.018
  724   1HB   LYS  93          2HB       LYS  93  10.879   7.961  -9.691
  725   2HB   LYS  93          1HB       LYS  93  10.844   9.701  -9.448
  726   1HG   LYS  93          2HG       LYS  93  13.239   8.990  -8.320
  727   2HG   LYS  93          1HG       LYS  93  13.109   7.887  -9.690
  728   1HD   LYS  93          2HD       LYS  93  13.979   9.603 -10.857
  729   2HD   LYS  93          1HD       LYS  93  12.327  10.223 -10.828
  730   1HE   LYS  93          2HE       LYS  93  12.789  11.711  -9.088
  731   2HE   LYS  93          1HE       LYS  93  14.256  10.850  -8.622
  732   1HZ   LYS  93          1HZ       LYS  93  15.466  11.830 -10.259
  733   2HZ   LYS  93          2HZ       LYS  93  14.345  13.071  -9.994
  734   3HZ   LYS  93          3HZ       LYS  93  14.147  12.017 -11.303
  735    H    LYS  94           H        LYS  94   8.314   8.780  -7.701
  736    HA   LYS  94           HA       LYS  94   8.042  11.563  -7.379
  737   1HB   LYS  94          2HB       LYS  94   6.142   9.261  -7.094
  738   2HB   LYS  94          1HB       LYS  94   5.636  10.907  -6.744
  739   1HG   LYS  94          2HG       LYS  94   5.055  10.923  -8.907
  740   2HG   LYS  94          1HG       LYS  94   6.769  11.250  -9.168
  741   1HD   LYS  94          2HD       LYS  94   6.884   8.594  -9.098
  742   2HD   LYS  94          1HD       LYS  94   5.210   8.765  -9.629
  743   1HE   LYS  94          2HE       LYS  94   6.542   8.611 -11.588
  744   2HE   LYS  94          1HE       LYS  94   6.050  10.296 -11.437
  745   1HZ   LYS  94          1HZ       LYS  94   8.430   9.947 -12.021
  746   2HZ   LYS  94          2HZ       LYS  94   8.666   9.268 -10.490
  747   3HZ   LYS  94          3HZ       LYS  94   8.187  10.884 -10.632
  748    H    GLY  95           H        GLY  95   8.632   9.058  -5.107
  749   1HA   GLY  95          2HA       GLY  95   9.436  10.207  -2.951
  750   2HA   GLY  95          1HA       GLY  95   7.782  10.791  -2.883
  751    H    ALA  96           H        ALA  96   7.521   7.800  -4.206
  752    HA   ALA  96           HA       ALA  96   6.289   6.646  -1.994
  753   1HB   ALA  96          1HB       ALA  96   5.772   4.976  -3.398
  754   2HB   ALA  96          2HB       ALA  96   7.455   4.710  -3.854
  755   3HB   ALA  96          3HB       ALA  96   6.523   5.988  -4.633
  756    H    TYR  97           H        TYR  97   7.235   4.112  -1.634
  757    HA   TYR  97           HA       TYR  97   9.795   4.601  -0.271
  758   1HB   TYR  97          2HB       TYR  97   7.598   3.983   0.998
  759   2HB   TYR  97          1HB       TYR  97   7.963   2.350   0.451
  760    HD1  TYR  97           1HD      TYR  97   9.130   1.022   1.918
  761    HD2  TYR  97           2HD      TYR  97   9.766   5.226   2.015
  762    HE1  TYR  97           1HE      TYR  97  10.682   0.737   3.805
  763    HE2  TYR  97           2HE      TYR  97  11.321   4.954   3.902
  764    HH   TYR  97           HH       TYR  97  12.485   1.876   4.896
  765    H    GLU  98           H        GLU  98   9.407   3.747  -3.043
  766    HA   GLU  98           HA       GLU  98  10.630   2.463  -4.482
  767   1HB   GLU  98          2HB       GLU  98  12.451   1.322  -3.775
  768   2HB   GLU  98          1HB       GLU  98  12.121   2.169  -2.277
  769   1HG   GLU  98          2HG       GLU  98  10.633  -0.029  -1.876
  770   2HG   GLU  98          1HG       GLU  98  11.869  -0.696  -2.939
  771    H    PHE  99           H        PHE  99  10.471   0.408  -5.545
  772    HA   PHE  99           HA       PHE  99   7.893  -0.838  -5.050
  773   1HB   PHE  99          2HB       PHE  99   9.576  -0.363  -7.332
  774   2HB   PHE  99          1HB       PHE  99   9.182  -2.074  -7.239
  775    HD1  PHE  99           1HD      PHE  99   7.471  -2.626  -8.650
  776    HD2  PHE  99           2HD      PHE  99   7.299   1.082  -6.569
  777    HE1  PHE  99           1HE      PHE  99   5.277  -2.165  -9.663
  778    HE2  PHE  99           2HE      PHE  99   5.105   1.548  -7.579
  779    HZ   PHE  99           HZ       PHE  99   4.090  -0.077  -9.125
  780    H    LEU 100           H        LEU 100   7.840  -2.452  -3.622
  781    HA   LEU 100           HA       LEU 100  10.061  -3.989  -2.838
  782   1HB   LEU 100          2HB       LEU 100   7.812  -3.547  -1.643
  783   2HB   LEU 100          1HB       LEU 100   7.216  -4.907  -2.574
  784    HG   LEU 100           HG       LEU 100   8.647  -6.430  -1.471
  785   1HD1  LEU 100          1HD1      LEU 100  10.750  -5.557  -1.288
  786   2HD1  LEU 100          2HD1      LEU 100  10.203  -5.366   0.378
  787   3HD1  LEU 100          3HD1      LEU 100  10.170  -3.989  -0.724
  788   1HD2  LEU 100          1HD2      LEU 100   7.669  -4.436   0.563
  789   2HD2  LEU 100          2HD2      LEU 100   8.068  -6.125   0.874
  790   3HD2  LEU 100          3HD2      LEU 100   6.708  -5.719  -0.173
  791    H    GLU 101           H        GLU 101  10.579  -6.166  -3.245
  792    HA   GLU 101           HA       GLU 101   9.723  -7.090  -5.890
  793   1HB   GLU 101          2HB       GLU 101  12.105  -7.796  -4.176
  794   2HB   GLU 101          1HB       GLU 101  11.713  -8.630  -5.674
  795   1HG   GLU 101          2HG       GLU 101  12.527  -6.985  -6.942
  796   2HG   GLU 101          1HG       GLU 101  11.808  -5.725  -5.938
  797    H    LYS 102           H        LYS 102   9.602  -9.511  -6.161
  798    HA   LYS 102           HA       LYS 102   8.586 -11.490  -5.704
  799   1HB   LYS 102          2HB       LYS 102   9.947 -10.758  -3.223
  800   2HB   LYS 102          1HB       LYS 102   8.561 -11.806  -2.959
  801   1HG   LYS 102          2HG       LYS 102   9.937 -13.494  -3.393
  802   2HG   LYS 102          1HG       LYS 102   9.840 -12.996  -5.082
  803   1HD   LYS 102          2HD       LYS 102  11.812 -11.602  -4.809
  804   2HD   LYS 102          1HD       LYS 102  11.889 -12.017  -3.095
  805   1HE   LYS 102          2HE       LYS 102  12.375 -13.787  -5.474
  806   2HE   LYS 102          1HE       LYS 102  13.477 -13.398  -4.154
  807   1HZ   LYS 102          1HZ       LYS 102  11.213 -15.266  -4.191
  808   2HZ   LYS 102          2HZ       LYS 102  11.644 -14.533  -2.728
  809   3HZ   LYS 102          3HZ       LYS 102  12.769 -15.479  -3.565
  810    HA   PRO 103           HA       PRO 103   4.682  -9.287  -4.570
  811   1HB   PRO 103          2HB       PRO 103   3.294  -9.976  -6.778
  812   2HB   PRO 103          1HB       PRO 103   4.399  -8.596  -6.749
  813   1HG   PRO 103          2HG       PRO 103   4.851 -11.362  -7.803
  814   2HG   PRO 103          1HG       PRO 103   5.297  -9.804  -8.524
  815   1HD   PRO 103          2HD       PRO 103   7.062 -11.372  -7.169
  816   2HD   PRO 103          1HD       PRO 103   7.183  -9.603  -7.225
  817    H    PHE 104           H        PHE 104   5.670 -12.463  -4.965
  818    HA   PHE 104           HA       PHE 104   3.122 -13.754  -4.701
  819   1HB   PHE 104          2HB       PHE 104   5.935 -14.799  -4.318
  820   2HB   PHE 104          1HB       PHE 104   4.486 -15.799  -4.299
  821    HD1  PHE 104           1HD      PHE 104   6.978 -14.221  -6.330
  822    HD2  PHE 104           2HD      PHE 104   3.073 -15.915  -6.383
  823    HE1  PHE 104           1HE      PHE 104   7.121 -14.467  -8.774
  824    HE2  PHE 104           2HE      PHE 104   3.211 -16.164  -8.827
  825    HZ   PHE 104           HZ       PHE 104   5.236 -15.439 -10.026
  826    H    SER 105           H        SER 105   5.931 -13.496  -2.516
  827    HA   SER 105           HA       SER 105   4.072 -13.772  -0.249
  828   1HB   SER 105          2HB       SER 105   5.730 -15.601  -0.454
  829   2HB   SER 105          1HB       SER 105   7.027 -14.414  -0.320
  830    HG   SER 105           HG       SER 105   6.016 -13.844   1.749
  831    H    VAL 106           H        VAL 106   3.942 -12.166   1.202
  832    HA   VAL 106           HA       VAL 106   5.622  -9.812   0.774
  833    HB   VAL 106           HB       VAL 106   3.998  -8.603   2.141
  834   1HG1  VAL 106          1HG1      VAL 106   2.325 -10.193   0.252
  835   2HG1  VAL 106          2HG1      VAL 106   3.667  -9.233  -0.370
  836   3HG1  VAL 106          3HG1      VAL 106   2.366  -8.452   0.528
  837   1HG2  VAL 106          1HG2      VAL 106   1.936 -10.601   2.293
  838   2HG2  VAL 106          2HG2      VAL 106   2.624  -9.599   3.571
  839   3HG2  VAL 106          3HG2      VAL 106   3.380 -11.135   3.154
  840    H    GLU 107           H        GLU 107   6.836 -12.056   2.030
  841    HA   GLU 107           HA       GLU 107   6.871 -11.840   4.843
  842   1HB   GLU 107          2HB       GLU 107   7.828 -13.661   3.170
  843   2HB   GLU 107          1HB       GLU 107   9.304 -12.731   3.386
  844   1HG   GLU 107          2HG       GLU 107   8.870 -12.990   5.895
  845   2HG   GLU 107          1HG       GLU 107   7.729 -14.250   5.425
  846    H    ARG 108           H        ARG 108   9.192 -10.684   2.394
  847    HA   ARG 108           HA       ARG 108  10.792  -9.205   4.171
  848   1HB   ARG 108          2HB       ARG 108  11.450  -9.842   1.852
  849   2HB   ARG 108          1HB       ARG 108  10.308  -8.657   1.234
  850   1HG   ARG 108          2HG       ARG 108  12.443  -7.653   1.156
  851   2HG   ARG 108          1HG       ARG 108  11.586  -6.911   2.508
  852   1HD   ARG 108          2HD       ARG 108  13.004  -7.760   4.037
  853   2HD   ARG 108          1HD       ARG 108  13.147  -9.303   3.194
  854    HE   ARG 108           HE       ARG 108  14.537  -7.611   1.612
  855   1HH1  ARG 108          1HH1      ARG 108  14.651  -8.303   5.031
  856   2HH1  ARG 108          2HH1      ARG 108  16.341  -7.952   5.172
  857   1HH2  ARG 108          1HH2      ARG 108  16.759  -7.150   1.797
  858   2HH2  ARG 108          2HH2      ARG 108  17.538  -7.297   3.337
  859    H    PHE 109           H        PHE 109   7.805  -8.506   2.519
  860    HA   PHE 109           HA       PHE 109   7.706  -5.726   2.762
  861   1HB   PHE 109          2HB       PHE 109   6.043  -6.722   1.417
  862   2HB   PHE 109          1HB       PHE 109   5.602  -7.875   2.665
  863    HD1  PHE 109           1HD      PHE 109   5.593  -4.213   1.999
  864    HD2  PHE 109           2HD      PHE 109   3.694  -7.508   3.911
  865    HE1  PHE 109           1HE      PHE 109   3.753  -2.739   2.701
  866    HE2  PHE 109           2HE      PHE 109   1.851  -6.039   4.615
  867    HZ   PHE 109           HZ       PHE 109   1.877  -3.652   4.010
  868    H    LEU 110           H        LEU 110   6.896  -8.301   5.024
  869    HA   LEU 110           HA       LEU 110   5.712  -6.764   7.038
  870   1HB   LEU 110          2HB       LEU 110   6.647  -9.436   6.698
  871   2HB   LEU 110          1HB       LEU 110   7.136  -8.838   8.273
  872    HG   LEU 110           HG       LEU 110   4.304  -8.806   7.234
  873   1HD1  LEU 110          1HD1      LEU 110   4.099 -10.556   9.124
  874   2HD1  LEU 110          2HD1      LEU 110   5.835 -10.764   8.888
  875   3HD1  LEU 110          3HD1      LEU 110   4.723 -11.053   7.550
  876   1HD2  LEU 110          1HD2      LEU 110   4.459  -7.096   8.814
  877   2HD2  LEU 110          2HD2      LEU 110   5.587  -8.001   9.822
  878   3HD2  LEU 110          3HD2      LEU 110   3.893  -8.481   9.748
  879    H    LEU 111           H        LEU 111   9.087  -7.820   6.683
  880    HA   LEU 111           HA       LEU 111  10.112  -6.627   8.976
  881   1HB   LEU 111          2HB       LEU 111  11.375  -7.271   6.330
  882   2HB   LEU 111          1HB       LEU 111  12.294  -6.613   7.670
  883    HG   LEU 111           HG       LEU 111  10.697  -8.984   8.350
  884   1HD1  LEU 111          1HD1      LEU 111  11.379  -9.556   6.060
  885   2HD1  LEU 111          2HD1      LEU 111  12.169 -10.569   7.267
  886   3HD1  LEU 111          3HD1      LEU 111  13.060  -9.254   6.500
  887   1HD2  LEU 111          1HD2      LEU 111  12.120  -8.449  10.042
  888   2HD2  LEU 111          2HD2      LEU 111  13.345  -7.794   8.956
  889   3HD2  LEU 111          3HD2      LEU 111  13.170  -9.540   9.139
  890    H    THR 112           H        THR 112   9.858  -5.298   5.686
  891    HA   THR 112           HA       THR 112  11.084  -2.820   6.328
  892    HB   THR 112           HB       THR 112   9.177  -3.444   4.066
  893    HG1  THR 112           1HG      THR 112  10.875  -4.193   2.973
  894   1HG2  THR 112          1HG2      THR 112  10.850  -1.736   2.967
  895   2HG2  THR 112          2HG2      THR 112  10.985  -1.166   4.630
  896   3HG2  THR 112          3HG2      THR 112   9.412  -1.199   3.834
  897    H    ILE 113           H        ILE 113   7.714  -3.860   6.038
  898    HA   ILE 113           HA       ILE 113   6.284  -1.589   6.261
  899    HB   ILE 113           HB       ILE 113   5.882  -4.328   7.318
  900   1HG1  ILE 113          2HG1      ILE 113   5.268  -3.712   5.027
  901   2HG1  ILE 113          1HG1      ILE 113   3.846  -4.174   5.958
  902   1HG2  ILE 113          1HG2      ILE 113   4.367  -1.955   8.338
  903   2HG2  ILE 113          2HG2      ILE 113   5.037  -3.318   9.234
  904   3HG2  ILE 113          3HG2      ILE 113   3.610  -3.544   8.224
  905   1HD1  ILE 113          1HD1      ILE 113   3.973  -1.459   6.332
  906   2HD1  ILE 113          2HD1      ILE 113   2.938  -2.303   5.181
  907   3HD1  ILE 113          3HD1      ILE 113   4.496  -1.662   4.660
  908    H    LYS 114           H        LYS 114   7.626  -3.316   9.077
  909    HA   LYS 114           HA       LYS 114   6.762  -1.719  11.114
  910   1HB   LYS 114          2HB       LYS 114   8.122  -3.794  11.355
  911   2HB   LYS 114          1HB       LYS 114   9.546  -2.869  10.902
  912   1HG   LYS 114          2HG       LYS 114   7.909  -1.878  13.171
  913   2HG   LYS 114          1HG       LYS 114   8.903  -3.314  13.425
  914   1HD   LYS 114          2HD       LYS 114   9.872  -0.628  12.441
  915   2HD   LYS 114          1HD       LYS 114  10.111  -1.291  14.058
  916   1HE   LYS 114          2HE       LYS 114  11.023  -3.226  12.205
  917   2HE   LYS 114          1HE       LYS 114  11.687  -1.670  11.709
  918   1HZ   LYS 114          1HZ       LYS 114  12.752  -1.398  13.757
  919   2HZ   LYS 114          2HZ       LYS 114  13.021  -3.021  13.364
  920   3HZ   LYS 114          3HZ       LYS 114  11.846  -2.611  14.509
  921    H    HIS 115           H        HIS 115   9.770  -1.276   9.266
  922    HA   HIS 115           HA       HIS 115  10.528   1.136  10.482
  923   1HB   HIS 115          2HB       HIS 115  11.976  -0.363   9.067
  924   2HB   HIS 115          1HB       HIS 115  11.170   0.308   7.654
  925    HD1  HIS 115           1HD      HIS 115  11.238   3.194   7.899
  926    HD2  HIS 115           2HD      HIS 115  14.338   0.876   9.411
  927    HE1  HIS 115           1HE      HIS 115  13.212   4.741   8.070
  928    HE2  HIS 115           2HE      HIS 115  15.054   3.337   9.062
  929    H    ALA 116           H        ALA 116   8.446   0.463   7.721
  930    HA   ALA 116           HA       ALA 116   8.253   3.060   6.691
  931   1HB   ALA 116          1HB       ALA 116   5.945   2.216   5.898
  932   2HB   ALA 116          2HB       ALA 116   6.442   0.677   6.602
  933   3HB   ALA 116          3HB       ALA 116   7.395   1.403   5.308
  934    H    PHE 117           H        PHE 117   6.467   1.451   9.276
  935    HA   PHE 117           HA       PHE 117   4.543   3.473   9.683
  936   1HB   PHE 117          2HB       PHE 117   5.553   1.149  11.253
  937   2HB   PHE 117          1HB       PHE 117   4.593   2.363  12.092
  938    HD1  PHE 117           1HD      PHE 117   2.258   2.653  11.610
  939    HD2  PHE 117           2HD      PHE 117   4.576  -0.231   9.510
  940    HE1  PHE 117           1HE      PHE 117   0.195   1.609  10.776
  941    HE2  PHE 117           2HE      PHE 117   2.517  -1.279   8.669
  942    HZ   PHE 117           HZ       PHE 117   0.320  -0.359   9.304
  943    H    GLU 118           H        GLU 118   7.876   3.298  10.478
  944    HA   GLU 118           HA       GLU 118   8.097   4.781  12.788
  945   1HB   GLU 118          2HB       GLU 118   9.908   3.673  11.311
  946   2HB   GLU 118          1HB       GLU 118   9.970   5.230  10.496
  947   1HG   GLU 118          2HG       GLU 118  10.099   5.858  13.192
  948   2HG   GLU 118          1HG       GLU 118  11.099   4.417  13.025
  949    H    GLU 119           H        GLU 119   7.153   5.837   9.627
  950    HA   GLU 119           HA       GLU 119   7.669   8.617  10.047
  951   1HB   GLU 119          2HB       GLU 119   5.864   7.262   8.040
  952   2HB   GLU 119          1HB       GLU 119   6.353   8.950   7.996
  953   1HG   GLU 119          2HG       GLU 119   8.656   7.239   8.165
  954   2HG   GLU 119          1HG       GLU 119   7.631   6.774   6.809
  955    H    TYR 120           H        TYR 120   5.401   6.575  11.368
  956    HA   TYR 120           HA       TYR 120   3.907   8.757  12.465
  957   1HB   TYR 120          2HB       TYR 120   2.926   8.027  10.085
  958   2HB   TYR 120          1HB       TYR 120   2.128   6.814  11.081
  959    HD1  TYR 120           1HD      TYR 120   0.215   7.363  12.330
  960    HD2  TYR 120           2HD      TYR 120   2.604  10.477  10.689
  961    HE1  TYR 120           1HE      TYR 120  -1.507   9.005  12.952
  962    HE2  TYR 120           2HE      TYR 120   0.890  12.128  11.307
  963    HH   TYR 120           HH       TYR 120  -1.475  12.228  11.806
  964    H    SER 121           H        SER 121   5.278   7.305  14.024
  965    HA   SER 121           HA       SER 121   4.351   4.786  14.814
  966   1HB   SER 121          2HB       SER 121   6.378   6.530  15.615
  967   2HB   SER 121          1HB       SER 121   5.369   6.341  17.050
  968    HG   SER 121           HG       SER 121   6.217   4.446  17.282
  Start of MODEL   24
    1   1H    MET   1          1HT       MET   1  -3.364   2.602  17.621
    2   2H    MET   1          2HT       MET   1  -2.817   0.985  17.800
    3   3H    MET   1          3HT       MET   1  -3.840   1.407  16.487
    4    HA   MET   1           HA       MET   1  -2.084   2.948  15.743
    5   1HB   MET   1          2HB       MET   1  -0.731   1.531  18.019
    6   2HB   MET   1          1HB       MET   1   0.214   2.130  16.663
    7   1HG   MET   1          2HG       MET   1  -1.675   3.926  18.130
    8   2HG   MET   1          1HG       MET   1  -0.054   3.608  18.747
    9   1HE   MET   1          1HE       MET   1   0.288   6.236  18.699
   10   2HE   MET   1          2HE       MET   1   1.334   6.768  17.383
   11   3HE   MET   1          3HE       MET   1   1.746   5.325  18.308
   12    H    LYS   2           H        LYS   2  -0.088   1.962  14.520
   13    HA   LYS   2           HA       LYS   2   0.628   0.517  12.917
   14   1HB   LYS   2          2HB       LYS   2  -0.563  -1.567  14.753
   15   2HB   LYS   2          1HB       LYS   2   0.554  -1.884  13.433
   16   1HG   LYS   2          2HG       LYS   2   1.131  -0.310  15.933
   17   2HG   LYS   2          1HG       LYS   2   1.733  -1.919  15.530
   18   1HD   LYS   2          2HD       LYS   2   2.605  -0.636  13.376
   19   2HD   LYS   2          1HD       LYS   2   2.547   0.739  14.480
   20   1HE   LYS   2          2HE       LYS   2   4.579   0.087  15.143
   21   2HE   LYS   2          1HE       LYS   2   3.746  -1.209  15.999
   22   1HZ   LYS   2          1HZ       LYS   2   4.183  -2.713  14.279
   23   2HZ   LYS   2          2HZ       LYS   2   5.636  -1.869  14.477
   24   3HZ   LYS   2          3HZ       LYS   2   4.611  -1.495  13.184
   25    H    ARG   3           H        ARG   3  -0.802   1.309  11.336
   26    HA   ARG   3           HA       ARG   3  -2.853  -0.625  10.562
   27   1HB   ARG   3          2HB       ARG   3  -3.459   2.317  10.407
   28   2HB   ARG   3          1HB       ARG   3  -4.569   0.959  10.280
   29   1HG   ARG   3          2HG       ARG   3  -5.076   1.616  12.382
   30   2HG   ARG   3          1HG       ARG   3  -3.728   0.544  12.766
   31   1HD   ARG   3          2HD       ARG   3  -2.365   2.249  13.357
   32   2HD   ARG   3          1HD       ARG   3  -3.018   3.334  12.130
   33    HE   ARG   3           HE       ARG   3  -4.895   2.848  14.218
   34   1HH1  ARG   3          1HH1      ARG   3  -2.048   4.694  13.398
   35   2HH1  ARG   3          2HH1      ARG   3  -2.406   5.975  14.507
   36   1HH2  ARG   3          1HH2      ARG   3  -5.368   4.532  15.677
   37   2HH2  ARG   3          2HH2      ARG   3  -4.290   5.882  15.801
   38    H    VAL   4           H        VAL   4  -2.406  -1.241   8.563
   39    HA   VAL   4           HA       VAL   4  -1.230   0.724   6.705
   40    HB   VAL   4           HB       VAL   4  -0.860  -2.265   6.542
   41   1HG1  VAL   4          1HG1      VAL   4   1.208  -1.339   5.224
   42   2HG1  VAL   4          2HG1      VAL   4   0.202   0.098   5.065
   43   3HG1  VAL   4          3HG1      VAL   4  -0.371  -1.448   4.446
   44   1HG2  VAL   4          1HG2      VAL   4   1.172  -0.307   7.588
   45   2HG2  VAL   4          2HG2      VAL   4   1.251  -2.068   7.607
   46   3HG2  VAL   4          3HG2      VAL   4   0.101  -1.225   8.647
   47    H    LEU   5           H        LEU   5  -1.745   0.355   4.408
   48    HA   LEU   5           HA       LEU   5  -4.447  -0.772   4.086
   49   1HB   LEU   5          2HB       LEU   5  -4.294   1.690   3.826
   50   2HB   LEU   5          1HB       LEU   5  -3.162   1.457   2.508
   51    HG   LEU   5           HG       LEU   5  -4.938   0.239   1.258
   52   1HD1  LEU   5          1HD1      LEU   5  -7.302   0.782   2.153
   53   2HD1  LEU   5          2HD1      LEU   5  -6.492   0.938   3.713
   54   3HD1  LEU   5          3HD1      LEU   5  -6.419  -0.587   2.830
   55   1HD2  LEU   5          1HD2      LEU   5  -6.446   2.421   1.127
   56   2HD2  LEU   5          2HD2      LEU   5  -4.814   2.365   0.460
   57   3HD2  LEU   5          3HD2      LEU   5  -5.096   3.094   2.040
   58    H    VAL   6           H        VAL   6  -4.776  -2.291   2.565
   59    HA   VAL   6           HA       VAL   6  -2.495  -2.959   0.815
   60    HB   VAL   6           HB       VAL   6  -4.667  -4.845   1.729
   61   1HG1  VAL   6          1HG1      VAL   6  -3.677  -5.525  -0.356
   62   2HG1  VAL   6          2HG1      VAL   6  -3.081  -6.576   0.929
   63   3HG1  VAL   6          3HG1      VAL   6  -2.054  -5.292   0.292
   64   1HG2  VAL   6          1HG2      VAL   6  -3.243  -5.676   3.392
   65   2HG2  VAL   6          2HG2      VAL   6  -3.103  -3.923   3.534
   66   3HG2  VAL   6          3HG2      VAL   6  -1.836  -4.846   2.726
   67    H    VAL   7           H        VAL   7  -3.111  -1.669  -0.931
   68    HA   VAL   7           HA       VAL   7  -5.754  -1.915  -2.072
   69    HB   VAL   7           HB       VAL   7  -3.329  -0.548  -3.250
   70   1HG1  VAL   7          1HG1      VAL   7  -5.158  -1.031  -4.833
   71   2HG1  VAL   7          2HG1      VAL   7  -4.922   0.698  -4.577
   72   3HG1  VAL   7          3HG1      VAL   7  -6.266  -0.134  -3.795
   73   1HG2  VAL   7          1HG2      VAL   7  -5.518   0.633  -1.542
   74   2HG2  VAL   7          2HG2      VAL   7  -4.180   1.511  -2.285
   75   3HG2  VAL   7          3HG2      VAL   7  -3.863   0.328  -1.016
   76    H    ASP   8           H        ASP   8  -6.282  -3.682  -3.185
   77    HA   ASP   8           HA       ASP   8  -4.516  -4.588  -5.315
   78   1HB   ASP   8          2HB       ASP   8  -3.833  -5.979  -3.439
   79   2HB   ASP   8          1HB       ASP   8  -5.506  -6.424  -3.123
   80    H    ASP   9           H        ASP   9  -5.587  -5.332  -7.068
   81    HA   ASP   9           HA       ASP   9  -8.320  -4.788  -7.371
   82   1HB   ASP   9          2HB       ASP   9  -6.866  -4.754  -9.287
   83   2HB   ASP   9          1HB       ASP   9  -6.433  -6.443  -9.055
   84    H    GLU  10           H        GLU  10  -7.026  -8.026  -8.021
   85    HA   GLU  10           HA       GLU  10  -9.492  -9.190  -7.043
   86   1HB   GLU  10          2HB       GLU  10  -8.068  -9.877  -9.140
   87   2HB   GLU  10          1HB       GLU  10  -7.161 -10.822  -7.968
   88   1HG   GLU  10          2HG       GLU  10  -8.680 -12.420  -8.054
   89   2HG   GLU  10          1HG       GLU  10  -9.925 -11.289  -7.531
   90    H    GLU  11           H        GLU  11  -9.421 -11.111  -5.611
   91    HA   GLU  11           HA       GLU  11  -7.808 -10.516  -3.283
   92   1HB   GLU  11          2HB       GLU  11  -9.753 -12.800  -3.578
   93   2HB   GLU  11          1HB       GLU  11  -9.221 -12.012  -2.098
   94   1HG   GLU  11          2HG       GLU  11 -10.431 -10.006  -2.689
   95   2HG   GLU  11          1HG       GLU  11 -10.893 -10.712  -4.238
   96    H    SER  12           H        SER  12  -5.753 -11.070  -4.273
   97    HA   SER  12           HA       SER  12  -5.304 -13.972  -4.489
   98   1HB   SER  12          2HB       SER  12  -4.725 -12.796  -6.534
   99   2HB   SER  12          1HB       SER  12  -3.713 -11.666  -5.635
  100    HG   SER  12           HG       SER  12  -2.196 -13.056  -6.070
  101    H    ILE  13           H        ILE  13  -4.193 -11.001  -2.990
  102    HA   ILE  13           HA       ILE  13  -2.404 -12.587  -1.269
  103    HB   ILE  13           HB       ILE  13  -2.223  -9.681  -2.067
  104   1HG1  ILE  13          2HG1      ILE  13  -0.001 -10.384  -2.931
  105   2HG1  ILE  13          1HG1      ILE  13  -0.380 -12.044  -2.487
  106   1HG2  ILE  13          1HG2      ILE  13  -0.815 -11.197   0.101
  107   2HG2  ILE  13          2HG2      ILE  13  -1.579  -9.609   0.170
  108   3HG2  ILE  13          3HG2      ILE  13  -0.053  -9.816  -0.688
  109   1HD1  ILE  13          1HD1      ILE  13  -0.763 -11.039  -4.933
  110   2HD1  ILE  13          2HD1      ILE  13  -2.337 -10.690  -4.220
  111   3HD1  ILE  13          3HD1      ILE  13  -1.733 -12.346  -4.257
  112    H    THR  14           H        THR  14  -4.884 -10.098  -1.368
  113    HA   THR  14           HA       THR  14  -4.975  -9.216   1.220
  114    HB   THR  14           HB       THR  14  -7.385  -8.841   0.883
  115    HG1  THR  14           1HG      THR  14  -8.241 -10.470  -0.180
  116   1HG2  THR  14          1HG2      THR  14  -5.411  -8.114  -1.169
  117   2HG2  THR  14          2HG2      THR  14  -6.487  -7.099  -0.208
  118   3HG2  THR  14          3HG2      THR  14  -7.104  -7.941  -1.629
  119    H    SER  15           H        SER  15  -5.867 -12.364   0.026
  120    HA   SER  15           HA       SER  15  -7.286 -13.127   2.413
  121   1HB   SER  15          2HB       SER  15  -7.938 -14.142   0.309
  122   2HB   SER  15          1HB       SER  15  -6.303 -14.752   0.057
  123    HG   SER  15           HG       SER  15  -6.586 -16.063   1.901
  124    H    SER  16           H        SER  16  -4.211 -14.132   0.910
  125    HA   SER  16           HA       SER  16  -3.373 -15.660   3.155
  126   1HB   SER  16          2HB       SER  16  -1.629 -14.493   0.975
  127   2HB   SER  16          1HB       SER  16  -1.259 -15.876   2.006
  128    HG   SER  16           HG       SER  16  -3.314 -15.705   0.054
  129    H    LEU  17           H        LEU  17  -2.009 -12.635   1.844
  130    HA   LEU  17           HA       LEU  17  -0.290 -11.961   3.844
  131   1HB   LEU  17          2HB       LEU  17  -0.263 -10.591   1.962
  132   2HB   LEU  17          1HB       LEU  17  -1.991 -10.315   2.012
  133    HG   LEU  17           HG       LEU  17  -0.377  -8.381   2.618
  134   1HD1  LEU  17          1HD1      LEU  17  -2.166  -7.365   3.497
  135   2HD1  LEU  17          2HD1      LEU  17  -2.354  -8.571   4.770
  136   3HD1  LEU  17          3HD1      LEU  17  -2.993  -8.885   3.157
  137   1HD2  LEU  17          1HD2      LEU  17   0.723  -8.389   4.579
  138   2HD2  LEU  17          2HD2      LEU  17   0.590 -10.142   4.437
  139   3HD2  LEU  17          3HD2      LEU  17  -0.569  -9.247   5.413
  140    H    SER  18           H        SER  18  -3.771 -11.228   3.768
  141    HA   SER  18           HA       SER  18  -4.049  -9.669   5.975
  142   1HB   SER  18          2HB       SER  18  -6.031 -10.094   4.812
  143   2HB   SER  18          1HB       SER  18  -5.804 -11.842   4.866
  144    HG   SER  18           HG       SER  18  -6.749 -10.101   6.851
  145    H    ALA  19           H        ALA  19  -3.527 -13.158   5.942
  146    HA   ALA  19           HA       ALA  19  -3.935 -13.561   8.725
  147   1HB   ALA  19          1HB       ALA  19  -4.046 -15.560   7.640
  148   2HB   ALA  19          2HB       ALA  19  -2.353 -15.613   8.132
  149   3HB   ALA  19          3HB       ALA  19  -2.780 -15.133   6.490
  150    H    ILE  20           H        ILE  20  -1.158 -12.797   6.734
  151    HA   ILE  20           HA       ILE  20   0.827 -13.058   8.742
  152    HB   ILE  20           HB       ILE  20   0.775 -11.574   6.120
  153   1HG1  ILE  20          2HG1      ILE  20   2.659 -13.573   6.017
  154   2HG1  ILE  20          1HG1      ILE  20   1.372 -14.286   6.980
  155   1HG2  ILE  20          1HG2      ILE  20   3.402 -11.810   6.626
  156   2HG2  ILE  20          2HG2      ILE  20   2.796 -11.553   8.262
  157   3HG2  ILE  20          3HG2      ILE  20   2.462 -10.365   7.002
  158   1HD1  ILE  20          1HD1      ILE  20   1.201 -13.194   4.193
  159   2HD1  ILE  20          2HD1      ILE  20  -0.216 -13.586   5.165
  160   3HD1  ILE  20          3HD1      ILE  20   0.934 -14.851   4.735
  161    H    LEU  21           H        LEU  21  -0.257 -10.066   7.155
  162    HA   LEU  21           HA       LEU  21   0.773  -8.250   8.948
  163   1HB   LEU  21          2HB       LEU  21  -0.209  -6.764   7.610
  164   2HB   LEU  21          1HB       LEU  21  -0.718  -8.135   6.667
  165    HG   LEU  21           HG       LEU  21  -2.546  -6.627   7.012
  166   1HD1  LEU  21          1HD1      LEU  21  -2.528  -9.346   7.484
  167   2HD1  LEU  21          2HD1      LEU  21  -3.943  -8.343   7.167
  168   3HD1  LEU  21          3HD1      LEU  21  -3.464  -8.686   8.825
  169   1HD2  LEU  21          1HD2      LEU  21  -2.898  -7.061   9.845
  170   2HD2  LEU  21          2HD2      LEU  21  -2.877  -5.553   8.928
  171   3HD2  LEU  21          3HD2      LEU  21  -1.368  -6.261   9.494
  172    H    GLU  22           H        GLU  22  -2.005 -10.305   9.329
  173    HA   GLU  22           HA       GLU  22  -3.133  -8.868  11.528
  174   1HB   GLU  22          2HB       GLU  22  -3.616 -11.481  10.221
  175   2HB   GLU  22          1HB       GLU  22  -4.159 -11.301  11.883
  176   1HG   GLU  22          2HG       GLU  22  -5.402  -9.261  11.182
  177   2HG   GLU  22          1HG       GLU  22  -4.978  -9.640   9.514
  178    H    GLU  23           H        GLU  23  -0.670 -11.309  11.167
  179    HA   GLU  23           HA       GLU  23  -0.642 -12.021  13.954
  180   1HB   GLU  23          2HB       GLU  23   0.020 -13.745  12.482
  181   2HB   GLU  23          1HB       GLU  23   1.100 -12.683  11.590
  182   1HG   GLU  23          2HG       GLU  23   2.807 -13.117  12.937
  183   2HG   GLU  23          1HG       GLU  23   1.827 -12.894  14.386
  184    H    GLU  24           H        GLU  24   1.159  -9.900  11.802
  185    HA   GLU  24           HA       GLU  24   3.246  -9.264  13.576
  186   1HB   GLU  24          2HB       GLU  24   2.132  -8.048  11.109
  187   2HB   GLU  24          1HB       GLU  24   3.188  -7.061  12.108
  188   1HG   GLU  24          2HG       GLU  24   4.342  -8.255  10.265
  189   2HG   GLU  24          1HG       GLU  24   4.987  -8.594  11.870
  190    H    GLY  25           H        GLY  25  -0.052  -8.379  13.583
  191   1HA   GLY  25          2HA       GLY  25  -1.158  -7.263  15.312
  192   2HA   GLY  25          1HA       GLY  25   0.393  -6.683  15.898
  193    H    TYR  26           H        TYR  26  -1.712  -6.338  13.046
  194    HA   TYR  26           HA       TYR  26  -1.346  -3.430  13.221
  195   1HB   TYR  26          2HB       TYR  26  -0.923  -5.159  10.790
  196   2HB   TYR  26          1HB       TYR  26  -1.236  -3.435  10.669
  197    HD1  TYR  26           1HD      TYR  26   0.568  -2.018  10.561
  198    HD2  TYR  26           2HD      TYR  26   1.057  -5.802  12.438
  199    HE1  TYR  26           1HE      TYR  26   2.963  -1.559  10.852
  200    HE2  TYR  26           2HE      TYR  26   3.455  -5.348  12.735
  201    HH   TYR  26           HH       TYR  26   5.206  -3.745  11.401
  202    H    HIS  27           H        HIS  27  -2.816  -2.489  11.287
  203    HA   HIS  27           HA       HIS  27  -5.436  -3.823  11.421
  204   1HB   HIS  27          2HB       HIS  27  -4.757  -1.375  12.641
  205   2HB   HIS  27          1HB       HIS  27  -5.704  -0.952  11.218
  206    HD1  HIS  27           1HD      HIS  27  -7.532  -3.590  11.443
  207    HD2  HIS  27           2HD      HIS  27  -6.817  -0.773  14.413
  208    HE1  HIS  27           1HE      HIS  27  -9.480  -3.769  13.022
  209    HE2  HIS  27           2HE      HIS  27  -8.981  -2.117  14.858
  210    HA   PRO  28           HA       PRO  28  -4.511  -2.974   7.044
  211   1HB   PRO  28          2HB       PRO  28  -5.349  -5.323   6.056
  212   2HB   PRO  28          1HB       PRO  28  -3.772  -5.135   6.829
  213   1HG   PRO  28          2HG       PRO  28  -6.254  -6.376   7.875
  214   2HG   PRO  28          1HG       PRO  28  -4.572  -6.795   8.192
  215   1HD   PRO  28          2HD       PRO  28  -6.247  -5.291   9.863
  216   2HD   PRO  28          1HD       PRO  28  -4.486  -5.437  10.002
  217    H    ASP  29           H        ASP  29  -5.816  -1.958   5.714
  218    HA   ASP  29           HA       ASP  29  -8.703  -2.396   6.012
  219   1HB   ASP  29          2HB       ASP  29  -7.309  -0.035   6.238
  220   2HB   ASP  29          1HB       ASP  29  -8.018   0.054   4.628
  221    H    THR  30           H        THR  30  -6.446  -3.399   4.120
  222    HA   THR  30           HA       THR  30  -6.185  -3.409   1.731
  223    HB   THR  30           HB       THR  30  -7.016  -5.541   1.157
  224    HG1  THR  30           1HG      THR  30  -9.121  -5.584   1.575
  225   1HG2  THR  30          1HG2      THR  30  -5.894  -6.690   2.685
  226   2HG2  THR  30          2HG2      THR  30  -7.014  -6.234   3.968
  227   3HG2  THR  30          3HG2      THR  30  -5.682  -5.161   3.537
  228    H    ALA  31           H        ALA  31  -6.810  -2.410  -0.012
  229    HA   ALA  31           HA       ALA  31  -9.653  -1.742  -0.344
  230   1HB   ALA  31          1HB       ALA  31  -7.779   0.044  -0.278
  231   2HB   ALA  31          2HB       ALA  31  -9.043   0.168  -1.502
  232   3HB   ALA  31          3HB       ALA  31  -7.458  -0.475  -1.933
  233    H    LYS  32           H        LYS  32  -9.820  -1.213  -2.983
  234    HA   LYS  32           HA       LYS  32  -9.427  -3.853  -4.194
  235   1HB   LYS  32          2HB       LYS  32 -11.720  -3.316  -4.164
  236   2HB   LYS  32          1HB       LYS  32 -11.424  -1.646  -4.624
  237   1HG   LYS  32          2HG       LYS  32 -10.798  -2.344  -6.844
  238   2HG   LYS  32          1HG       LYS  32 -11.010  -4.033  -6.397
  239   1HD   LYS  32          2HD       LYS  32 -13.388  -3.599  -5.949
  240   2HD   LYS  32          1HD       LYS  32 -13.163  -1.919  -6.437
  241   1HE   LYS  32          2HE       LYS  32 -12.124  -3.392  -8.547
  242   2HE   LYS  32          1HE       LYS  32 -13.563  -4.287  -8.061
  243   1HZ   LYS  32          1HZ       LYS  32 -14.568  -2.815  -9.407
  244   2HZ   LYS  32          2HZ       LYS  32 -13.336  -1.662  -9.276
  245   3HZ   LYS  32          3HZ       LYS  32 -14.500  -1.797  -8.057
  246    H    THR  33           H        THR  33  -9.094  -0.388  -4.830
  247    HA   THR  33           HA       THR  33  -6.794  -0.836  -6.477
  248    HB   THR  33           HB       THR  33  -8.860   0.683  -7.965
  249    HG1  THR  33           1HG      THR  33  -9.876  -1.131  -8.706
  250   1HG2  THR  33          1HG2      THR  33  -6.370  -0.228  -8.579
  251   2HG2  THR  33          2HG2      THR  33  -7.605   0.238  -9.749
  252   3HG2  THR  33          3HG2      THR  33  -7.405  -1.458  -9.306
  253    H    LEU  34           H        LEU  34  -6.624   1.584  -7.768
  254    HA   LEU  34           HA       LEU  34  -5.930   3.311  -5.637
  255   1HB   LEU  34          2HB       LEU  34  -6.222   3.998  -8.561
  256   2HB   LEU  34          1HB       LEU  34  -5.317   4.904  -7.362
  257    HG   LEU  34           HG       LEU  34  -4.639   2.074  -8.151
  258   1HD1  LEU  34          1HD1      LEU  34  -2.659   3.548  -9.216
  259   2HD1  LEU  34          2HD1      LEU  34  -4.022   4.640  -9.458
  260   3HD1  LEU  34          3HD1      LEU  34  -4.073   3.006 -10.120
  261   1HD2  LEU  34          1HD2      LEU  34  -3.726   3.864  -6.102
  262   2HD2  LEU  34          2HD2      LEU  34  -2.409   3.505  -7.220
  263   3HD2  LEU  34          3HD2      LEU  34  -3.264   2.191  -6.412
  264    H    ARG  35           H        ARG  35  -8.475   3.559  -8.128
  265    HA   ARG  35           HA       ARG  35  -9.649   5.908  -7.178
  266   1HB   ARG  35          2HB       ARG  35 -11.705   5.122  -8.356
  267   2HB   ARG  35          1HB       ARG  35 -10.253   5.053  -9.345
  268   1HG   ARG  35          2HG       ARG  35 -10.150   2.582  -8.517
  269   2HG   ARG  35          1HG       ARG  35 -11.866   2.831  -8.188
  270   1HD   ARG  35          2HD       ARG  35 -12.205   3.517 -10.516
  271   2HD   ARG  35          1HD       ARG  35 -10.492   3.256 -10.840
  272    HE   ARG  35           HE       ARG  35 -11.351   0.864  -9.870
  273   1HH1  ARG  35          1HH1      ARG  35 -12.384   2.946 -12.474
  274   2HH1  ARG  35          2HH1      ARG  35 -12.967   1.641 -13.452
  275   1HH2  ARG  35          1HH2      ARG  35 -12.116  -0.853 -11.156
  276   2HH2  ARG  35          2HH2      ARG  35 -12.815  -0.515 -12.704
  277    H    GLU  36           H        GLU  36 -10.334   2.520  -6.392
  278    HA   GLU  36           HA       GLU  36 -12.413   3.100  -4.540
  279   1HB   GLU  36          2HB       GLU  36 -12.014   0.886  -5.715
  280   2HB   GLU  36          1HB       GLU  36 -10.693   0.617  -4.587
  281   1HG   GLU  36          2HG       GLU  36 -12.166  -0.314  -3.226
  282   2HG   GLU  36          1HG       GLU  36 -12.844   1.293  -2.974
  283    H    ALA  37           H        ALA  37  -8.926   2.709  -4.298
  284    HA   ALA  37           HA       ALA  37  -8.806   2.613  -1.462
  285   1HB   ALA  37          1HB       ALA  37  -6.388   3.288  -1.848
  286   2HB   ALA  37          2HB       ALA  37  -6.764   3.267  -3.571
  287   3HB   ALA  37          3HB       ALA  37  -6.919   1.792  -2.617
  288    H    GLU  38           H        GLU  38  -8.830   5.212  -3.825
  289    HA   GLU  38           HA       GLU  38  -8.071   7.292  -2.073
  290   1HB   GLU  38          2HB       GLU  38  -9.681   7.295  -4.623
  291   2HB   GLU  38          1HB       GLU  38  -9.246   8.765  -3.762
  292   1HG   GLU  38          2HG       GLU  38  -6.974   8.499  -4.211
  293   2HG   GLU  38          1HG       GLU  38  -7.164   6.796  -4.628
  294    H    LYS  39           H        LYS  39 -11.201   5.941  -3.008
  295    HA   LYS  39           HA       LYS  39 -12.839   7.732  -1.612
  296   1HB   LYS  39          2HB       LYS  39 -13.754   6.152  -3.221
  297   2HB   LYS  39          1HB       LYS  39 -13.254   4.797  -2.219
  298   1HG   LYS  39          2HG       LYS  39 -15.116   6.848  -1.112
  299   2HG   LYS  39          1HG       LYS  39 -15.723   5.592  -2.193
  300   1HD   LYS  39          2HD       LYS  39 -14.261   4.086  -0.513
  301   2HD   LYS  39          1HD       LYS  39 -14.721   5.395   0.579
  302   1HE   LYS  39          2HE       LYS  39 -16.633   3.771  -1.096
  303   2HE   LYS  39          1HE       LYS  39 -16.313   3.508   0.617
  304   1HZ   LYS  39          1HZ       LYS  39 -18.334   4.830   0.177
  305   2HZ   LYS  39          2HZ       LYS  39 -17.373   6.041  -0.512
  306   3HZ   LYS  39          3HZ       LYS  39 -17.201   5.655   1.125
  307    H    LYS  40           H        LYS  40 -11.147   4.811  -0.597
  308    HA   LYS  40           HA       LYS  40 -12.252   4.756   2.034
  309   1HB   LYS  40          2HB       LYS  40  -9.871   3.424   0.769
  310   2HB   LYS  40          1HB       LYS  40 -10.273   3.209   2.466
  311   1HG   LYS  40          2HG       LYS  40 -12.619   2.750   0.925
  312   2HG   LYS  40          1HG       LYS  40 -11.293   1.822   0.224
  313   1HD   LYS  40          2HD       LYS  40 -10.808   0.861   2.428
  314   2HD   LYS  40          1HD       LYS  40 -12.148   1.780   3.118
  315   1HE   LYS  40          2HE       LYS  40 -13.736   0.582   1.770
  316   2HE   LYS  40          1HE       LYS  40 -12.441  -0.231   0.891
  317   1HZ   LYS  40          1HZ       LYS  40 -13.466  -1.632   2.610
  318   2HZ   LYS  40          2HZ       LYS  40 -12.959  -0.541   3.799
  319   3HZ   LYS  40          3HZ       LYS  40 -11.815  -1.388   2.886
  320    H    ILE  41           H        ILE  41  -9.107   5.785   0.716
  321    HA   ILE  41           HA       ILE  41  -8.037   6.686   3.164
  322    HB   ILE  41           HB       ILE  41  -7.349   7.713   0.410
  323   1HG1  ILE  41          2HG1      ILE  41  -5.692   5.622   1.695
  324   2HG1  ILE  41          1HG1      ILE  41  -7.263   5.099   1.101
  325   1HG2  ILE  41          1HG2      ILE  41  -5.189   7.475   2.323
  326   2HG2  ILE  41          2HG2      ILE  41  -6.466   8.542   2.903
  327   3HG2  ILE  41          3HG2      ILE  41  -5.690   8.859   1.352
  328   1HD1  ILE  41          1HD1      ILE  41  -6.637   6.133  -1.106
  329   2HD1  ILE  41          2HD1      ILE  41  -5.713   4.708  -0.629
  330   3HD1  ILE  41          3HD1      ILE  41  -5.007   6.315  -0.459
  331    H    LYS  42           H        LYS  42 -10.216   8.144   0.883
  332    HA   LYS  42           HA       LYS  42  -9.931  10.835   1.338
  333   1HB   LYS  42          2HB       LYS  42 -12.302   9.126   0.739
  334   2HB   LYS  42          1HB       LYS  42 -12.530  10.836   1.075
  335   1HG   LYS  42          2HG       LYS  42 -10.422  10.641  -0.787
  336   2HG   LYS  42          1HG       LYS  42 -11.710   9.571  -1.343
  337   1HD   LYS  42          2HD       LYS  42 -12.641  11.408  -2.217
  338   2HD   LYS  42          1HD       LYS  42 -13.081  11.824  -0.559
  339   1HE   LYS  42          2HE       LYS  42 -11.995  13.740  -1.130
  340   2HE   LYS  42          1HE       LYS  42 -10.618  12.804  -0.550
  341   1HZ   LYS  42          1HZ       LYS  42 -11.432  12.879  -3.399
  342   2HZ   LYS  42          2HZ       LYS  42  -9.988  12.284  -2.752
  343   3HZ   LYS  42          3HZ       LYS  42 -10.301  13.947  -2.737
  344    H    GLU  43           H        GLU  43 -11.212   8.426   3.489
  345    HA   GLU  43           HA       GLU  43 -11.719  10.531   5.476
  346   1HB   GLU  43          2HB       GLU  43 -13.213   7.925   5.164
  347   2HB   GLU  43          1HB       GLU  43 -13.480   9.108   6.437
  348   1HG   GLU  43          2HG       GLU  43 -14.222  10.738   4.815
  349   2HG   GLU  43          1HG       GLU  43 -13.869   9.621   3.497
  350    H    LEU  44           H        LEU  44 -10.753   7.171   4.946
  351    HA   LEU  44           HA       LEU  44  -9.827   6.844   7.652
  352   1HB   LEU  44          2HB       LEU  44 -10.305   5.162   5.364
  353   2HB   LEU  44          1HB       LEU  44  -8.718   4.829   6.030
  354    HG   LEU  44           HG       LEU  44 -10.369   3.333   6.990
  355   1HD1  LEU  44          1HD1      LEU  44  -9.581   3.444   9.119
  356   2HD1  LEU  44          2HD1      LEU  44  -9.859   5.180   9.253
  357   3HD1  LEU  44          3HD1      LEU  44  -8.465   4.576   8.356
  358   1HD2  LEU  44          1HD2      LEU  44 -12.385   4.569   6.775
  359   2HD2  LEU  44          2HD2      LEU  44 -11.767   5.879   7.781
  360   3HD2  LEU  44          3HD2      LEU  44 -12.126   4.309   8.499
  361    H    PHE  45           H        PHE  45  -8.007   7.723   8.360
  362    HA   PHE  45           HA       PHE  45  -5.940   8.586   6.547
  363   1HB   PHE  45          2HB       PHE  45  -6.619   9.867   8.595
  364   2HB   PHE  45          1HB       PHE  45  -5.902   8.588   9.570
  365    HD1  PHE  45           1HD      PHE  45  -5.210  11.327   7.226
  366    HD2  PHE  45           2HD      PHE  45  -3.534   8.391   9.812
  367    HE1  PHE  45           1HE      PHE  45  -3.024  12.445   7.072
  368    HE2  PHE  45           2HE      PHE  45  -1.345   9.505   9.663
  369    HZ   PHE  45           HZ       PHE  45  -1.088  11.535   8.292
  370    H    PHE  46           H        PHE  46  -4.806   6.942   5.656
  371    HA   PHE  46           HA       PHE  46  -3.855   4.775   7.373
  372   1HB   PHE  46          2HB       PHE  46  -3.828   5.113   4.371
  373   2HB   PHE  46          1HB       PHE  46  -3.128   3.735   5.212
  374    HD1  PHE  46           1HD      PHE  46  -5.766   4.559   3.314
  375    HD2  PHE  46           2HD      PHE  46  -4.983   2.909   7.154
  376    HE1  PHE  46           1HE      PHE  46  -7.958   3.444   3.273
  377    HE2  PHE  46           2HE      PHE  46  -7.174   1.788   7.123
  378    HZ   PHE  46           HZ       PHE  46  -8.665   2.060   5.181
  379    HA   PRO  47           HA       PRO  47   0.092   6.923   7.533
  380   1HB   PRO  47          2HB       PRO  47   1.339   5.174   9.172
  381   2HB   PRO  47          1HB       PRO  47   0.140   6.331   9.765
  382   1HG   PRO  47          2HG       PRO  47  -0.186   3.428   9.122
  383   2HG   PRO  47          1HG       PRO  47  -0.810   4.344  10.506
  384   1HD   PRO  47          2HD       PRO  47  -2.329   3.718   8.338
  385   2HD   PRO  47          1HD       PRO  47  -2.589   5.176   9.313
  386    H    VAL  48           H        VAL  48  -0.578   3.722   6.435
  387    HA   VAL  48           HA       VAL  48   1.754   3.796   4.710
  388    HB   VAL  48           HB       VAL  48   1.162   1.285   6.248
  389   1HG1  VAL  48          1HG1      VAL  48   3.338   2.261   4.455
  390   2HG1  VAL  48          2HG1      VAL  48   2.491   0.714   4.457
  391   3HG1  VAL  48          3HG1      VAL  48   3.703   1.057   5.691
  392   1HG2  VAL  48          1HG2      VAL  48   1.660   2.753   7.980
  393   2HG2  VAL  48          2HG2      VAL  48   2.863   3.615   7.025
  394   3HG2  VAL  48          3HG2      VAL  48   3.204   1.988   7.606
  395    H    ILE  49           H        ILE  49   1.299   3.062   2.737
  396    HA   ILE  49           HA       ILE  49  -1.187   1.536   2.333
  397    HB   ILE  49           HB       ILE  49   0.129   3.261   0.240
  398   1HG1  ILE  49          2HG1      ILE  49  -0.486   4.669   2.181
  399   2HG1  ILE  49          1HG1      ILE  49  -1.470   5.023   0.764
  400   1HG2  ILE  49          1HG2      ILE  49  -2.558   1.946   0.519
  401   2HG2  ILE  49          2HG2      ILE  49  -1.340   1.700  -0.732
  402   3HG2  ILE  49          3HG2      ILE  49  -2.238   3.216  -0.664
  403   1HD1  ILE  49          1HD1      ILE  49  -2.235   3.705   3.321
  404   2HD1  ILE  49          2HD1      ILE  49  -3.131   3.337   1.847
  405   3HD1  ILE  49          3HD1      ILE  49  -3.039   4.999   2.432
  406    H    VAL  50           H        VAL  50  -1.130   0.026   0.458
  407    HA   VAL  50           HA       VAL  50   1.494  -0.732  -0.500
  408    HB   VAL  50           HB       VAL  50  -0.152  -2.676   1.124
  409   1HG1  VAL  50          1HG1      VAL  50   2.511  -3.077  -0.239
  410   2HG1  VAL  50          2HG1      VAL  50   0.970  -3.706  -0.819
  411   3HG1  VAL  50          3HG1      VAL  50   1.628  -4.268   0.716
  412   1HG2  VAL  50          1HG2      VAL  50   1.837  -2.684   2.606
  413   2HG2  VAL  50          2HG2      VAL  50   0.999  -1.134   2.561
  414   3HG2  VAL  50          3HG2      VAL  50   2.500  -1.351   1.660
  415    H    LEU  51           H        LEU  51   0.915  -0.503  -2.565
  416    HA   LEU  51           HA       LEU  51  -1.571  -1.394  -3.636
  417   1HB   LEU  51          2HB       LEU  51  -0.051   0.448  -4.537
  418   2HB   LEU  51          1HB       LEU  51   0.927  -0.838  -5.219
  419    HG   LEU  51           HG       LEU  51  -0.892  -1.560  -6.627
  420   1HD1  LEU  51          1HD1      LEU  51  -2.783  -1.215  -5.218
  421   2HD1  LEU  51          2HD1      LEU  51  -3.015  -0.242  -6.671
  422   3HD1  LEU  51          3HD1      LEU  51  -2.500   0.526  -5.169
  423   1HD2  LEU  51          1HD2      LEU  51  -0.454   1.420  -6.683
  424   2HD2  LEU  51          2HD2      LEU  51  -1.217   0.502  -7.982
  425   3HD2  LEU  51          3HD2      LEU  51   0.463   0.187  -7.548
  426    H    ASP  52           H        ASP  52  -1.698  -2.946  -5.463
  427    HA   ASP  52           HA       ASP  52   0.255  -5.087  -5.494
  428   1HB   ASP  52          2HB       ASP  52  -1.586  -5.396  -3.599
  429   2HB   ASP  52          1HB       ASP  52  -2.545  -5.975  -4.958
  430    H    VAL  53           H        VAL  53  -0.050  -3.602  -7.569
  431    HA   VAL  53           HA       VAL  53  -2.075  -3.776  -9.365
  432    HB   VAL  53           HB       VAL  53   0.851  -4.027 -10.078
  433   1HG1  VAL  53          1HG1      VAL  53   0.295  -3.768 -12.221
  434   2HG1  VAL  53          2HG1      VAL  53  -0.847  -2.476 -11.851
  435   3HG1  VAL  53          3HG1      VAL  53  -1.354  -4.161 -11.736
  436   1HG2  VAL  53          1HG2      VAL  53   0.750  -2.130  -8.731
  437   2HG2  VAL  53          2HG2      VAL  53  -0.848  -1.676  -9.323
  438   3HG2  VAL  53          3HG2      VAL  53   0.564  -1.485 -10.362
  439    H    TRP  54           H        TRP  54  -3.193  -5.724  -9.323
  440    HA   TRP  54           HA       TRP  54  -1.822  -8.180 -10.065
  441   1HB   TRP  54          2HB       TRP  54  -3.498  -8.419  -8.361
  442   2HB   TRP  54          1HB       TRP  54  -4.689  -7.559  -9.331
  443    HD1  TRP  54           HD       TRP  54  -6.469  -9.222 -10.089
  444    HE1  TRP  54           1HE      TRP  54  -6.487 -11.628 -11.001
  445    HE3  TRP  54           3HE      TRP  54  -1.469 -10.233  -9.803
  446    HZ2  TRP  54           2HZ      TRP  54  -4.625 -13.686 -11.528
  447    HZ3  TRP  54           3HZ      TRP  54  -0.667 -12.444 -10.530
  448    HH2  TRP  54           HH       TRP  54  -2.215 -14.133 -11.374
  449    H    MET  55           H        MET  55  -4.920  -6.880 -11.202
  450    HA   MET  55           HA       MET  55  -3.960  -6.850 -13.945
  451   1HB   MET  55          2HB       MET  55  -4.892  -9.170 -13.368
  452   2HB   MET  55          1HB       MET  55  -6.466  -8.388 -13.294
  453   1HG   MET  55          2HG       MET  55  -6.572  -8.068 -15.541
  454   2HG   MET  55          1HG       MET  55  -4.823  -7.945 -15.719
  455   1HE   MET  55          1HE       MET  55  -7.022 -10.297 -13.903
  456   2HE   MET  55          2HE       MET  55  -6.524 -11.907 -14.420
  457   3HE   MET  55          3HE       MET  55  -7.749 -11.028 -15.334
  458    HA   PRO  56           HA       PRO  56  -7.361  -3.767 -13.050
  459   1HB   PRO  56          2HB       PRO  56  -6.000  -1.744 -11.784
  460   2HB   PRO  56          1HB       PRO  56  -6.837  -3.050 -10.946
  461   1HG   PRO  56          2HG       PRO  56  -4.012  -2.540 -11.077
  462   2HG   PRO  56          1HG       PRO  56  -4.855  -3.816 -10.191
  463   1HD   PRO  56          2HD       PRO  56  -3.496  -3.928 -12.812
  464   2HD   PRO  56          1HD       PRO  56  -3.852  -5.230 -11.664
  465    H    ASP  57           H        ASP  57  -6.902  -1.052 -13.293
  466    HA   ASP  57           HA       ASP  57  -5.116  -0.620 -15.541
  467   1HB   ASP  57          2HB       ASP  57  -7.264  -1.433 -16.523
  468   2HB   ASP  57          1HB       ASP  57  -8.069  -0.041 -15.806
  469    H    GLY  58           H        GLY  58  -4.475   0.502 -13.329
  470   1HA   GLY  58          2HA       GLY  58  -5.277   3.306 -13.651
  471   2HA   GLY  58          1HA       GLY  58  -5.422   2.578 -12.059
  472    H    ASP  59           H        ASP  59  -3.613   4.672 -13.564
  473    HA   ASP  59           HA       ASP  59  -0.964   3.669 -13.172
  474   1HB   ASP  59          2HB       ASP  59  -0.271   6.012 -13.601
  475   2HB   ASP  59          1HB       ASP  59  -1.368   5.395 -14.831
  476    H    GLY  60           H        GLY  60   0.501   4.137 -11.545
  477   1HA   GLY  60          2HA       GLY  60  -0.734   5.029  -9.028
  478   2HA   GLY  60          1HA       GLY  60   0.686   4.004  -9.155
  479    H    VAL  61           H        VAL  61   1.609   5.953 -11.369
  480    HA   VAL  61           HA       VAL  61   3.458   7.384  -9.914
  481    HB   VAL  61           HB       VAL  61   2.284   8.176 -12.582
  482   1HG1  VAL  61          1HG1      VAL  61   5.000   8.753 -11.424
  483   2HG1  VAL  61          2HG1      VAL  61   3.659   9.897 -11.459
  484   3HG1  VAL  61          3HG1      VAL  61   4.360   9.314 -12.969
  485   1HG2  VAL  61          1HG2      VAL  61   4.430   6.206 -11.842
  486   2HG2  VAL  61          2HG2      VAL  61   4.314   6.919 -13.450
  487   3HG2  VAL  61          3HG2      VAL  61   2.988   5.941 -12.821
  488    H    ASN  62           H        ASN  62   0.237   8.376 -10.983
  489    HA   ASN  62           HA       ASN  62   0.553  11.012  -9.820
  490   1HB   ASN  62          2HB       ASN  62  -0.753  11.344 -11.642
  491   2HB   ASN  62          1HB       ASN  62  -1.344   9.688 -11.645
  492   1HD2  ASN  62          1HD2      ASN  62  -2.995   9.158 -10.032
  493   2HD2  ASN  62          2HD2      ASN  62  -4.156  10.367  -9.616
  494    H    PHE  63           H        PHE  63  -0.377   7.956  -8.720
  495    HA   PHE  63           HA       PHE  63  -2.366   8.822  -6.837
  496   1HB   PHE  63          2HB       PHE  63  -2.341   6.526  -7.776
  497   2HB   PHE  63          1HB       PHE  63  -0.830   6.217  -6.922
  498    HD1  PHE  63           1HD      PHE  63  -4.053   7.818  -5.945
  499    HD2  PHE  63           2HD      PHE  63  -1.179   4.779  -5.164
  500    HE1  PHE  63           1HE      PHE  63  -5.322   7.136  -3.953
  501    HE2  PHE  63           2HE      PHE  63  -2.444   4.090  -3.170
  502    HZ   PHE  63           HZ       PHE  63  -4.520   5.271  -2.562
  503    H    ILE  64           H        ILE  64   1.084   8.054  -6.719
  504    HA   ILE  64           HA       ILE  64   1.560   7.972  -4.025
  505    HB   ILE  64           HB       ILE  64   3.304   9.398  -6.037
  506   1HG1  ILE  64          2HG1      ILE  64   4.302   6.825  -5.487
  507   2HG1  ILE  64          1HG1      ILE  64   2.573   6.615  -5.755
  508   1HG2  ILE  64          1HG2      ILE  64   5.133   8.918  -4.533
  509   2HG2  ILE  64          2HG2      ILE  64   4.043   8.082  -3.427
  510   3HG2  ILE  64          3HG2      ILE  64   3.884   9.820  -3.676
  511   1HD1  ILE  64          1HD1      ILE  64   4.633   7.717  -7.625
  512   2HD1  ILE  64          2HD1      ILE  64   2.907   7.975  -7.875
  513   3HD1  ILE  64          3HD1      ILE  64   3.560   6.338  -7.850
  514    H    ASP  65           H        ASP  65   0.845  10.792  -5.980
  515    HA   ASP  65           HA       ASP  65   1.527  12.689  -3.941
  516   1HB   ASP  65          2HB       ASP  65   1.472  13.139  -6.447
  517   2HB   ASP  65          1HB       ASP  65  -0.283  13.175  -6.310
  518    H    PHE  66           H        PHE  66  -1.359  10.975  -4.930
  519    HA   PHE  66           HA       PHE  66  -3.263  12.497  -3.540
  520   1HB   PHE  66          2HB       PHE  66  -4.010  10.896  -5.165
  521   2HB   PHE  66          1HB       PHE  66  -3.203   9.577  -4.325
  522    HD1  PHE  66           1HD      PHE  66  -4.166   8.588  -2.344
  523    HD2  PHE  66           2HD      PHE  66  -6.114  11.783  -4.371
  524    HE1  PHE  66           1HE      PHE  66  -6.235   8.108  -1.106
  525    HE2  PHE  66           2HE      PHE  66  -8.188  11.309  -3.135
  526    HZ   PHE  66           HZ       PHE  66  -8.249   9.469  -1.498
  527    H    ILE  67           H        ILE  67  -1.326   9.688  -2.566
  528    HA   ILE  67           HA       ILE  67  -2.405   9.332  -0.013
  529    HB   ILE  67           HB       ILE  67   0.379   8.778  -1.048
  530   1HG1  ILE  67          2HG1      ILE  67  -0.611   6.371  -0.718
  531   2HG1  ILE  67          1HG1      ILE  67  -2.160   7.206  -0.782
  532   1HG2  ILE  67          1HG2      ILE  67   0.919   8.725   1.150
  533   2HG2  ILE  67          2HG2      ILE  67   0.181   7.125   1.054
  534   3HG2  ILE  67          3HG2      ILE  67  -0.751   8.490   1.667
  535   1HD1  ILE  67          1HD1      ILE  67  -0.293   7.900  -2.933
  536   2HD1  ILE  67          2HD1      ILE  67  -2.021   7.549  -2.989
  537   3HD1  ILE  67          3HD1      ILE  67  -0.854   6.228  -2.930
  538    H    LYS  68           H        LYS  68   0.233  11.415  -1.146
  539    HA   LYS  68           HA       LYS  68   0.733  12.451   1.500
  540   1HB   LYS  68          2HB       LYS  68   1.735  13.321  -1.219
  541   2HB   LYS  68          1HB       LYS  68   2.272  14.013   0.306
  542   1HG   LYS  68          2HG       LYS  68   2.662  11.338   0.718
  543   2HG   LYS  68          1HG       LYS  68   3.037  11.519  -0.998
  544   1HD   LYS  68          2HD       LYS  68   4.845  12.859  -0.602
  545   2HD   LYS  68          1HD       LYS  68   4.166  13.518   0.889
  546   1HE   LYS  68          2HE       LYS  68   5.139  10.681   0.619
  547   2HE   LYS  68          1HE       LYS  68   6.160  12.007   1.176
  548   1HZ   LYS  68          1HZ       LYS  68   3.578  11.572   2.498
  549   2HZ   LYS  68          2HZ       LYS  68   5.024  12.182   3.132
  550   3HZ   LYS  68          3HZ       LYS  68   4.854  10.522   2.860
  551    H    GLU  69           H        GLU  69  -1.403  13.146  -1.085
  552    HA   GLU  69           HA       GLU  69  -1.786  15.921  -0.594
  553   1HB   GLU  69          2HB       GLU  69  -2.375  14.703  -2.716
  554   2HB   GLU  69          1HB       GLU  69  -3.741  14.008  -1.857
  555   1HG   GLU  69          2HG       GLU  69  -4.866  16.014  -1.740
  556   2HG   GLU  69          1HG       GLU  69  -3.394  16.967  -1.922
  557    H    ASN  70           H        ASN  70  -3.122  12.984   0.712
  558    HA   ASN  70           HA       ASN  70  -4.653  14.587   2.638
  559   1HB   ASN  70          2HB       ASN  70  -6.198  12.369   2.508
  560   2HB   ASN  70          1HB       ASN  70  -6.506  13.826   1.568
  561   1HD2  ASN  70          1HD2      ASN  70  -5.254  13.872  -0.563
  562   2HD2  ASN  70          2HD2      ASN  70  -5.268  12.410  -1.480
  563    H    SER  71           H        SER  71  -2.030  12.973   2.524
  564    HA   SER  71           HA       SER  71  -2.171  12.002   5.195
  565   1HB   SER  71          2HB       SER  71  -2.661  10.116   3.037
  566   2HB   SER  71          1HB       SER  71  -1.246   9.659   3.986
  567    HG   SER  71           HG       SER  71  -3.329   8.866   4.767
  568    HA   PRO  72           HA       PRO  72   1.967  13.344   3.485
  569   1HB   PRO  72          2HB       PRO  72   1.982  15.100   5.831
  570   2HB   PRO  72          1HB       PRO  72   2.224  15.507   4.130
  571   1HG   PRO  72          2HG       PRO  72  -0.003  16.212   5.477
  572   2HG   PRO  72          1HG       PRO  72  -0.022  15.820   3.749
  573   1HD   PRO  72          2HD       PRO  72  -0.847  14.141   6.086
  574   2HD   PRO  72          1HD       PRO  72  -1.615  14.312   4.492
  575    H    ASP  73           H        ASP  73   0.740  12.313   6.510
  576    HA   ASP  73           HA       ASP  73   3.408  11.568   7.466
  577   1HB   ASP  73          2HB       ASP  73   1.876  12.810   8.999
  578   2HB   ASP  73          1HB       ASP  73   0.781  11.431   8.953
  579    H    SER  74           H        SER  74   2.085  10.179   5.274
  580    HA   SER  74           HA       SER  74   1.661   7.543   6.510
  581   1HB   SER  74          2HB       SER  74  -0.291   8.342   5.263
  582   2HB   SER  74          1HB       SER  74   0.705   8.568   3.827
  583    HG   SER  74           HG       SER  74  -0.424   6.586   3.769
  584    H    VAL  75           H        VAL  75   1.971   6.004   4.172
  585    HA   VAL  75           HA       VAL  75   4.579   6.606   3.066
  586    HB   VAL  75           HB       VAL  75   4.210   4.051   4.637
  587   1HG1  VAL  75          1HG1      VAL  75   6.231   5.080   2.720
  588   2HG1  VAL  75          2HG1      VAL  75   5.703   3.426   3.030
  589   3HG1  VAL  75          3HG1      VAL  75   6.838   4.211   4.130
  590   1HG2  VAL  75          1HG2      VAL  75   4.460   5.873   6.180
  591   2HG2  VAL  75          2HG2      VAL  75   5.803   6.539   5.253
  592   3HG2  VAL  75          3HG2      VAL  75   5.991   5.001   6.096
  593    H    VAL  76           H        VAL  76   4.838   5.787   1.093
  594    HA   VAL  76           HA       VAL  76   2.710   4.017   0.096
  595    HB   VAL  76           HB       VAL  76   4.529   5.578  -1.705
  596   1HG1  VAL  76          1HG1      VAL  76   2.593   3.739  -2.208
  597   2HG1  VAL  76          2HG1      VAL  76   3.107   4.993  -3.338
  598   3HG1  VAL  76          3HG1      VAL  76   1.684   5.246  -2.326
  599   1HG2  VAL  76          1HG2      VAL  76   2.401   6.636   0.050
  600   2HG2  VAL  76          2HG2      VAL  76   2.371   7.175  -1.629
  601   3HG2  VAL  76          3HG2      VAL  76   3.808   7.443  -0.643
  602    H    ILE  77           H        ILE  77   3.308   1.958   0.036
  603    HA   ILE  77           HA       ILE  77   6.080   1.222  -0.436
  604    HB   ILE  77           HB       ILE  77   3.698  -0.587  -0.004
  605   1HG1  ILE  77          2HG1      ILE  77   4.067   0.955   1.899
  606   2HG1  ILE  77          1HG1      ILE  77   4.395  -0.721   2.324
  607   1HG2  ILE  77          1HG2      ILE  77   5.518  -1.757  -1.039
  608   2HG2  ILE  77          2HG2      ILE  77   5.445  -2.226   0.659
  609   3HG2  ILE  77          3HG2      ILE  77   6.669  -1.079   0.112
  610   1HD1  ILE  77          1HD1      ILE  77   6.849   0.193   1.510
  611   2HD1  ILE  77          2HD1      ILE  77   6.297   0.045   3.179
  612   3HD1  ILE  77          3HD1      ILE  77   6.154   1.588   2.336
  613    H    VAL  78           H        VAL  78   2.916   0.387  -1.852
  614    HA   VAL  78           HA       VAL  78   2.306  -0.320  -3.927
  615    HB   VAL  78           HB       VAL  78   4.638   1.334  -4.902
  616   1HG1  VAL  78          1HG1      VAL  78   1.981   0.709  -6.190
  617   2HG1  VAL  78          2HG1      VAL  78   3.500  -0.106  -6.565
  618   3HG1  VAL  78          3HG1      VAL  78   3.315   1.615  -6.903
  619   1HG2  VAL  78          1HG2      VAL  78   2.151   2.122  -3.569
  620   2HG2  VAL  78          2HG2      VAL  78   2.445   2.944  -5.102
  621   3HG2  VAL  78          3HG2      VAL  78   3.646   3.025  -3.812
  622    H    ILE  79           H        ILE  79   2.624  -2.448  -4.135
  623    HA   ILE  79           HA       ILE  79   5.315  -3.436  -4.780
  624    HB   ILE  79           HB       ILE  79   3.046  -5.305  -4.270
  625   1HG1  ILE  79          2HG1      ILE  79   4.541  -3.927  -2.037
  626   2HG1  ILE  79          1HG1      ILE  79   2.891  -3.536  -2.508
  627   1HG2  ILE  79          1HG2      ILE  79   4.801  -6.671  -4.468
  628   2HG2  ILE  79          2HG2      ILE  79   5.258  -6.127  -2.855
  629   3HG2  ILE  79          3HG2      ILE  79   5.956  -5.351  -4.276
  630   1HD1  ILE  79          1HD1      ILE  79   3.275  -5.110  -0.519
  631   2HD1  ILE  79          2HD1      ILE  79   3.643  -6.325  -1.744
  632   3HD1  ILE  79          3HD1      ILE  79   2.060  -5.548  -1.719
  633    H    THR  80           H        THR  80   4.846  -5.705  -6.163
  634    HA   THR  80           HA       THR  80   4.471  -6.519  -8.248
  635    HB   THR  80           HB       THR  80   2.112  -5.173  -9.076
  636    HG1  THR  80           1HG      THR  80   1.605  -4.426  -7.118
  637   1HG2  THR  80          1HG2      THR  80   1.739  -7.300  -9.549
  638   2HG2  THR  80          2HG2      THR  80   1.281  -7.505  -7.859
  639   3HG2  THR  80          3HG2      THR  80   2.933  -7.849  -8.372
  640    H    GLY  81           H        GLY  81   4.334  -5.941 -10.570
  641   1HA   GLY  81          2HA       GLY  81   5.446  -3.237 -10.983
  642   2HA   GLY  81          1HA       GLY  81   5.860  -4.642 -11.954
  643    H    HIS  82           H        HIS  82   5.331  -3.433 -13.837
  644    HA   HIS  82           HA       HIS  82   2.575  -3.731 -14.601
  645   1HB   HIS  82          2HB       HIS  82   3.268  -1.285 -13.496
  646   2HB   HIS  82          1HB       HIS  82   3.378  -0.996 -15.229
  647    HD1  HIS  82           1HD      HIS  82   1.066  -2.223 -16.466
  648    HD2  HIS  82           2HD      HIS  82   0.806  -0.623 -12.640
  649    HE1  HIS  82           1HE      HIS  82  -1.380  -1.775 -16.089
  650    HE2  HIS  82           2HE      HIS  82  -1.522  -0.882 -13.737
  651    H    GLY  83           H        GLY  83   5.194  -4.725 -15.418
  652   1HA   GLY  83          2HA       GLY  83   5.301  -5.357 -17.855
  653   2HA   GLY  83          1HA       GLY  83   5.313  -3.627 -18.158
  654    H    SER  84           H        SER  84   7.196  -2.481 -17.947
  655    HA   SER  84           HA       SER  84   9.615  -4.103 -17.650
  656   1HB   SER  84          2HB       SER  84   9.623  -1.241 -18.553
  657   2HB   SER  84          1HB       SER  84  10.728  -2.547 -18.980
  658    HG   SER  84           HG       SER  84   8.937  -3.496 -20.133
  659    H    VAL  85           H        VAL  85   8.166  -3.423 -15.308
  660    HA   VAL  85           HA       VAL  85   8.335  -2.405 -13.267
  661    HB   VAL  85           HB       VAL  85  10.576  -2.512 -12.267
  662   1HG1  VAL  85          1HG1      VAL  85   9.933  -4.907 -13.982
  663   2HG1  VAL  85          2HG1      VAL  85   9.199  -4.532 -12.423
  664   3HG1  VAL  85          3HG1      VAL  85  10.919  -4.907 -12.521
  665   1HG2  VAL  85          1HG2      VAL  85  12.520  -3.086 -13.497
  666   2HG2  VAL  85          2HG2      VAL  85  11.758  -1.752 -14.363
  667   3HG2  VAL  85          3HG2      VAL  85  11.586  -3.403 -14.959
  668    H    ASP  86           H        ASP  86   8.251  -0.530 -15.503
  669    HA   ASP  86           HA       ASP  86  10.092   1.596 -14.883
  670   1HB   ASP  86          2HB       ASP  86   7.593   1.687 -16.592
  671   2HB   ASP  86          1HB       ASP  86   8.900   2.868 -16.580
  672    H    THR  87           H        THR  87   6.545   1.178 -14.552
  673    HA   THR  87           HA       THR  87   5.915   3.540 -13.309
  674    HB   THR  87           HB       THR  87   4.431   1.467 -13.932
  675    HG1  THR  87           1HG      THR  87   2.817   2.297 -12.527
  676   1HG2  THR  87          1HG2      THR  87   5.349  -0.090 -12.280
  677   2HG2  THR  87          2HG2      THR  87   3.627   0.198 -12.033
  678   3HG2  THR  87          3HG2      THR  87   4.811   0.978 -10.984
  679    H    ALA  88           H        ALA  88   7.553   0.760 -12.010
  680    HA   ALA  88           HA       ALA  88   7.407   1.329  -9.275
  681   1HB   ALA  88          1HB       ALA  88   9.732   0.047 -10.701
  682   2HB   ALA  88          2HB       ALA  88   8.233  -0.797 -10.316
  683   3HB   ALA  88          3HB       ALA  88   9.251  -0.172  -9.021
  684    H    VAL  89           H        VAL  89  10.079   1.965 -11.527
  685    HA   VAL  89           HA       VAL  89  11.491   3.652  -9.757
  686    HB   VAL  89           HB       VAL  89  12.897   4.211 -11.646
  687   1HG1  VAL  89          1HG1      VAL  89  13.623   2.170 -10.976
  688   2HG1  VAL  89          2HG1      VAL  89  13.078   1.721 -12.592
  689   3HG1  VAL  89          3HG1      VAL  89  12.046   1.415 -11.196
  690   1HG2  VAL  89          1HG2      VAL  89  12.391   3.684 -13.908
  691   2HG2  VAL  89          2HG2      VAL  89  10.984   4.526 -13.259
  692   3HG2  VAL  89          3HG2      VAL  89  10.956   2.773 -13.444
  693    H    LYS  90           H        LYS  90   8.860   4.192 -11.939
  694    HA   LYS  90           HA       LYS  90   9.223   7.055 -12.060
  695   1HB   LYS  90          2HB       LYS  90   8.256   5.789 -13.950
  696   2HB   LYS  90          1HB       LYS  90   6.884   5.358 -12.940
  697   1HG   LYS  90          2HG       LYS  90   6.143   7.608 -12.836
  698   2HG   LYS  90          1HG       LYS  90   7.637   8.199 -13.566
  699   1HD   LYS  90          2HD       LYS  90   6.093   6.211 -15.121
  700   2HD   LYS  90          1HD       LYS  90   5.376   7.816 -14.955
  701   1HE   LYS  90          2HE       LYS  90   7.152   8.856 -16.045
  702   2HE   LYS  90          1HE       LYS  90   8.240   7.495 -15.774
  703   1HZ   LYS  90          1HZ       LYS  90   7.735   7.110 -17.928
  704   2HZ   LYS  90          2HZ       LYS  90   6.235   7.886 -17.852
  705   3HZ   LYS  90          3HZ       LYS  90   6.403   6.313 -17.256
  706    H    ALA  91           H        ALA  91   7.664   4.801  -9.986
  707    HA   ALA  91           HA       ALA  91   5.969   6.896  -8.826
  708   1HB   ALA  91          1HB       ALA  91   4.977   4.940  -7.549
  709   2HB   ALA  91          2HB       ALA  91   5.923   3.900  -8.614
  710   3HB   ALA  91          3HB       ALA  91   4.698   4.974  -9.289
  711    H    ILE  92           H        ILE  92   8.518   4.587  -7.990
  712    HA   ILE  92           HA       ILE  92   8.560   5.224  -5.225
  713    HB   ILE  92           HB       ILE  92  10.534   3.931  -5.050
  714   1HG1  ILE  92          2HG1      ILE  92  10.824   4.196  -8.051
  715   2HG1  ILE  92          1HG1      ILE  92  11.846   4.966  -6.842
  716   1HG2  ILE  92          1HG2      ILE  92   9.863   2.042  -6.885
  717   2HG2  ILE  92          2HG2      ILE  92   8.379   2.990  -6.798
  718   3HG2  ILE  92          3HG2      ILE  92   9.052   2.274  -5.337
  719   1HD1  ILE  92          1HD1      ILE  92  12.843   2.949  -6.232
  720   2HD1  ILE  92          2HD1      ILE  92  12.723   2.864  -7.989
  721   3HD1  ILE  92          3HD1      ILE  92  11.570   1.987  -6.983
  722    H    LYS  93           H        LYS  93  10.017   6.667  -8.031
  723    HA   LYS  93           HA       LYS  93  12.002   8.162  -6.620
  724   1HB   LYS  93          2HB       LYS  93  11.010   7.979  -9.390
  725   2HB   LYS  93          1HB       LYS  93  11.626   9.561  -8.932
  726   1HG   LYS  93          2HG       LYS  93  13.352   7.344  -8.128
  727   2HG   LYS  93          1HG       LYS  93  13.128   7.489  -9.872
  728   1HD   LYS  93          2HD       LYS  93  13.652   9.975  -9.542
  729   2HD   LYS  93          1HD       LYS  93  14.247   9.506  -7.949
  730   1HE   LYS  93          2HE       LYS  93  15.247   7.845 -10.145
  731   2HE   LYS  93          1HE       LYS  93  15.731   9.539 -10.243
  732   1HZ   LYS  93          1HZ       LYS  93  17.016   9.371  -8.412
  733   2HZ   LYS  93          2HZ       LYS  93  17.067   7.737  -8.845
  734   3HZ   LYS  93          3HZ       LYS  93  15.999   8.259  -7.642
  735    H    LYS  94           H        LYS  94   8.666   8.674  -7.520
  736    HA   LYS  94           HA       LYS  94   8.503  11.444  -7.165
  737   1HB   LYS  94          2HB       LYS  94   6.758   9.847  -8.128
  738   2HB   LYS  94          1HB       LYS  94   6.294   9.531  -6.461
  739   1HG   LYS  94          2HG       LYS  94   5.314  11.554  -6.203
  740   2HG   LYS  94          1HG       LYS  94   6.448  12.365  -7.285
  741   1HD   LYS  94          2HD       LYS  94   4.982  10.520  -8.848
  742   2HD   LYS  94          1HD       LYS  94   3.820  11.381  -7.838
  743   1HE   LYS  94          2HE       LYS  94   3.993  12.691  -9.767
  744   2HE   LYS  94          1HE       LYS  94   5.020  13.511  -8.591
  745   1HZ   LYS  94          1HZ       LYS  94   6.954  12.602  -9.604
  746   2HZ   LYS  94          2HZ       LYS  94   6.012  13.271 -10.840
  747   3HZ   LYS  94          3HZ       LYS  94   6.043  11.595 -10.613
  748    H    GLY  95           H        GLY  95   7.387   8.958  -4.857
  749   1HA   GLY  95          2HA       GLY  95   8.712  10.126  -2.638
  750   2HA   GLY  95          1HA       GLY  95   7.040  10.659  -2.686
  751    H    ALA  96           H        ALA  96   8.007   7.484  -3.803
  752    HA   ALA  96           HA       ALA  96   6.323   6.299  -1.748
  753   1HB   ALA  96          1HB       ALA  96   5.926   4.639  -3.201
  754   2HB   ALA  96          2HB       ALA  96   7.630   4.472  -3.624
  755   3HB   ALA  96          3HB       ALA  96   6.647   5.716  -4.397
  756    H    TYR  97           H        TYR  97   7.438   3.803  -1.471
  757    HA   TYR  97           HA       TYR  97   9.982   4.386  -0.101
  758   1HB   TYR  97          2HB       TYR  97   8.153   3.968   1.467
  759   2HB   TYR  97          1HB       TYR  97   7.815   2.430   0.686
  760    HD1  TYR  97           1HD      TYR  97  10.535   4.260   2.463
  761    HD2  TYR  97           2HD      TYR  97   8.818   0.491   1.492
  762    HE1  TYR  97           1HE      TYR  97  12.122   3.153   3.980
  763    HE2  TYR  97           2HE      TYR  97  10.399  -0.627   3.006
  764    HH   TYR  97           HH       TYR  97  13.142   0.795   4.177
  765    H    GLU  98           H        GLU  98   9.453   3.418  -2.834
  766    HA   GLU  98           HA       GLU  98  10.691   2.128  -4.268
  767   1HB   GLU  98          2HB       GLU  98  12.455   0.876  -3.584
  768   2HB   GLU  98          1HB       GLU  98  12.205   1.779  -2.102
  769   1HG   GLU  98          2HG       GLU  98  10.604  -0.320  -1.615
  770   2HG   GLU  98          1HG       GLU  98  11.777  -1.083  -2.685
  771    H    PHE  99           H        PHE  99  10.234   0.320  -5.485
  772    HA   PHE  99           HA       PHE  99   7.692  -0.902  -4.927
  773   1HB   PHE  99          2HB       PHE  99   9.473  -0.592  -7.216
  774   2HB   PHE  99          1HB       PHE  99   8.751  -2.193  -7.142
  775    HD1  PHE  99           1HD      PHE  99   7.359   1.133  -6.208
  776    HD2  PHE  99           2HD      PHE  99   7.126  -2.253  -8.777
  777    HE1  PHE  99           1HE      PHE  99   5.291   2.030  -7.199
  778    HE2  PHE  99           2HE      PHE  99   5.058  -1.361  -9.773
  779    HZ   PHE  99           HZ       PHE  99   4.140   0.782  -8.981
  780    H    LEU 100           H        LEU 100   7.665  -2.452  -3.410
  781    HA   LEU 100           HA       LEU 100   9.775  -4.115  -2.681
  782   1HB   LEU 100          2HB       LEU 100   7.493  -3.610  -1.541
  783   2HB   LEU 100          1HB       LEU 100   6.918  -4.982  -2.464
  784    HG   LEU 100           HG       LEU 100   8.405  -6.475  -1.336
  785   1HD1  LEU 100          1HD1      LEU 100   9.873  -5.564   0.519
  786   2HD1  LEU 100          2HD1      LEU 100   9.624  -3.973  -0.199
  787   3HD1  LEU 100          3HD1      LEU 100  10.407  -5.248  -1.132
  788   1HD2  LEU 100          1HD2      LEU 100   7.636  -4.987   1.053
  789   2HD2  LEU 100          2HD2      LEU 100   7.146  -6.589   0.504
  790   3HD2  LEU 100          3HD2      LEU 100   6.335  -5.156  -0.125
  791    H    GLU 101           H        GLU 101   9.735  -6.551  -2.840
  792    HA   GLU 101           HA       GLU 101  10.028  -7.345  -5.506
  793   1HB   GLU 101          2HB       GLU 101   9.996  -8.730  -2.875
  794   2HB   GLU 101          1HB       GLU 101   9.789  -9.726  -4.309
  795   1HG   GLU 101          2HG       GLU 101  11.897  -8.361  -5.125
  796   2HG   GLU 101          1HG       GLU 101  12.150  -8.186  -3.389
  797    H    LYS 102           H        LYS 102   8.680  -8.184  -6.983
  798    HA   LYS 102           HA       LYS 102   5.859  -8.233  -6.392
  799   1HB   LYS 102          2HB       LYS 102   7.042  -9.128  -9.000
  800   2HB   LYS 102          1HB       LYS 102   5.494  -8.355  -8.698
  801   1HG   LYS 102          2HG       LYS 102   6.658  -6.262  -8.162
  802   2HG   LYS 102          1HG       LYS 102   8.199  -7.043  -8.518
  803   1HD   LYS 102          2HD       LYS 102   6.097  -7.192 -10.601
  804   2HD   LYS 102          1HD       LYS 102   6.846  -5.618 -10.328
  805   1HE   LYS 102          2HE       LYS 102   8.362  -8.169 -10.861
  806   2HE   LYS 102          1HE       LYS 102   7.964  -6.966 -12.088
  807   1HZ   LYS 102          1HZ       LYS 102   9.831  -6.742  -9.818
  808   2HZ   LYS 102          2HZ       LYS 102   9.158  -5.352 -10.509
  809   3HZ   LYS 102          3HZ       LYS 102  10.097  -6.396 -11.452
  810    HA   PRO 103           HA       PRO 103   6.407 -12.892  -7.267
  811   1HB   PRO 103          2HB       PRO 103   8.824 -13.949  -7.678
  812   2HB   PRO 103          1HB       PRO 103   7.970 -13.094  -8.969
  813   1HG   PRO 103          2HG       PRO 103  10.202 -12.148  -7.223
  814   2HG   PRO 103          1HG       PRO 103   9.939 -11.873  -8.953
  815   1HD   PRO 103          2HD       PRO 103   9.320 -10.070  -6.942
  816   2HD   PRO 103          1HD       PRO 103   8.621 -10.057  -8.571
  817    H    PHE 104           H        PHE 104   6.389 -11.755  -4.784
  818    HA   PHE 104           HA       PHE 104   7.956 -13.675  -3.195
  819   1HB   PHE 104          2HB       PHE 104   8.410 -10.982  -3.162
  820   2HB   PHE 104          1HB       PHE 104   7.253 -11.151  -1.846
  821    HD1  PHE 104           1HD      PHE 104  10.651 -11.648  -2.912
  822    HD2  PHE 104           2HD      PHE 104   7.776 -12.706   0.042
  823    HE1  PHE 104           1HE      PHE 104  12.461 -12.397  -1.425
  824    HE2  PHE 104           2HE      PHE 104   9.581 -13.457   1.535
  825    HZ   PHE 104           HZ       PHE 104  11.928 -13.303   0.803
  826    H    SER 105           H        SER 105   7.001 -14.166  -1.075
  827    HA   SER 105           HA       SER 105   4.159 -14.581  -1.343
  828   1HB   SER 105          2HB       SER 105   5.621 -15.285   1.163
  829   2HB   SER 105          1HB       SER 105   4.373 -16.183   0.300
  830    HG   SER 105           HG       SER 105   5.979 -16.596  -1.329
  831    H    VAL 106           H        VAL 106   6.146 -13.272   1.320
  832    HA   VAL 106           HA       VAL 106   4.729 -10.882   1.628
  833    HB   VAL 106           HB       VAL 106   2.856 -12.393   2.236
  834   1HG1  VAL 106          1HG1      VAL 106   4.103 -13.049   4.836
  835   2HG1  VAL 106          2HG1      VAL 106   4.662 -13.956   3.432
  836   3HG1  VAL 106          3HG1      VAL 106   2.955 -13.966   3.863
  837   1HG2  VAL 106          1HG2      VAL 106   2.356 -11.285   4.449
  838   2HG2  VAL 106          2HG2      VAL 106   2.757 -10.198   3.120
  839   3HG2  VAL 106          3HG2      VAL 106   3.962 -10.562   4.354
  840    H    GLU 107           H        GLU 107   6.504 -13.476   3.191
  841    HA   GLU 107           HA       GLU 107   7.412 -12.468   5.507
  842   1HB   GLU 107          2HB       GLU 107   8.087 -14.618   4.279
  843   2HB   GLU 107          1HB       GLU 107   9.376 -13.655   3.573
  844   1HG   GLU 107          2HG       GLU 107   9.810 -13.040   6.105
  845   2HG   GLU 107          1HG       GLU 107   9.007 -14.589   6.360
  846    H    ARG 108           H        ARG 108   8.506 -11.450   2.310
  847    HA   ARG 108           HA       ARG 108  10.585  -9.745   3.259
  848   1HB   ARG 108          2HB       ARG 108  10.469 -10.681   0.943
  849   2HB   ARG 108          1HB       ARG 108   9.113  -9.607   0.621
  850   1HG   ARG 108          2HG       ARG 108  10.896  -8.450  -0.272
  851   2HG   ARG 108          1HG       ARG 108  10.743  -7.727   1.331
  852   1HD   ARG 108          2HD       ARG 108  12.786  -8.398   1.913
  853   2HD   ARG 108          1HD       ARG 108  12.462 -10.050   1.387
  854    HE   ARG 108           HE       ARG 108  12.885  -8.734  -0.938
  855   1HH1  ARG 108          1HH1      ARG 108  14.702  -8.975   2.032
  856   2HH1  ARG 108          2HH1      ARG 108  16.238  -8.781   1.255
  857   1HH2  ARG 108          1HH2      ARG 108  14.904  -8.478  -1.961
  858   2HH2  ARG 108          2HH2      ARG 108  16.352  -8.499  -1.012
  859    H    PHE 109           H        PHE 109   7.205  -9.294   2.388
  860    HA   PHE 109           HA       PHE 109   7.060  -6.512   2.477
  861   1HB   PHE 109          2HB       PHE 109   5.210  -7.769   1.611
  862   2HB   PHE 109          1HB       PHE 109   5.011  -8.637   3.128
  863    HD1  PHE 109           1HD      PHE 109   5.307  -5.020   2.263
  864    HD2  PHE 109           2HD      PHE 109   3.012  -8.093   4.107
  865    HE1  PHE 109           1HE      PHE 109   3.662  -3.346   2.995
  866    HE2  PHE 109           2HE      PHE 109   1.360  -6.424   4.841
  867    HZ   PHE 109           HZ       PHE 109   1.685  -4.046   4.286
  868    H    LEU 110           H        LEU 110   7.250  -8.862   5.032
  869    HA   LEU 110           HA       LEU 110   6.228  -7.486   7.193
  870   1HB   LEU 110          2HB       LEU 110   7.554  -9.834   6.830
  871   2HB   LEU 110          1HB       LEU 110   8.718  -8.908   7.756
  872    HG   LEU 110           HG       LEU 110   5.887  -9.081   8.702
  873   1HD1  LEU 110          1HD1      LEU 110   7.000 -11.034  10.141
  874   2HD1  LEU 110          2HD1      LEU 110   7.878 -11.266   8.629
  875   3HD1  LEU 110          3HD1      LEU 110   6.115 -11.334   8.644
  876   1HD2  LEU 110          1HD2      LEU 110   8.541  -8.358   9.790
  877   2HD2  LEU 110          2HD2      LEU 110   7.428  -9.183  10.882
  878   3HD2  LEU 110          3HD2      LEU 110   6.952  -7.667  10.117
  879    H    LEU 111           H        LEU 111   9.538  -7.355   5.906
  880    HA   LEU 111           HA       LEU 111  10.495  -5.489   7.807
  881   1HB   LEU 111          2HB       LEU 111  11.495  -6.118   5.030
  882   2HB   LEU 111          1HB       LEU 111  12.368  -5.170   6.220
  883    HG   LEU 111           HG       LEU 111  12.069  -7.344   7.691
  884   1HD1  LEU 111          1HD1      LEU 111  11.423  -8.206   4.940
  885   2HD1  LEU 111          2HD1      LEU 111  10.918  -8.876   6.492
  886   3HD1  LEU 111          3HD1      LEU 111  12.524  -9.234   5.856
  887   1HD2  LEU 111          1HD2      LEU 111  14.136  -6.167   6.430
  888   2HD2  LEU 111          2HD2      LEU 111  14.122  -7.728   5.611
  889   3HD2  LEU 111          3HD2      LEU 111  14.280  -7.655   7.366
  890    H    THR 112           H        THR 112   9.468  -5.064   4.416
  891    HA   THR 112           HA       THR 112   9.831  -2.374   4.108
  892    HB   THR 112           HB       THR 112   7.566  -4.114   3.124
  893    HG1  THR 112           1HG      THR 112   9.564  -4.671   2.293
  894   1HG2  THR 112          1HG2      THR 112   7.935  -2.015   1.326
  895   2HG2  THR 112          2HG2      THR 112   7.791  -1.264   2.916
  896   3HG2  THR 112          3HG2      THR 112   6.521  -2.340   2.330
  897    H    ILE 113           H        ILE 113   7.353  -3.996   5.956
  898    HA   ILE 113           HA       ILE 113   5.786  -1.632   6.436
  899    HB   ILE 113           HB       ILE 113   5.743  -4.410   7.605
  900   1HG1  ILE 113          2HG1      ILE 113   4.861  -4.090   5.318
  901   2HG1  ILE 113          1HG1      ILE 113   3.603  -4.570   6.453
  902   1HG2  ILE 113          1HG2      ILE 113   4.346  -1.957   8.538
  903   2HG2  ILE 113          2HG2      ILE 113   4.973  -3.323   9.460
  904   3HG2  ILE 113          3HG2      ILE 113   3.467  -3.486   8.558
  905   1HD1  ILE 113          1HD1      ILE 113   3.728  -1.729   6.376
  906   2HD1  ILE 113          2HD1      ILE 113   2.409  -2.799   5.896
  907   3HD1  ILE 113          3HD1      ILE 113   3.650  -2.347   4.727
  908    H    LYS 114           H        LYS 114   7.479  -3.779   8.726
  909    HA   LYS 114           HA       LYS 114   7.528  -2.117  10.894
  910   1HB   LYS 114          2HB       LYS 114   9.429  -3.395  11.715
  911   2HB   LYS 114          1HB       LYS 114   8.193  -4.436  11.015
  912   1HG   LYS 114          2HG       LYS 114   9.774  -5.330   9.799
  913   2HG   LYS 114          1HG       LYS 114   9.829  -3.812   8.905
  914   1HD   LYS 114          2HD       LYS 114  11.447  -3.021  10.732
  915   2HD   LYS 114          1HD       LYS 114  11.595  -4.728  11.153
  916   1HE   LYS 114          2HE       LYS 114  11.877  -4.139   8.292
  917   2HE   LYS 114          1HE       LYS 114  13.129  -3.435   9.313
  918   1HZ   LYS 114          1HZ       LYS 114  13.668  -5.582  10.165
  919   2HZ   LYS 114          2HZ       LYS 114  13.657  -5.688   8.477
  920   3HZ   LYS 114          3HZ       LYS 114  12.359  -6.300   9.371
  921    H    HIS 115           H        HIS 115   9.316  -1.765   8.000
  922    HA   HIS 115           HA       HIS 115  11.312  -0.033   9.204
  923   1HB   HIS 115          2HB       HIS 115  11.724  -1.694   7.277
  924   2HB   HIS 115          1HB       HIS 115  10.967  -0.475   6.257
  925    HD1  HIS 115           1HD      HIS 115  12.342   1.938   7.918
  926    HD2  HIS 115           2HD      HIS 115  14.235  -1.294   6.116
  927    HE1  HIS 115           1HE      HIS 115  14.707   2.687   7.508
  928    HE2  HIS 115           2HE      HIS 115  15.856   0.685   6.497
  929    H    ALA 116           H        ALA 116   8.337   0.166   7.428
  930    HA   ALA 116           HA       ALA 116   8.622   2.916   6.654
  931   1HB   ALA 116          1HB       ALA 116   5.930   1.697   6.817
  932   2HB   ALA 116          2HB       ALA 116   7.086   0.945   5.719
  933   3HB   ALA 116          3HB       ALA 116   6.671   2.648   5.530
  934    H    PHE 117           H        PHE 117   7.145   1.172   9.328
  935    HA   PHE 117           HA       PHE 117   5.855   3.507  10.407
  936   1HB   PHE 117          2HB       PHE 117   6.232   0.686  11.383
  937   2HB   PHE 117          1HB       PHE 117   5.538   1.928  12.419
  938    HD1  PHE 117           1HD      PHE 117   3.339   2.828  11.981
  939    HD2  PHE 117           2HD      PHE 117   5.033  -0.143   9.450
  940    HE1  PHE 117           1HE      PHE 117   1.128   2.427  10.981
  941    HE2  PHE 117           2HE      PHE 117   2.829  -0.550   8.446
  942    HZ   PHE 117           HZ       PHE 117   0.871   0.740   9.211
  943    H    GLU 118           H        GLU 118   8.691   1.546  11.260
  944    HA   GLU 118           HA       GLU 118   9.440   2.839  13.591
  945   1HB   GLU 118          2HB       GLU 118  11.056   1.468  11.464
  946   2HB   GLU 118          1HB       GLU 118  11.806   2.146  12.903
  947   1HG   GLU 118          2HG       GLU 118  10.580   0.678  14.324
  948   2HG   GLU 118          1HG       GLU 118   9.594   0.113  12.977
  949    H    GLU 119           H        GLU 119  10.465   3.582  10.264
  950    HA   GLU 119           HA       GLU 119  11.898   5.929  11.097
  951   1HB   GLU 119          2HB       GLU 119  11.181   4.858   8.372
  952   2HB   GLU 119          1HB       GLU 119  12.145   6.306   8.630
  953   1HG   GLU 119          2HG       GLU 119  13.073   3.911  10.054
  954   2HG   GLU 119          1HG       GLU 119  13.165   3.833   8.296
  955    H    TYR 120           H        TYR 120   8.661   5.332  10.766
  956    HA   TYR 120           HA       TYR 120   8.111   8.186  10.460
  957   1HB   TYR 120          2HB       TYR 120   7.647   6.390   8.387
  958   2HB   TYR 120          1HB       TYR 120   6.069   6.582   9.143
  959    HD1  TYR 120           1HD      TYR 120   4.827   7.949   7.735
  960    HD2  TYR 120           2HD      TYR 120   8.837   9.035   8.651
  961    HE1  TYR 120           1HE      TYR 120   4.517  10.077   6.542
  962    HE2  TYR 120           2HE      TYR 120   8.537  11.166   7.462
  963    HH   TYR 120           HH       TYR 120   5.583  12.409   6.628
  964    H    SER 121           H        SER 121   8.175   6.819  12.838
  965    HA   SER 121           HA       SER 121   5.420   6.134  13.516
  966   1HB   SER 121          2HB       SER 121   7.304   4.708  14.323
  967   2HB   SER 121          1HB       SER 121   7.881   6.073  15.278
  968    HG   SER 121           HG       SER 121   5.725   6.036  16.264
  Start of MODEL   25
    1   1H    MET   1          1HT       MET   1  -3.370  -1.254  17.573
    2   2H    MET   1          2HT       MET   1  -4.665  -0.313  16.951
    3   3H    MET   1          3HT       MET   1  -3.987   0.062  18.482
    4    HA   MET   1           HA       MET   1  -3.340   1.505  16.580
    5   1HB   MET   1          2HB       MET   1  -1.066   1.681  17.441
    6   2HB   MET   1          1HB       MET   1  -2.191   1.390  18.760
    7   1HG   MET   1          2HG       MET   1  -1.490  -0.835  19.011
    8   2HG   MET   1          1HG       MET   1  -0.657  -0.833  17.458
    9   1HE   MET   1          1HE       MET   1   1.383  -1.830  18.253
   10   2HE   MET   1          2HE       MET   1   2.712  -0.883  18.919
   11   3HE   MET   1          3HE       MET   1   2.024  -0.455  17.353
   12    H    LYS   2           H        LYS   2  -1.423   1.705  15.074
   13    HA   LYS   2           HA       LYS   2  -0.329   1.086  13.180
   14   1HB   LYS   2          2HB       LYS   2  -0.438  -1.712  14.316
   15   2HB   LYS   2          1HB       LYS   2   0.648  -1.131  13.062
   16   1HG   LYS   2          2HG       LYS   2   0.612  -0.132  15.901
   17   2HG   LYS   2          1HG       LYS   2   1.727  -1.343  15.267
   18   1HD   LYS   2          2HD       LYS   2   1.821   0.868  13.509
   19   2HD   LYS   2          1HD       LYS   2   1.906   1.511  15.150
   20   1HE   LYS   2          2HE       LYS   2   3.581  -0.854  14.551
   21   2HE   LYS   2          1HE       LYS   2   4.055   0.668  13.795
   22   1HZ   LYS   2          1HZ       LYS   2   3.421   0.777  16.632
   23   2HZ   LYS   2          2HZ       LYS   2   4.638   1.567  15.764
   24   3HZ   LYS   2          3HZ       LYS   2   4.839  -0.049  16.218
   25    H    ARG   3           H        ARG   3  -1.108   0.897  11.185
   26    HA   ARG   3           HA       ARG   3  -2.894  -1.204  10.402
   27   1HB   ARG   3          2HB       ARG   3  -4.516   0.795   9.561
   28   2HB   ARG   3          1HB       ARG   3  -4.775  -0.126  11.033
   29   1HG   ARG   3          2HG       ARG   3  -5.041   2.160  11.574
   30   2HG   ARG   3          1HG       ARG   3  -3.503   1.639  12.263
   31   1HD   ARG   3          2HD       ARG   3  -2.266   2.727  10.571
   32   2HD   ARG   3          1HD       ARG   3  -3.700   2.968   9.574
   33    HE   ARG   3           HE       ARG   3  -4.177   4.854  10.778
   34   1HH1  ARG   3          1HH1      ARG   3  -1.825   2.965  12.533
   35   2HH1  ARG   3          2HH1      ARG   3  -1.542   4.193  13.722
   36   1HH2  ARG   3          1HH2      ARG   3  -3.807   6.469  12.343
   37   2HH2  ARG   3          2HH2      ARG   3  -2.665   6.181  13.613
   38    H    VAL   4           H        VAL   4  -2.492  -1.666   8.313
   39    HA   VAL   4           HA       VAL   4  -1.295   0.461   6.649
   40    HB   VAL   4           HB       VAL   4  -0.835  -2.513   6.371
   41   1HG1  VAL   4          1HG1      VAL   4   1.168  -0.890   5.154
   42   2HG1  VAL   4          2HG1      VAL   4  -0.413  -0.352   4.592
   43   3HG1  VAL   4          3HG1      VAL   4   0.064  -2.038   4.396
   44   1HG2  VAL   4          1HG2      VAL   4   1.026  -0.415   7.490
   45   2HG2  VAL   4          2HG2      VAL   4   1.377  -2.132   7.292
   46   3HG2  VAL   4          3HG2      VAL   4   0.152  -1.610   8.448
   47    H    LEU   5           H        LEU   5  -2.028   0.701   4.544
   48    HA   LEU   5           HA       LEU   5  -4.597  -0.575   3.989
   49   1HB   LEU   5          2HB       LEU   5  -4.283   1.942   3.919
   50   2HB   LEU   5          1HB       LEU   5  -3.331   1.693   2.467
   51    HG   LEU   5           HG       LEU   5  -5.266   0.709   1.341
   52   1HD1  LEU   5          1HD1      LEU   5  -7.505   1.111   2.606
   53   2HD1  LEU   5          2HD1      LEU   5  -6.488   1.022   4.045
   54   3HD1  LEU   5          3HD1      LEU   5  -6.558  -0.342   2.928
   55   1HD2  LEU   5          1HD2      LEU   5  -6.782   2.808   1.520
   56   2HD2  LEU   5          2HD2      LEU   5  -5.143   2.975   0.893
   57   3HD2  LEU   5          3HD2      LEU   5  -5.500   3.431   2.558
   58    H    VAL   6           H        VAL   6  -4.909  -1.986   2.382
   59    HA   VAL   6           HA       VAL   6  -2.650  -2.491   0.555
   60    HB   VAL   6           HB       VAL   6  -4.728  -4.506   1.398
   61   1HG1  VAL   6          1HG1      VAL   6  -3.798  -5.073  -0.710
   62   2HG1  VAL   6          2HG1      VAL   6  -3.005  -6.096   0.488
   63   3HG1  VAL   6          3HG1      VAL   6  -2.165  -4.692  -0.167
   64   1HG2  VAL   6          1HG2      VAL   6  -3.193  -5.414   2.949
   65   2HG2  VAL   6          2HG2      VAL   6  -3.230  -3.679   3.262
   66   3HG2  VAL   6          3HG2      VAL   6  -1.884  -4.384   2.368
   67    H    VAL   7           H        VAL   7  -3.401  -1.084  -1.048
   68    HA   VAL   7           HA       VAL   7  -6.060  -1.455  -2.118
   69    HB   VAL   7           HB       VAL   7  -3.849   0.276  -3.227
   70   1HG1  VAL   7          1HG1      VAL   7  -6.201  -0.430  -4.396
   71   2HG1  VAL   7          2HG1      VAL   7  -5.312   1.056  -4.729
   72   3HG1  VAL   7          3HG1      VAL   7  -6.643   1.066  -3.573
   73   1HG2  VAL   7          1HG2      VAL   7  -6.057   1.077  -1.338
   74   2HG2  VAL   7          2HG2      VAL   7  -4.788   2.116  -1.989
   75   3HG2  VAL   7          3HG2      VAL   7  -4.376   0.819  -0.868
   76    H    ASP   8           H        ASP   8  -6.476  -3.094  -3.412
   77    HA   ASP   8           HA       ASP   8  -4.694  -3.638  -5.649
   78   1HB   ASP   8          2HB       ASP   8  -3.879  -5.196  -3.998
   79   2HB   ASP   8          1HB       ASP   8  -5.513  -5.721  -3.612
   80    H    ASP   9           H        ASP   9  -5.767  -4.207  -7.473
   81    HA   ASP   9           HA       ASP   9  -8.457  -3.693  -7.775
   82   1HB   ASP   9          2HB       ASP   9  -6.979  -3.760  -9.683
   83   2HB   ASP   9          1HB       ASP   9  -6.670  -5.475  -9.442
   84    H    GLU  10           H        GLU  10  -6.950  -6.578  -6.594
   85    HA   GLU  10           HA       GLU  10  -8.938  -8.470  -7.118
   86   1HB   GLU  10          2HB       GLU  10  -6.518  -8.526  -5.881
   87   2HB   GLU  10          1HB       GLU  10  -7.593  -8.680  -4.499
   88   1HG   GLU  10          2HG       GLU  10  -8.725 -10.515  -6.001
   89   2HG   GLU  10          1HG       GLU  10  -7.138 -10.541  -6.769
   90    H    GLU  11           H        GLU  11  -9.704  -9.476  -4.606
   91    HA   GLU  11           HA       GLU  11 -11.202  -7.346  -3.297
   92   1HB   GLU  11          2HB       GLU  11 -12.464  -8.537  -5.317
   93   2HB   GLU  11          1HB       GLU  11 -12.795  -9.738  -4.076
   94   1HG   GLU  11          2HG       GLU  11 -13.572  -7.697  -2.675
   95   2HG   GLU  11          1HG       GLU  11 -13.681  -6.894  -4.242
   96    H    SER  12           H        SER  12 -11.987  -7.884  -1.236
   97    HA   SER  12           HA       SER  12 -11.888  -8.857   0.815
   98   1HB   SER  12          2HB       SER  12 -11.639 -11.519  -0.578
   99   2HB   SER  12          1HB       SER  12 -12.415 -11.158   0.964
  100    HG   SER  12           HG       SER  12 -13.809 -11.465  -0.966
  101    H    ILE  13           H        ILE  13  -9.740  -7.873   1.034
  102    HA   ILE  13           HA       ILE  13  -7.559  -7.836   1.547
  103    HB   ILE  13           HB       ILE  13  -7.973 -10.667   2.330
  104   1HG1  ILE  13          2HG1      ILE  13  -9.814  -9.169   3.160
  105   2HG1  ILE  13          1HG1      ILE  13  -8.903  -9.995   4.419
  106   1HG2  ILE  13          1HG2      ILE  13  -5.744 -10.261   2.678
  107   2HG2  ILE  13          2HG2      ILE  13  -6.416  -9.801   4.243
  108   3HG2  ILE  13          3HG2      ILE  13  -6.013  -8.560   3.056
  109   1HD1  ILE  13          1HD1      ILE  13  -7.512  -7.796   4.463
  110   2HD1  ILE  13          2HD1      ILE  13  -9.078  -7.877   5.270
  111   3HD1  ILE  13          3HD1      ILE  13  -8.939  -7.111   3.688
  112    H    THR  14           H        THR  14  -5.448  -8.652   1.139
  113    HA   THR  14           HA       THR  14  -5.242  -9.935  -1.470
  114    HB   THR  14           HB       THR  14  -2.867  -9.204  -1.371
  115    HG1  THR  14           1HG      THR  14  -3.614  -7.911   1.035
  116   1HG2  THR  14          1HG2      THR  14  -3.204  -6.860  -1.617
  117   2HG2  THR  14          2HG2      THR  14  -4.705  -6.924  -0.693
  118   3HG2  THR  14          3HG2      THR  14  -4.614  -7.685  -2.282
  119    H    SER  15           H        SER  15  -4.024 -11.824  -1.834
  120    HA   SER  15           HA       SER  15  -4.078 -13.714   0.271
  121   1HB   SER  15          2HB       SER  15  -3.992 -13.871  -2.458
  122   2HB   SER  15          1HB       SER  15  -2.355 -14.365  -2.024
  123    HG   SER  15           HG       SER  15  -3.481 -15.812  -0.468
  124    H    SER  16           H        SER  16  -2.532 -14.492   1.590
  125    HA   SER  16           HA       SER  16  -0.473 -14.879   2.521
  126   1HB   SER  16          2HB       SER  16   0.924 -12.951   0.712
  127   2HB   SER  16          1HB       SER  16   1.502 -14.469   1.397
  128    HG   SER  16           HG       SER  16   0.134 -15.567  -0.052
  129    H    LEU  17           H        LEU  17  -1.850 -11.784   2.043
  130    HA   LEU  17           HA       LEU  17  -0.088 -10.457   3.923
  131   1HB   LEU  17          2HB       LEU  17  -1.983  -9.661   1.923
  132   2HB   LEU  17          1HB       LEU  17  -2.425  -8.916   3.440
  133    HG   LEU  17           HG       LEU  17  -0.572  -7.977   1.581
  134   1HD1  LEU  17          1HD1      LEU  17  -0.642  -6.098   2.837
  135   2HD1  LEU  17          2HD1      LEU  17  -0.445  -6.969   4.358
  136   3HD1  LEU  17          3HD1      LEU  17  -2.013  -6.947   3.552
  137   1HD2  LEU  17          1HD2      LEU  17   1.554  -7.923   2.645
  138   2HD2  LEU  17          2HD2      LEU  17   1.063  -9.614   2.542
  139   3HD2  LEU  17          3HD2      LEU  17   0.930  -8.748   4.073
  140    H    SER  18           H        SER  18  -3.522 -11.372   3.783
  141    HA   SER  18           HA       SER  18  -4.398 -10.508   6.224
  142   1HB   SER  18          2HB       SER  18  -5.488 -12.024   4.265
  143   2HB   SER  18          1HB       SER  18  -5.275 -13.246   5.519
  144    HG   SER  18           HG       SER  18  -7.163 -11.393   5.342
  145    H    ALA  19           H        ALA  19  -2.940 -13.697   5.588
  146    HA   ALA  19           HA       ALA  19  -2.934 -14.638   8.210
  147   1HB   ALA  19          1HB       ALA  19  -1.467 -15.290   5.727
  148   2HB   ALA  19          2HB       ALA  19  -2.409 -16.329   6.797
  149   3HB   ALA  19          3HB       ALA  19  -0.766 -15.869   7.238
  150    H    ILE  20           H        ILE  20  -0.579 -12.664   6.486
  151    HA   ILE  20           HA       ILE  20   1.408 -12.679   8.507
  152    HB   ILE  20           HB       ILE  20   0.884 -10.809   6.202
  153   1HG1  ILE  20          2HG1      ILE  20   3.073 -12.838   6.656
  154   2HG1  ILE  20          1HG1      ILE  20   1.608 -13.147   5.729
  155   1HG2  ILE  20          1HG2      ILE  20   2.775 -10.544   8.437
  156   2HG2  ILE  20          2HG2      ILE  20   2.112  -9.320   7.355
  157   3HG2  ILE  20          3HG2      ILE  20   3.462 -10.324   6.828
  158   1HD1  ILE  20          1HD1      ILE  20   3.540 -12.624   4.316
  159   2HD1  ILE  20          2HD1      ILE  20   3.650 -11.038   5.078
  160   3HD1  ILE  20          3HD1      ILE  20   2.229 -11.462   4.125
  161    H    LEU  21           H        LEU  21  -0.546  -9.876   7.472
  162    HA   LEU  21           HA       LEU  21  -0.075  -8.215   9.586
  163   1HB   LEU  21          2HB       LEU  21  -2.747  -8.563   8.236
  164   2HB   LEU  21          1HB       LEU  21  -2.180  -7.131   9.077
  165    HG   LEU  21           HG       LEU  21  -0.363  -7.942   6.959
  166   1HD1  LEU  21          1HD1      LEU  21  -1.757  -8.366   5.301
  167   2HD1  LEU  21          2HD1      LEU  21  -2.463  -6.765   5.502
  168   3HD1  LEU  21          3HD1      LEU  21  -3.144  -8.143   6.366
  169   1HD2  LEU  21          1HD2      LEU  21  -1.839  -5.441   7.726
  170   2HD2  LEU  21          2HD2      LEU  21  -0.774  -5.533   6.322
  171   3HD2  LEU  21          3HD2      LEU  21  -0.128  -5.813   7.939
  172    H    GLU  22           H        GLU  22  -2.142 -11.025   9.506
  173    HA   GLU  22           HA       GLU  22  -3.570 -10.510  11.901
  174   1HB   GLU  22          2HB       GLU  22  -3.160 -12.844  10.122
  175   2HB   GLU  22          1HB       GLU  22  -3.712 -13.164  11.760
  176   1HG   GLU  22          2HG       GLU  22  -5.358 -11.126  10.966
  177   2HG   GLU  22          1HG       GLU  22  -5.145 -12.053   9.482
  178    H    GLU  23           H        GLU  23  -0.461 -11.929  11.182
  179    HA   GLU  23           HA       GLU  23  -0.099 -13.018  13.824
  180   1HB   GLU  23          2HB       GLU  23   1.024 -14.206  12.123
  181   2HB   GLU  23          1HB       GLU  23   1.648 -12.736  11.389
  182   1HG   GLU  23          2HG       GLU  23   3.468 -12.744  12.661
  183   2HG   GLU  23          1HG       GLU  23   2.552 -13.097  14.124
  184    H    GLU  24           H        GLU  24   0.793 -10.135  12.043
  185    HA   GLU  24           HA       GLU  24   2.458  -9.132  14.183
  186   1HB   GLU  24          2HB       GLU  24   1.578  -7.942  11.557
  187   2HB   GLU  24          1HB       GLU  24   2.580  -7.080  12.718
  188   1HG   GLU  24          2HG       GLU  24   3.365  -9.755  11.613
  189   2HG   GLU  24          1HG       GLU  24   3.752  -8.245  10.789
  190    H    GLY  25           H        GLY  25   1.988  -6.637  14.653
  191   1HA   GLY  25          2HA       GLY  25  -0.703  -6.617  15.809
  192   2HA   GLY  25          1HA       GLY  25   0.630  -5.568  16.270
  193    H    TYR  26           H        TYR  26  -0.311  -6.137  12.948
  194    HA   TYR  26           HA       TYR  26  -0.862  -3.290  12.655
  195   1HB   TYR  26          2HB       TYR  26  -0.550  -5.474  10.586
  196   2HB   TYR  26          1HB       TYR  26  -0.797  -3.770  10.223
  197    HD1  TYR  26           1HD      TYR  26   0.952  -2.160  11.421
  198    HD2  TYR  26           2HD      TYR  26   1.606  -6.271  10.561
  199    HE1  TYR  26           1HE      TYR  26   3.377  -1.784  11.511
  200    HE2  TYR  26           2HE      TYR  26   4.033  -5.912  10.649
  201    HH   TYR  26           HH       TYR  26   5.619  -4.289  11.700
  202    H    HIS  27           H        HIS  27  -2.539  -3.046  10.664
  203    HA   HIS  27           HA       HIS  27  -4.903  -4.678  11.035
  204   1HB   HIS  27          2HB       HIS  27  -4.638  -2.394  12.580
  205   2HB   HIS  27          1HB       HIS  27  -5.585  -1.840  11.207
  206    HD1  HIS  27           1HD      HIS  27  -5.748  -4.057  14.198
  207    HD2  HIS  27           2HD      HIS  27  -8.170  -2.939  11.012
  208    HE1  HIS  27           1HE      HIS  27  -8.053  -4.869  14.789
  209    HE2  HIS  27           2HE      HIS  27  -9.481  -4.267  12.803
  210    HA   PRO  28           HA       PRO  28  -4.371  -3.358   6.714
  211   1HB   PRO  28          2HB       PRO  28  -5.490  -5.553   5.610
  212   2HB   PRO  28          1HB       PRO  28  -3.814  -5.506   6.165
  213   1HG   PRO  28          2HG       PRO  28  -6.223  -6.655   7.508
  214   2HG   PRO  28          1HG       PRO  28  -4.577  -7.302   7.416
  215   1HD   PRO  28          2HD       PRO  28  -5.568  -5.990   9.598
  216   2HD   PRO  28          1HD       PRO  28  -3.847  -6.021   9.174
  217    H    ASP  29           H        ASP  29  -5.756  -2.292   5.429
  218    HA   ASP  29           HA       ASP  29  -8.597  -2.499   6.094
  219   1HB   ASP  29          2HB       ASP  29  -6.924  -0.231   6.102
  220   2HB   ASP  29          1HB       ASP  29  -8.094  -0.025   4.805
  221    H    THR  30           H        THR  30  -6.530  -3.292   3.786
  222    HA   THR  30           HA       THR  30  -6.608  -3.167   1.432
  223    HB   THR  30           HB       THR  30  -7.747  -5.200   0.778
  224    HG1  THR  30           1HG      THR  30  -9.028  -4.900   3.278
  225   1HG2  THR  30          1HG2      THR  30  -5.915  -6.073   1.706
  226   2HG2  THR  30          2HG2      THR  30  -7.014  -6.577   2.989
  227   3HG2  THR  30          3HG2      THR  30  -6.066  -5.102   3.170
  228    H    ALA  31           H        ALA  31  -7.389  -2.035  -0.149
  229    HA   ALA  31           HA       ALA  31 -10.294  -1.660  -0.389
  230   1HB   ALA  31          1HB       ALA  31  -9.881   0.458   0.321
  231   2HB   ALA  31          2HB       ALA  31  -9.447   0.684  -1.374
  232   3HB   ALA  31          3HB       ALA  31  -8.188   0.407  -0.170
  233    H    LYS  32           H        LYS  32 -10.967  -1.085  -2.610
  234    HA   LYS  32           HA       LYS  32  -9.550  -2.666  -4.535
  235   1HB   LYS  32          2HB       LYS  32 -11.779  -0.734  -5.159
  236   2HB   LYS  32          1HB       LYS  32 -11.329  -2.189  -6.033
  237   1HG   LYS  32          2HG       LYS  32 -12.130  -3.572  -4.225
  238   2HG   LYS  32          1HG       LYS  32 -12.486  -2.143  -3.253
  239   1HD   LYS  32          2HD       LYS  32 -14.053  -1.422  -5.087
  240   2HD   LYS  32          1HD       LYS  32 -13.816  -3.013  -5.812
  241   1HE   LYS  32          2HE       LYS  32 -14.420  -3.739  -3.296
  242   2HE   LYS  32          1HE       LYS  32 -15.323  -2.228  -3.396
  243   1HZ   LYS  32          1HZ       LYS  32 -16.012  -3.351  -5.698
  244   2HZ   LYS  32          2HZ       LYS  32 -16.879  -3.583  -4.264
  245   3HZ   LYS  32          3HZ       LYS  32 -15.762  -4.747  -4.776
  246    H    THR  33           H        THR  33  -9.707  -1.248  -6.895
  247    HA   THR  33           HA       THR  33  -7.333   0.054  -7.043
  248    HB   THR  33           HB       THR  33  -7.987   0.871  -9.178
  249    HG1  THR  33           1HG      THR  33 -10.614   0.734  -8.150
  250   1HG2  THR  33          1HG2      THR  33  -8.106  -1.674  -8.788
  251   2HG2  THR  33          2HG2      THR  33  -8.789  -0.997 -10.266
  252   3HG2  THR  33          3HG2      THR  33  -9.849  -1.448  -8.932
  253    H    LEU  34           H        LEU  34  -6.804   2.270  -7.495
  254    HA   LEU  34           HA       LEU  34  -6.877   4.032  -5.573
  255   1HB   LEU  34          2HB       LEU  34  -7.457   5.115  -8.309
  256   2HB   LEU  34          1HB       LEU  34  -6.409   5.775  -7.067
  257    HG   LEU  34           HG       LEU  34  -5.861   3.305  -8.718
  258   1HD1  LEU  34          1HD1      LEU  34  -3.876   4.823  -9.394
  259   2HD1  LEU  34          2HD1      LEU  34  -4.926   6.135  -8.863
  260   3HD1  LEU  34          3HD1      LEU  34  -5.448   5.056 -10.156
  261   1HD2  LEU  34          1HD2      LEU  34  -4.992   3.735  -6.180
  262   2HD2  LEU  34          2HD2      LEU  34  -3.712   4.501  -7.121
  263   3HD2  LEU  34          3HD2      LEU  34  -4.117   2.808  -7.398
  264    H    ARG  35           H        ARG  35  -9.601   3.802  -7.851
  265    HA   ARG  35           HA       ARG  35 -11.124   5.927  -6.973
  266   1HB   ARG  35          2HB       ARG  35 -11.523   3.737  -8.645
  267   2HB   ARG  35          1HB       ARG  35 -12.765   3.559  -7.413
  268   1HG   ARG  35          2HG       ARG  35 -13.668   4.799  -9.245
  269   2HG   ARG  35          1HG       ARG  35 -13.480   5.887  -7.869
  270   1HD   ARG  35          2HD       ARG  35 -11.991   7.171  -8.941
  271   2HD   ARG  35          1HD       ARG  35 -11.135   5.781  -9.607
  272    HE   ARG  35           HE       ARG  35 -13.134   7.359 -10.908
  273   1HH1  ARG  35          1HH1      ARG  35 -11.728   4.169 -10.740
  274   2HH1  ARG  35          2HH1      ARG  35 -12.168   3.754 -12.362
  275   1HH2  ARG  35          1HH2      ARG  35 -13.715   6.814 -13.041
  276   2HH2  ARG  35          2HH2      ARG  35 -13.298   5.253 -13.669
  277    H    GLU  36           H        GLU  36 -11.503   2.564  -5.847
  278    HA   GLU  36           HA       GLU  36 -13.120   3.247  -3.635
  279   1HB   GLU  36          2HB       GLU  36 -12.741   0.953  -4.828
  280   2HB   GLU  36          1HB       GLU  36 -11.426   0.775  -3.674
  281   1HG   GLU  36          2HG       GLU  36 -13.053  -0.207  -2.463
  282   2HG   GLU  36          1HG       GLU  36 -13.358   1.460  -1.978
  283    H    ALA  37           H        ALA  37  -9.634   2.902  -4.051
  284    HA   ALA  37           HA       ALA  37  -8.921   2.867  -1.328
  285   1HB   ALA  37          1HB       ALA  37  -7.002   4.299  -2.963
  286   2HB   ALA  37          2HB       ALA  37  -7.558   2.823  -3.751
  287   3HB   ALA  37          3HB       ALA  37  -6.844   2.747  -2.141
  288    H    GLU  38           H        GLU  38  -8.733   5.631  -3.581
  289    HA   GLU  38           HA       GLU  38  -8.211   7.637  -1.817
  290   1HB   GLU  38          2HB       GLU  38  -9.951   7.631  -4.269
  291   2HB   GLU  38          1HB       GLU  38  -9.634   9.103  -3.361
  292   1HG   GLU  38          2HG       GLU  38  -7.243   8.835  -3.745
  293   2HG   GLU  38          1HG       GLU  38  -7.549   7.346  -4.637
  294    H    LYS  39           H        LYS  39 -11.353   6.163  -2.483
  295    HA   LYS  39           HA       LYS  39 -12.903   7.896  -0.895
  296   1HB   LYS  39          2HB       LYS  39 -13.879   6.300  -2.499
  297   2HB   LYS  39          1HB       LYS  39 -13.350   4.963  -1.487
  298   1HG   LYS  39          2HG       LYS  39 -15.139   7.078  -0.369
  299   2HG   LYS  39          1HG       LYS  39 -15.801   5.773  -1.355
  300   1HD   LYS  39          2HD       LYS  39 -14.282   4.331   0.316
  301   2HD   LYS  39          1HD       LYS  39 -14.639   5.703   1.366
  302   1HE   LYS  39          2HE       LYS  39 -16.359   4.172   1.793
  303   2HE   LYS  39          1HE       LYS  39 -17.077   5.355   0.701
  304   1HZ   LYS  39          1HZ       LYS  39 -15.833   3.039  -0.544
  305   2HZ   LYS  39          2HZ       LYS  39 -17.259   3.853  -0.952
  306   3HZ   LYS  39          3HZ       LYS  39 -17.254   2.741   0.323
  307    H    LYS  40           H        LYS  40 -11.458   4.725  -0.152
  308    HA   LYS  40           HA       LYS  40 -12.176   4.688   2.565
  309   1HB   LYS  40          2HB       LYS  40 -10.061   3.288   0.970
  310   2HB   LYS  40          1HB       LYS  40 -10.158   3.081   2.714
  311   1HG   LYS  40          2HG       LYS  40 -12.367   2.481   0.758
  312   2HG   LYS  40          1HG       LYS  40 -11.304   1.290   1.509
  313   1HD   LYS  40          2HD       LYS  40 -12.275   2.717   3.660
  314   2HD   LYS  40          1HD       LYS  40 -13.663   2.628   2.575
  315   1HE   LYS  40          2HE       LYS  40 -13.818   0.714   3.930
  316   2HE   LYS  40          1HE       LYS  40 -13.169   0.142   2.394
  317   1HZ   LYS  40          1HZ       LYS  40 -11.207  -0.392   3.322
  318   2HZ   LYS  40          2HZ       LYS  40 -12.105  -0.455   4.755
  319   3HZ   LYS  40          3HZ       LYS  40 -11.204   0.927   4.381
  320    H    ILE  41           H        ILE  41  -9.434   6.082   0.878
  321    HA   ILE  41           HA       ILE  41  -8.063   6.747   3.344
  322    HB   ILE  41           HB       ILE  41  -7.394   7.663   0.554
  323   1HG1  ILE  41          2HG1      ILE  41  -5.814   5.493   1.772
  324   2HG1  ILE  41          1HG1      ILE  41  -7.465   5.050   1.349
  325   1HG2  ILE  41          1HG2      ILE  41  -5.972   7.724   3.184
  326   2HG2  ILE  41          2HG2      ILE  41  -6.183   9.011   1.996
  327   3HG2  ILE  41          3HG2      ILE  41  -5.060   7.690   1.674
  328   1HD1  ILE  41          1HD1      ILE  41  -6.302   4.508  -0.555
  329   2HD1  ILE  41          2HD1      ILE  41  -5.223   5.896  -0.419
  330   3HD1  ILE  41          3HD1      ILE  41  -6.893   6.126  -0.936
  331    H    LYS  42           H        LYS  42 -10.628   8.072   1.686
  332    HA   LYS  42           HA       LYS  42  -9.931  10.841   2.258
  333   1HB   LYS  42          2HB       LYS  42 -11.871   9.472   0.544
  334   2HB   LYS  42          1HB       LYS  42 -12.491  10.914   1.335
  335   1HG   LYS  42          2HG       LYS  42  -9.943  10.862  -0.256
  336   2HG   LYS  42          1HG       LYS  42 -11.518  11.278  -0.937
  337   1HD   LYS  42          2HD       LYS  42 -11.566  12.947   1.109
  338   2HD   LYS  42          1HD       LYS  42  -9.814  12.785   0.983
  339   1HE   LYS  42          2HE       LYS  42 -10.328  14.626  -0.367
  340   2HE   LYS  42          1HE       LYS  42 -10.123  13.291  -1.501
  341   1HZ   LYS  42          1HZ       LYS  42 -12.641  13.038  -1.286
  342   2HZ   LYS  42          2HZ       LYS  42 -12.058  14.339  -2.196
  343   3HZ   LYS  42          3HZ       LYS  42 -12.622  14.594  -0.622
  344    H    GLU  43           H        GLU  43 -10.365   8.898   4.419
  345    HA   GLU  43           HA       GLU  43 -12.312  10.459   5.914
  346   1HB   GLU  43          2HB       GLU  43 -12.491   7.446   5.836
  347   2HB   GLU  43          1HB       GLU  43 -13.555   8.549   6.696
  348   1HG   GLU  43          2HG       GLU  43 -14.384   9.430   4.598
  349   2HG   GLU  43          1HG       GLU  43 -13.270   8.397   3.704
  350    H    LEU  44           H        LEU  44 -10.210   7.582   6.107
  351    HA   LEU  44           HA       LEU  44  -9.468   8.375   8.828
  352   1HB   LEU  44          2HB       LEU  44  -8.719   6.164   9.175
  353   2HB   LEU  44          1HB       LEU  44 -10.239   6.031   8.315
  354    HG   LEU  44           HG       LEU  44  -8.188   6.071   6.365
  355   1HD1  LEU  44          1HD1      LEU  44  -7.567   3.690   7.910
  356   2HD1  LEU  44          2HD1      LEU  44  -7.091   5.175   8.732
  357   3HD1  LEU  44          3HD1      LEU  44  -6.492   4.835   7.111
  358   1HD2  LEU  44          1HD2      LEU  44  -9.357   3.478   7.046
  359   2HD2  LEU  44          2HD2      LEU  44  -9.424   4.395   5.542
  360   3HD2  LEU  44          3HD2      LEU  44 -10.542   4.770   6.853
  361    H    PHE  45           H        PHE  45  -7.021   7.410   9.195
  362    HA   PHE  45           HA       PHE  45  -5.343   8.778   7.194
  363   1HB   PHE  45          2HB       PHE  45  -5.632   9.980   9.405
  364   2HB   PHE  45          1HB       PHE  45  -4.765   8.645  10.154
  365    HD1  PHE  45           1HD      PHE  45  -4.419  11.161   7.430
  366    HD2  PHE  45           2HD      PHE  45  -2.469   8.731  10.329
  367    HE1  PHE  45           1HE      PHE  45  -2.277  12.249   6.896
  368    HE2  PHE  45           2HE      PHE  45  -0.324   9.815   9.800
  369    HZ   PHE  45           HZ       PHE  45  -0.225  11.577   8.083
  370    H    PHE  46           H        PHE  46  -4.213   7.279   6.129
  371    HA   PHE  46           HA       PHE  46  -3.345   4.869   7.533
  372   1HB   PHE  46          2HB       PHE  46  -3.497   5.579   4.606
  373   2HB   PHE  46          1HB       PHE  46  -2.747   4.099   5.196
  374    HD1  PHE  46           1HD      PHE  46  -5.738   5.574   4.082
  375    HD2  PHE  46           2HD      PHE  46  -4.225   2.640   6.765
  376    HE1  PHE  46           1HE      PHE  46  -7.941   4.475   4.117
  377    HE2  PHE  46           2HE      PHE  46  -6.424   1.536   6.808
  378    HZ   PHE  46           HZ       PHE  46  -8.286   2.455   5.484
  379    HA   PRO  47           HA       PRO  47   0.784   6.619   7.603
  380   1HB   PRO  47          2HB       PRO  47   1.799   4.362   8.974
  381   2HB   PRO  47          1HB       PRO  47   1.265   5.882   9.688
  382   1HG   PRO  47          2HG       PRO  47   0.043   3.366   9.971
  383   2HG   PRO  47          1HG       PRO  47  -0.625   4.929  10.464
  384   1HD   PRO  47          2HD       PRO  47  -1.229   3.282   8.081
  385   2HD   PRO  47          1HD       PRO  47  -2.248   4.453   8.938
  386    H    VAL  48           H        VAL  48  -0.117   3.464   6.471
  387    HA   VAL  48           HA       VAL  48   2.099   3.501   4.573
  388    HB   VAL  48           HB       VAL  48   1.339   0.982   6.028
  389   1HG1  VAL  48          1HG1      VAL  48   2.624   1.210   3.715
  390   2HG1  VAL  48          2HG1      VAL  48   3.036  -0.024   4.904
  391   3HG1  VAL  48          3HG1      VAL  48   3.993   1.454   4.800
  392   1HG2  VAL  48          1HG2      VAL  48   2.161   2.257   7.772
  393   2HG2  VAL  48          2HG2      VAL  48   3.315   3.104   6.741
  394   3HG2  VAL  48          3HG2      VAL  48   3.600   1.421   7.187
  395    H    ILE  49           H        ILE  49   1.483   2.988   2.588
  396    HA   ILE  49           HA       ILE  49  -1.119   1.672   2.201
  397    HB   ILE  49           HB       ILE  49   0.122   3.493   0.158
  398   1HG1  ILE  49          2HG1      ILE  49  -0.058   4.846   2.169
  399   2HG1  ILE  49          1HG1      ILE  49  -1.320   5.314   1.033
  400   1HG2  ILE  49          1HG2      ILE  49  -2.690   2.558   0.702
  401   2HG2  ILE  49          2HG2      ILE  49  -1.647   2.082  -0.639
  402   3HG2  ILE  49          3HG2      ILE  49  -2.248   3.737  -0.534
  403   1HD1  ILE  49          1HD1      ILE  49  -1.779   4.921   3.615
  404   2HD1  ILE  49          2HD1      ILE  49  -2.021   3.269   3.047
  405   3HD1  ILE  49          3HD1      ILE  49  -2.985   4.583   2.374
  406    H    VAL  50           H        VAL  50  -1.303   0.241   0.421
  407    HA   VAL  50           HA       VAL  50   1.199  -0.572  -0.867
  408    HB   VAL  50           HB       VAL  50  -0.663  -2.513   0.512
  409   1HG1  VAL  50          1HG1      VAL  50   1.891  -3.571  -0.319
  410   2HG1  VAL  50          2HG1      VAL  50   1.001  -2.921  -1.696
  411   3HG1  VAL  50          3HG1      VAL  50   0.265  -4.155  -0.674
  412   1HG2  VAL  50          1HG2      VAL  50   1.071  -2.880   2.092
  413   2HG2  VAL  50          2HG2      VAL  50   0.837  -1.135   1.985
  414   3HG2  VAL  50          3HG2      VAL  50   2.206  -1.893   1.172
  415    H    LEU  51           H        LEU  51   0.665  -0.058  -2.884
  416    HA   LEU  51           HA       LEU  51  -1.967  -0.775  -3.920
  417   1HB   LEU  51          2HB       LEU  51  -1.231   1.457  -4.426
  418   2HB   LEU  51          1HB       LEU  51   0.279   0.862  -5.086
  419    HG   LEU  51           HG       LEU  51  -1.323  -0.402  -6.763
  420   1HD1  LEU  51          1HD1      LEU  51  -3.297   0.940  -7.300
  421   2HD1  LEU  51          2HD1      LEU  51  -2.984   1.958  -5.895
  422   3HD1  LEU  51          3HD1      LEU  51  -3.392   0.256  -5.677
  423   1HD2  LEU  51          1HD2      LEU  51  -0.294   2.389  -6.777
  424   2HD2  LEU  51          2HD2      LEU  51  -1.334   1.863  -8.101
  425   3HD2  LEU  51          3HD2      LEU  51   0.172   1.006  -7.769
  426    H    ASP  52           H        ASP  52  -2.325  -2.448  -5.214
  427    HA   ASP  52           HA       ASP  52   0.003  -3.914  -6.262
  428   1HB   ASP  52          2HB       ASP  52  -1.370  -5.111  -4.537
  429   2HB   ASP  52          1HB       ASP  52  -2.734  -5.042  -5.648
  430    H    VAL  53           H        VAL  53   0.249  -3.589  -8.368
  431    HA   VAL  53           HA       VAL  53  -1.891  -2.671 -10.032
  432    HB   VAL  53           HB       VAL  53  -0.288  -2.510 -11.790
  433   1HG1  VAL  53          1HG1      VAL  53   0.047  -0.765 -10.273
  434   2HG1  VAL  53          2HG1      VAL  53   1.665  -1.401 -10.571
  435   3HG1  VAL  53          3HG1      VAL  53   0.810  -1.823  -9.086
  436   1HG2  VAL  53          1HG2      VAL  53   1.252  -4.077 -12.130
  437   2HG2  VAL  53          2HG2      VAL  53   0.885  -4.801 -10.566
  438   3HG2  VAL  53          3HG2      VAL  53   2.111  -3.540 -10.686
  439    H    TRP  54           H        TRP  54  -2.986  -4.888  -9.187
  440    HA   TRP  54           HA       TRP  54  -2.343  -7.264 -10.571
  441   1HB   TRP  54          2HB       TRP  54  -3.690  -7.333  -8.555
  442   2HB   TRP  54          1HB       TRP  54  -4.942  -6.360  -9.314
  443    HD1  TRP  54           HD       TRP  54  -6.961  -7.870  -9.736
  444    HE1  TRP  54           1HE      TRP  54  -7.331 -10.247 -10.653
  445    HE3  TRP  54           3HE      TRP  54  -2.084  -9.268 -10.363
  446    HZ2  TRP  54           2HZ      TRP  54  -5.762 -12.426 -11.525
  447    HZ3  TRP  54           3HZ      TRP  54  -1.604 -11.514 -11.242
  448    HH2  TRP  54           HH       TRP  54  -3.407 -13.060 -11.810
  449    H    MET  55           H        MET  55  -5.452  -5.625 -11.026
  450    HA   MET  55           HA       MET  55  -4.981  -5.377 -13.880
  451   1HB   MET  55          2HB       MET  55  -6.817  -7.377 -12.661
  452   2HB   MET  55          1HB       MET  55  -7.376  -6.538 -14.102
  453   1HG   MET  55          2HG       MET  55  -5.242  -7.241 -15.217
  454   2HG   MET  55          1HG       MET  55  -4.928  -8.256 -13.810
  455   1HE   MET  55          1HE       MET  55  -6.246 -11.130 -13.966
  456   2HE   MET  55          2HE       MET  55  -7.857 -10.520 -13.593
  457   3HE   MET  55          3HE       MET  55  -6.439  -9.770 -12.862
  458    HA   PRO  56           HA       PRO  56  -7.930  -2.270 -11.918
  459   1HB   PRO  56          2HB       PRO  56  -5.851  -0.281 -11.754
  460   2HB   PRO  56          1HB       PRO  56  -6.753  -1.028 -10.437
  461   1HG   PRO  56          2HG       PRO  56  -4.082  -1.414 -10.877
  462   2HG   PRO  56          1HG       PRO  56  -5.127  -2.568 -10.034
  463   1HD   PRO  56          2HD       PRO  56  -4.189  -2.588 -12.881
  464   2HD   PRO  56          1HD       PRO  56  -4.316  -3.931 -11.728
  465    H    ASP  57           H        ASP  57  -7.352   0.440 -12.615
  466    HA   ASP  57           HA       ASP  57  -6.749   0.621 -15.406
  467   1HB   ASP  57          2HB       ASP  57  -8.977   1.322 -16.163
  468   2HB   ASP  57          1HB       ASP  57  -9.003  -0.333 -15.563
  469    H    GLY  58           H        GLY  58  -5.993   1.865 -12.866
  470   1HA   GLY  58          2HA       GLY  58  -6.579   4.657 -13.613
  471   2HA   GLY  58          1HA       GLY  58  -6.671   4.143 -11.936
  472    H    ASP  59           H        ASP  59  -4.872   5.986 -13.686
  473    HA   ASP  59           HA       ASP  59  -2.257   5.006 -13.640
  474   1HB   ASP  59          2HB       ASP  59  -3.270   7.192 -14.678
  475   2HB   ASP  59          1HB       ASP  59  -2.813   7.908 -13.135
  476    H    GLY  60           H        GLY  60  -1.374   4.132 -11.866
  477   1HA   GLY  60          2HA       GLY  60  -1.974   4.980  -9.216
  478   2HA   GLY  60          1HA       GLY  60  -0.698   3.869  -9.682
  479    H    VAL  61           H        VAL  61   0.608   5.761 -11.476
  480    HA   VAL  61           HA       VAL  61   2.441   6.911  -9.743
  481    HB   VAL  61           HB       VAL  61   1.762   7.791 -12.556
  482   1HG1  VAL  61          1HG1      VAL  61   4.519   8.030 -11.667
  483   2HG1  VAL  61          2HG1      VAL  61   3.406   9.047 -10.756
  484   3HG1  VAL  61          3HG1      VAL  61   3.494   9.189 -12.511
  485   1HG2  VAL  61          1HG2      VAL  61   4.102   6.074 -12.005
  486   2HG2  VAL  61          2HG2      VAL  61   3.003   6.089 -13.384
  487   3HG2  VAL  61          3HG2      VAL  61   2.517   5.311 -11.878
  488    H    ASN  62           H        ASN  62  -0.465   8.264 -11.212
  489    HA   ASN  62           HA       ASN  62  -0.035  10.909 -10.201
  490   1HB   ASN  62          2HB       ASN  62  -1.931   9.592 -11.926
  491   2HB   ASN  62          1HB       ASN  62  -2.790  10.549 -10.722
  492   1HD2  ASN  62          1HD2      ASN  62  -0.247  10.692 -13.156
  493   2HD2  ASN  62          2HD2      ASN  62  -0.451  12.365 -13.531
  494    H    PHE  63           H        PHE  63  -1.376   7.981  -8.985
  495    HA   PHE  63           HA       PHE  63  -2.986   9.142  -6.923
  496   1HB   PHE  63          2HB       PHE  63  -3.478   6.916  -7.800
  497   2HB   PHE  63          1HB       PHE  63  -1.905   6.336  -7.267
  498    HD1  PHE  63           1HD      PHE  63  -4.720   8.224  -5.698
  499    HD2  PHE  63           2HD      PHE  63  -2.025   4.940  -5.465
  500    HE1  PHE  63           1HE      PHE  63  -5.700   7.578  -3.535
  501    HE2  PHE  63           2HE      PHE  63  -2.999   4.287  -3.303
  502    HZ   PHE  63           HZ       PHE  63  -4.842   5.605  -2.338
  503    H    ILE  64           H        ILE  64   0.337   8.125  -7.243
  504    HA   ILE  64           HA       ILE  64   1.129   7.778  -4.625
  505    HB   ILE  64           HB       ILE  64   2.844   9.347  -6.531
  506   1HG1  ILE  64          2HG1      ILE  64   2.058   7.607  -7.946
  507   2HG1  ILE  64          1HG1      ILE  64   3.633   7.080  -7.373
  508   1HG2  ILE  64          1HG2      ILE  64   4.609   8.624  -5.300
  509   2HG2  ILE  64          2HG2      ILE  64   3.833   7.098  -4.873
  510   3HG2  ILE  64          3HG2      ILE  64   3.369   8.586  -4.046
  511   1HD1  ILE  64          1HD1      ILE  64   1.029   6.197  -6.164
  512   2HD1  ILE  64          2HD1      ILE  64   2.639   5.552  -5.845
  513   3HD1  ILE  64          3HD1      ILE  64   1.890   5.313  -7.423
  514    H    ASP  65           H        ASP  65   0.440  10.756  -6.337
  515    HA   ASP  65           HA       ASP  65   1.512  12.501  -4.356
  516   1HB   ASP  65          2HB       ASP  65   1.082  13.087  -6.783
  517   2HB   ASP  65          1HB       ASP  65  -0.631  13.168  -6.379
  518    H    PHE  66           H        PHE  66  -1.693  11.167  -5.009
  519    HA   PHE  66           HA       PHE  66  -3.196  12.678  -3.229
  520   1HB   PHE  66          2HB       PHE  66  -4.268  11.179  -4.792
  521   2HB   PHE  66          1HB       PHE  66  -3.494   9.782  -4.053
  522    HD1  PHE  66           1HD      PHE  66  -4.116   9.191  -1.671
  523    HD2  PHE  66           2HD      PHE  66  -6.336  11.947  -4.033
  524    HE1  PHE  66           1HE      PHE  66  -6.049   8.907  -0.177
  525    HE2  PHE  66           2HE      PHE  66  -8.274  11.670  -2.542
  526    HZ   PHE  66           HZ       PHE  66  -8.132  10.148  -0.612
  527    H    ILE  67           H        ILE  67  -1.310   9.731  -2.668
  528    HA   ILE  67           HA       ILE  67  -2.019   9.327   0.013
  529    HB   ILE  67           HB       ILE  67   0.506   8.614  -1.485
  530   1HG1  ILE  67          2HG1      ILE  67  -0.619   6.275  -1.027
  531   2HG1  ILE  67          1HG1      ILE  67  -2.079   7.243  -0.848
  532   1HG2  ILE  67          1HG2      ILE  67   1.407   8.428   0.583
  533   2HG2  ILE  67          2HG2      ILE  67   0.527   6.900   0.582
  534   3HG2  ILE  67          3HG2      ILE  67  -0.164   8.315   1.376
  535   1HD1  ILE  67          1HD1      ILE  67  -0.481   7.809  -3.246
  536   2HD1  ILE  67          2HD1      ILE  67  -2.226   7.651  -3.048
  537   3HD1  ILE  67          3HD1      ILE  67  -1.220   6.209  -3.175
  538    H    LYS  68           H        LYS  68   0.659  11.181  -1.421
  539    HA   LYS  68           HA       LYS  68   1.577  12.097   1.154
  540   1HB   LYS  68          2HB       LYS  68   2.321  12.944  -1.653
  541   2HB   LYS  68          1HB       LYS  68   3.114  13.525  -0.195
  542   1HG   LYS  68          2HG       LYS  68   3.382  10.903   0.209
  543   2HG   LYS  68          1HG       LYS  68   3.316  10.909  -1.555
  544   1HD   LYS  68          2HD       LYS  68   5.130  12.758  -0.036
  545   2HD   LYS  68          1HD       LYS  68   5.617  11.113  -0.447
  546   1HE   LYS  68          2HE       LYS  68   6.427  12.206  -2.276
  547   2HE   LYS  68          1HE       LYS  68   4.795  11.859  -2.848
  548   1HZ   LYS  68          1HZ       LYS  68   4.218  14.018  -2.778
  549   2HZ   LYS  68          2HZ       LYS  68   5.884  14.281  -2.899
  550   3HZ   LYS  68          3HZ       LYS  68   5.125  14.349  -1.388
  551    H    GLU  69           H        GLU  69  -0.889  12.999  -0.975
  552    HA   GLU  69           HA       GLU  69  -0.891  15.813  -0.491
  553   1HB   GLU  69          2HB       GLU  69  -1.926  14.718  -2.485
  554   2HB   GLU  69          1HB       GLU  69  -3.166  14.067  -1.424
  555   1HG   GLU  69          2HG       GLU  69  -3.770  16.398  -0.803
  556   2HG   GLU  69          1HG       GLU  69  -2.629  16.964  -2.022
  557    H    ASN  70           H        ASN  70  -2.625  13.037   0.814
  558    HA   ASN  70           HA       ASN  70  -3.587  14.741   3.016
  559   1HB   ASN  70          2HB       ASN  70  -5.250  12.574   3.095
  560   2HB   ASN  70          1HB       ASN  70  -5.625  14.089   2.280
  561   1HD2  ASN  70          1HD2      ASN  70  -4.631  14.175  -0.013
  562   2HD2  ASN  70          2HD2      ASN  70  -4.886  12.771  -0.983
  563    H    SER  71           H        SER  71  -1.150  12.849   2.504
  564    HA   SER  71           HA       SER  71  -1.010  11.911   5.210
  565   1HB   SER  71          2HB       SER  71  -1.821  10.085   3.092
  566   2HB   SER  71          1HB       SER  71  -0.348   9.543   3.895
  567    HG   SER  71           HG       SER  71  -1.415   9.504   5.825
  568    HA   PRO  72           HA       PRO  72   2.974  13.023   3.021
  569   1HB   PRO  72          2HB       PRO  72   3.333  14.893   5.240
  570   2HB   PRO  72          1HB       PRO  72   3.368  15.205   3.503
  571   1HG   PRO  72          2HG       PRO  72   1.359  16.065   5.095
  572   2HG   PRO  72          1HG       PRO  72   1.110  15.617   3.398
  573   1HD   PRO  72          2HD       PRO  72   0.515  14.056   5.881
  574   2HD   PRO  72          1HD       PRO  72  -0.438  14.210   4.388
  575    H    ASP  73           H        ASP  73   2.008  12.162   6.183
  576    HA   ASP  73           HA       ASP  73   4.725  11.338   6.910
  577   1HB   ASP  73          2HB       ASP  73   2.882  12.673   8.392
  578   2HB   ASP  73          1HB       ASP  73   2.599  11.014   8.905
  579    H    SER  74           H        SER  74   2.968   9.936   4.988
  580    HA   SER  74           HA       SER  74   2.583   7.393   6.412
  581   1HB   SER  74          2HB       SER  74   0.548   8.282   5.368
  582   2HB   SER  74          1HB       SER  74   1.368   8.350   3.808
  583    HG   SER  74           HG       SER  74   0.012   6.351   4.746
  584    H    VAL  75           H        VAL  75   2.454   5.835   3.999
  585    HA   VAL  75           HA       VAL  75   5.036   6.158   2.714
  586    HB   VAL  75           HB       VAL  75   4.439   3.623   4.251
  587   1HG1  VAL  75          1HG1      VAL  75   5.599   3.091   2.228
  588   2HG1  VAL  75          2HG1      VAL  75   6.792   3.067   3.525
  589   3HG1  VAL  75          3HG1      VAL  75   6.707   4.447   2.431
  590   1HG2  VAL  75          1HG2      VAL  75   5.099   5.323   5.795
  591   2HG2  VAL  75          2HG2      VAL  75   6.405   5.860   4.738
  592   3HG2  VAL  75          3HG2      VAL  75   6.496   4.283   5.522
  593    H    VAL  76           H        VAL  76   5.105   5.363   0.715
  594    HA   VAL  76           HA       VAL  76   2.761   3.818  -0.198
  595    HB   VAL  76           HB       VAL  76   4.368   5.406  -2.143
  596   1HG1  VAL  76          1HG1      VAL  76   2.213   3.795  -2.390
  597   2HG1  VAL  76          2HG1      VAL  76   2.605   5.104  -3.504
  598   3HG1  VAL  76          3HG1      VAL  76   1.432   5.367  -2.213
  599   1HG2  VAL  76          1HG2      VAL  76   2.687   6.541   0.013
  600   2HG2  VAL  76          2HG2      VAL  76   2.469   7.207  -1.605
  601   3HG2  VAL  76          3HG2      VAL  76   4.059   7.242  -0.843
  602    H    ILE  77           H        ILE  77   3.650   1.792   0.063
  603    HA   ILE  77           HA       ILE  77   6.229   1.089  -0.925
  604    HB   ILE  77           HB       ILE  77   3.953  -0.792  -0.305
  605   1HG1  ILE  77          2HG1      ILE  77   4.364   0.742   1.587
  606   2HG1  ILE  77          1HG1      ILE  77   4.829  -0.911   1.971
  607   1HG2  ILE  77          1HG2      ILE  77   6.332  -1.360  -1.451
  608   2HG2  ILE  77          2HG2      ILE  77   5.431  -2.483  -0.434
  609   3HG2  ILE  77          3HG2      ILE  77   6.745  -1.531   0.255
  610   1HD1  ILE  77          1HD1      ILE  77   6.917   0.910   0.918
  611   2HD1  ILE  77          2HD1      ILE  77   7.042  -0.407   2.083
  612   3HD1  ILE  77          3HD1      ILE  77   6.359   1.144   2.574
  613    H    VAL  78           H        VAL  78   2.958   0.120  -2.001
  614    HA   VAL  78           HA       VAL  78   2.190  -0.625  -4.020
  615    HB   VAL  78           HB       VAL  78   4.239   1.318  -5.110
  616   1HG1  VAL  78          1HG1      VAL  78   1.649   0.401  -6.353
  617   2HG1  VAL  78          2HG1      VAL  78   3.221  -0.297  -6.736
  618   3HG1  VAL  78          3HG1      VAL  78   2.901   1.402  -7.086
  619   1HG2  VAL  78          1HG2      VAL  78   1.890   2.637  -5.229
  620   2HG2  VAL  78          2HG2      VAL  78   3.033   2.786  -3.894
  621   3HG2  VAL  78          3HG2      VAL  78   1.650   1.700  -3.754
  622    H    ILE  79           H        ILE  79   2.871  -2.763  -3.979
  623    HA   ILE  79           HA       ILE  79   5.396  -3.328  -5.393
  624    HB   ILE  79           HB       ILE  79   4.068  -5.366  -3.656
  625   1HG1  ILE  79          2HG1      ILE  79   6.097  -3.402  -2.601
  626   2HG1  ILE  79          1HG1      ILE  79   4.365  -3.200  -2.362
  627   1HG2  ILE  79          1HG2      ILE  79   5.852  -6.545  -4.236
  628   2HG2  ILE  79          2HG2      ILE  79   6.905  -5.330  -3.515
  629   3HG2  ILE  79          3HG2      ILE  79   6.431  -5.193  -5.208
  630   1HD1  ILE  79          1HD1      ILE  79   4.716  -4.329  -0.474
  631   2HD1  ILE  79          2HD1      ILE  79   6.250  -4.988  -1.037
  632   3HD1  ILE  79          3HD1      ILE  79   4.734  -5.752  -1.515
  633    H    THR  80           H        THR  80   5.443  -4.901  -6.967
  634    HA   THR  80           HA       THR  80   3.610  -6.794  -7.647
  635    HB   THR  80           HB       THR  80   2.661  -5.246  -9.713
  636    HG1  THR  80           1HG      THR  80   2.047  -3.642  -7.534
  637   1HG2  THR  80          1HG2      THR  80   1.561  -6.780  -7.752
  638   2HG2  THR  80          2HG2      THR  80   0.662  -5.897  -8.983
  639   3HG2  THR  80          3HG2      THR  80   0.903  -5.187  -7.389
  640    H    GLY  81           H        GLY  81   5.192  -7.953  -8.567
  641   1HA   GLY  81          2HA       GLY  81   6.856  -6.685 -10.630
  642   2HA   GLY  81          1HA       GLY  81   7.231  -8.180  -9.788
  643    H    HIS  82           H        HIS  82   6.347  -6.962 -12.688
  644    HA   HIS  82           HA       HIS  82   5.478  -9.569 -13.625
  645   1HB   HIS  82          2HB       HIS  82   3.607  -7.474 -13.171
  646   2HB   HIS  82          1HB       HIS  82   3.773  -7.665 -14.913
  647    HD1  HIS  82           1HD      HIS  82   1.697  -8.789 -12.351
  648    HD2  HIS  82           2HD      HIS  82   3.673 -10.727 -15.449
  649    HE1  HIS  82           1HE      HIS  82   0.474 -10.962 -12.671
  650    HE2  HIS  82           2HE      HIS  82   1.741 -12.156 -14.492
  651    H    GLY  83           H        GLY  83   7.849  -7.915 -13.939
  652   1HA   GLY  83          2HA       GLY  83   8.545  -8.352 -16.533
  653   2HA   GLY  83          1HA       GLY  83   7.768  -6.777 -16.584
  654    H    SER  84           H        SER  84   9.046  -5.076 -16.319
  655    HA   SER  84           HA       SER  84  11.641  -5.486 -14.983
  656   1HB   SER  84          2HB       SER  84  11.314  -3.169 -16.804
  657   2HB   SER  84          1HB       SER  84  12.694  -4.245 -16.581
  658    HG   SER  84           HG       SER  84  11.406  -5.850 -17.724
  659    H    VAL  85           H        VAL  85  12.563  -3.393 -14.084
  660    HA   VAL  85           HA       VAL  85  10.583  -2.246 -12.321
  661    HB   VAL  85           HB       VAL  85  12.504  -1.091 -11.268
  662   1HG1  VAL  85          1HG1      VAL  85  12.383  -4.034 -11.632
  663   2HG1  VAL  85          2HG1      VAL  85  12.165  -3.062 -10.177
  664   3HG1  VAL  85          3HG1      VAL  85  13.787  -3.365 -10.800
  665   1HG2  VAL  85          1HG2      VAL  85  14.459  -2.648 -12.842
  666   2HG2  VAL  85          2HG2      VAL  85  14.598  -1.043 -12.126
  667   3HG2  VAL  85          3HG2      VAL  85  13.735  -1.257 -13.648
  668    H    ASP  86           H        ASP  86   9.665  -1.362 -14.544
  669    HA   ASP  86           HA       ASP  86  10.845   1.271 -15.093
  670   1HB   ASP  86          2HB       ASP  86   8.742  -0.220 -16.680
  671   2HB   ASP  86          1HB       ASP  86   9.559   1.265 -17.158
  672    H    THR  87           H        THR  87   8.005  -0.323 -13.854
  673    HA   THR  87           HA       THR  87   6.464   2.137 -13.807
  674    HB   THR  87           HB       THR  87   5.574  -0.317 -14.125
  675    HG1  THR  87           1HG      THR  87   4.239   1.499 -12.410
  676   1HG2  THR  87          1HG2      THR  87   6.528  -0.837 -11.702
  677   2HG2  THR  87          2HG2      THR  87   5.062  -1.592 -12.328
  678   3HG2  THR  87          3HG2      THR  87   4.946  -0.212 -11.236
  679    H    ALA  88           H        ALA  88   8.395   0.175 -11.681
  680    HA   ALA  88           HA       ALA  88   7.624   1.275  -9.212
  681   1HB   ALA  88          1HB       ALA  88   9.890   0.523  -8.455
  682   2HB   ALA  88          2HB       ALA  88  10.236   0.084 -10.127
  683   3HB   ALA  88          3HB       ALA  88   8.937  -0.728  -9.254
  684    H    VAL  89           H        VAL  89  10.399   2.014 -11.281
  685    HA   VAL  89           HA       VAL  89  11.407   4.197  -9.921
  686    HB   VAL  89           HB       VAL  89  12.417   4.909 -12.036
  687   1HG1  VAL  89          1HG1      VAL  89  12.443   1.903 -11.892
  688   2HG1  VAL  89          2HG1      VAL  89  13.274   2.936 -10.729
  689   3HG1  VAL  89          3HG1      VAL  89  13.735   2.974 -12.431
  690   1HG2  VAL  89          1HG2      VAL  89  11.924   3.563 -14.096
  691   2HG2  VAL  89          2HG2      VAL  89  10.623   4.637 -13.581
  692   3HG2  VAL  89          3HG2      VAL  89  10.521   2.908 -13.251
  693    H    LYS  90           H        LYS  90   8.637   3.981 -12.045
  694    HA   LYS  90           HA       LYS  90   8.319   6.809 -12.375
  695   1HB   LYS  90          2HB       LYS  90   7.464   4.973 -13.921
  696   2HB   LYS  90          1HB       LYS  90   6.180   4.728 -12.746
  697   1HG   LYS  90          2HG       LYS  90   5.464   7.044 -13.048
  698   2HG   LYS  90          1HG       LYS  90   6.746   7.280 -14.236
  699   1HD   LYS  90          2HD       LYS  90   4.966   4.980 -14.710
  700   2HD   LYS  90          1HD       LYS  90   4.218   6.570 -14.865
  701   1HE   LYS  90          2HE       LYS  90   6.579   6.901 -16.209
  702   2HE   LYS  90          1HE       LYS  90   6.164   5.230 -16.587
  703   1HZ   LYS  90          1HZ       LYS  90   5.093   6.401 -18.235
  704   2HZ   LYS  90          2HZ       LYS  90   4.685   7.694 -17.222
  705   3HZ   LYS  90          3HZ       LYS  90   3.854   6.226 -17.096
  706    H    ALA  91           H        ALA  91   7.431   4.509  -9.963
  707    HA   ALA  91           HA       ALA  91   5.446   6.320  -8.807
  708   1HB   ALA  91          1HB       ALA  91   4.618   4.526  -7.592
  709   2HB   ALA  91          2HB       ALA  91   6.136   3.633  -7.684
  710   3HB   ALA  91          3HB       ALA  91   5.111   3.781  -9.112
  711    H    ILE  92           H        ILE  92   8.530   4.760  -8.005
  712    HA   ILE  92           HA       ILE  92   8.650   5.824  -5.369
  713    HB   ILE  92           HB       ILE  92  10.837   4.960  -5.205
  714   1HG1  ILE  92          2HG1      ILE  92  10.880   4.848  -8.231
  715   2HG1  ILE  92          1HG1      ILE  92  11.814   5.943  -7.218
  716   1HG2  ILE  92          1HG2      ILE  92  10.591   2.674  -6.330
  717   2HG2  ILE  92          2HG2      ILE  92   9.047   3.281  -6.927
  718   3HG2  ILE  92          3HG2      ILE  92   9.340   3.174  -5.191
  719   1HD1  ILE  92          1HD1      ILE  92  12.307   3.232  -6.436
  720   2HD1  ILE  92          2HD1      ILE  92  13.435   4.450  -7.031
  721   3HD1  ILE  92          3HD1      ILE  92  12.565   3.423  -8.170
  722    H    LYS  93           H        LYS  93  10.040   6.834  -8.466
  723    HA   LYS  93           HA       LYS  93  11.574   8.967  -7.478
  724   1HB   LYS  93          2HB       LYS  93  11.525   7.891  -9.841
  725   2HB   LYS  93          1HB       LYS  93  10.245   9.050 -10.170
  726   1HG   LYS  93          2HG       LYS  93  12.202  10.612  -9.047
  727   2HG   LYS  93          1HG       LYS  93  13.123   9.439  -9.990
  728   1HD   LYS  93          2HD       LYS  93  12.350  10.225 -11.971
  729   2HD   LYS  93          1HD       LYS  93  10.760  10.623 -11.314
  730   1HE   LYS  93          2HE       LYS  93  11.504  12.742 -11.557
  731   2HE   LYS  93          1HE       LYS  93  12.260  12.419  -9.997
  732   1HZ   LYS  93          1HZ       LYS  93  14.323  12.119 -10.964
  733   2HZ   LYS  93          2HZ       LYS  93  13.682  13.387 -11.881
  734   3HZ   LYS  93          3HZ       LYS  93  13.689  11.814 -12.503
  735    H    LYS  94           H        LYS  94   8.178   8.608  -7.952
  736    HA   LYS  94           HA       LYS  94   7.593  11.427  -8.001
  737   1HB   LYS  94          2HB       LYS  94   5.819   9.010  -7.643
  738   2HB   LYS  94          1HB       LYS  94   5.228  10.663  -7.750
  739   1HG   LYS  94          2HG       LYS  94   6.969   9.629  -9.927
  740   2HG   LYS  94          1HG       LYS  94   5.286   9.100  -9.853
  741   1HD   LYS  94          2HD       LYS  94   4.978  10.966 -11.108
  742   2HD   LYS  94          1HD       LYS  94   4.920  11.727  -9.517
  743   1HE   LYS  94          2HE       LYS  94   7.572  11.777  -9.960
  744   2HE   LYS  94          1HE       LYS  94   6.988  11.867 -11.621
  745   1HZ   LYS  94          1HZ       LYS  94   7.112  14.068 -10.972
  746   2HZ   LYS  94          2HZ       LYS  94   6.553  13.764  -9.405
  747   3HZ   LYS  94          3HZ       LYS  94   5.478  13.713 -10.711
  748    H    GLY  95           H        GLY  95   6.913   8.809  -5.660
  749   1HA   GLY  95          2HA       GLY  95   7.776  10.275  -3.421
  750   2HA   GLY  95          1HA       GLY  95   6.046  10.509  -3.600
  751    H    ALA  96           H        ALA  96   7.602   7.485  -4.488
  752    HA   ALA  96           HA       ALA  96   6.011   6.150  -2.449
  753   1HB   ALA  96          1HB       ALA  96   5.996   4.339  -3.780
  754   2HB   ALA  96          2HB       ALA  96   7.711   4.481  -4.163
  755   3HB   ALA  96          3HB       ALA  96   6.530   5.466  -5.025
  756    H    TYR  97           H        TYR  97   7.581   3.868  -2.017
  757    HA   TYR  97           HA       TYR  97   9.660   5.031  -0.324
  758   1HB   TYR  97          2HB       TYR  97   8.070   3.806   0.960
  759   2HB   TYR  97          1HB       TYR  97   8.143   2.432  -0.132
  760    HD1  TYR  97           1HD      TYR  97  10.401   4.432   2.079
  761    HD2  TYR  97           2HD      TYR  97   9.393   0.602   0.523
  762    HE1  TYR  97           1HE      TYR  97  12.113   3.405   3.515
  763    HE2  TYR  97           2HE      TYR  97  11.103  -0.434   1.953
  764    HH   TYR  97           HH       TYR  97  12.280   0.615   4.470
  765    H    GLU  98           H        GLU  98   9.203   2.985  -3.015
  766    HA   GLU  98           HA       GLU  98  11.527   2.992  -4.223
  767   1HB   GLU  98          2HB       GLU  98  12.890   1.051  -3.392
  768   2HB   GLU  98          1HB       GLU  98  12.878   2.457  -2.342
  769   1HG   GLU  98          2HG       GLU  98  10.844   1.084  -1.261
  770   2HG   GLU  98          1HG       GLU  98  11.788  -0.252  -1.914
  771    H    PHE  99           H        PHE  99   8.784   1.211  -3.363
  772    HA   PHE  99           HA       PHE  99   7.547  -0.304  -4.543
  773   1HB   PHE  99          2HB       PHE  99   8.846   1.037  -6.506
  774   2HB   PHE  99          1HB       PHE  99   9.484  -0.581  -6.767
  775    HD1  PHE  99           1HD      PHE  99   8.058  -2.375  -7.520
  776    HD2  PHE  99           2HD      PHE  99   6.507   1.534  -6.866
  777    HE1  PHE  99           1HE      PHE  99   6.031  -2.972  -8.781
  778    HE2  PHE  99           2HE      PHE  99   4.479   0.944  -8.125
  779    HZ   PHE  99           HZ       PHE  99   4.237  -1.311  -9.083
  780    H    LEU 100           H        LEU 100   8.418  -1.596  -2.695
  781    HA   LEU 100           HA       LEU 100  10.581  -3.274  -2.734
  782   1HB   LEU 100          2HB       LEU 100   9.139  -2.960  -0.813
  783   2HB   LEU 100          1HB       LEU 100   7.815  -3.754  -1.640
  784    HG   LEU 100           HG       LEU 100   9.112  -5.864  -1.615
  785   1HD1  LEU 100          1HD1      LEU 100  11.207  -6.054  -0.805
  786   2HD1  LEU 100          2HD1      LEU 100  10.941  -4.846   0.453
  787   3HD1  LEU 100          3HD1      LEU 100  11.296  -4.336  -1.199
  788   1HD2  LEU 100          1HD2      LEU 100   9.091  -5.115   1.212
  789   2HD2  LEU 100          2HD2      LEU 100   8.206  -6.381   0.363
  790   3HD2  LEU 100          3HD2      LEU 100   7.614  -4.720   0.335
  791    H    GLU 101           H        GLU 101  10.570  -5.690  -2.975
  792    HA   GLU 101           HA       GLU 101   8.980  -6.516  -5.312
  793   1HB   GLU 101          2HB       GLU 101  11.853  -7.257  -4.722
  794   2HB   GLU 101          1HB       GLU 101  10.909  -7.809  -6.098
  795   1HG   GLU 101          2HG       GLU 101  10.663  -5.165  -6.430
  796   2HG   GLU 101          1HG       GLU 101  12.225  -5.216  -5.615
  797    H    LYS 102           H        LYS 102   7.467  -7.728  -4.263
  798    HA   LYS 102           HA       LYS 102   8.435 -10.184  -3.009
  799   1HB   LYS 102          2HB       LYS 102   6.916  -9.985  -1.132
  800   2HB   LYS 102          1HB       LYS 102   7.984  -8.589  -1.178
  801   1HG   LYS 102          2HG       LYS 102   6.221  -7.256  -1.137
  802   2HG   LYS 102          1HG       LYS 102   5.686  -7.926  -2.680
  803   1HD   LYS 102          2HD       LYS 102   4.770  -9.866  -1.183
  804   2HD   LYS 102          1HD       LYS 102   4.862  -8.655   0.098
  805   1HE   LYS 102          2HE       LYS 102   2.641  -8.765  -1.001
  806   2HE   LYS 102          1HE       LYS 102   3.405  -7.180  -1.114
  807   1HZ   LYS 102          1HZ       LYS 102   2.327  -8.179  -3.197
  808   2HZ   LYS 102          2HZ       LYS 102   3.709  -9.149  -3.288
  809   3HZ   LYS 102          3HZ       LYS 102   3.852  -7.465  -3.353
  810    HA   PRO 103           HA       PRO 103   4.699 -10.556  -5.900
  811   1HB   PRO 103          2HB       PRO 103   5.902 -11.809  -7.971
  812   2HB   PRO 103          1HB       PRO 103   5.825 -10.047  -7.843
  813   1HG   PRO 103          2HG       PRO 103   8.074 -11.899  -7.142
  814   2HG   PRO 103          1HG       PRO 103   8.129 -10.355  -8.015
  815   1HD   PRO 103          2HD       PRO 103   8.763 -10.568  -5.388
  816   2HD   PRO 103          1HD       PRO 103   8.019  -9.110  -6.078
  817    H    PHE 104           H        PHE 104   6.948 -12.497  -4.330
  818    HA   PHE 104           HA       PHE 104   5.165 -14.810  -4.559
  819   1HB   PHE 104          2HB       PHE 104   8.037 -14.682  -5.277
  820   2HB   PHE 104          1HB       PHE 104   7.532 -16.091  -4.350
  821    HD1  PHE 104           1HD      PHE 104   7.997 -14.862  -7.557
  822    HD2  PHE 104           2HD      PHE 104   5.262 -17.179  -5.263
  823    HE1  PHE 104           1HE      PHE 104   7.163 -15.913  -9.620
  824    HE2  PHE 104           2HE      PHE 104   4.423 -18.235  -7.321
  825    HZ   PHE 104           HZ       PHE 104   5.375 -17.603  -9.503
  826    H    SER 105           H        SER 105   7.901 -13.353  -2.824
  827    HA   SER 105           HA       SER 105   7.016 -14.741  -0.387
  828   1HB   SER 105          2HB       SER 105   9.253 -14.341   0.496
  829   2HB   SER 105          1HB       SER 105   9.365 -15.132  -1.076
  830    HG   SER 105           HG       SER 105   9.672 -12.975  -1.954
  831    H    VAL 106           H        VAL 106   5.438 -13.404   0.386
  832    HA   VAL 106           HA       VAL 106   5.834 -10.547   0.558
  833    HB   VAL 106           HB       VAL 106   3.600 -11.410   0.117
  834   1HG1  VAL 106          1HG1      VAL 106   2.546 -12.381   2.410
  835   2HG1  VAL 106          2HG1      VAL 106   4.181 -13.038   2.494
  836   3HG1  VAL 106          3HG1      VAL 106   3.161 -13.385   1.097
  837   1HG2  VAL 106          1HG2      VAL 106   3.069 -10.370   2.791
  838   2HG2  VAL 106          2HG2      VAL 106   2.644  -9.710   1.213
  839   3HG2  VAL 106          3HG2      VAL 106   4.247  -9.419   1.890
  840    H    GLU 107           H        GLU 107   7.027 -13.059   2.351
  841    HA   GLU 107           HA       GLU 107   6.598 -12.114   4.993
  842   1HB   GLU 107          2HB       GLU 107   7.490 -14.429   4.049
  843   2HB   GLU 107          1HB       GLU 107   9.047 -13.655   4.310
  844   1HG   GLU 107          2HG       GLU 107   7.931 -13.125   6.665
  845   2HG   GLU 107          1HG       GLU 107   7.035 -14.590   6.262
  846    H    ARG 108           H        ARG 108   9.129 -11.684   2.571
  847    HA   ARG 108           HA       ARG 108  10.926 -10.194   4.140
  848   1HB   ARG 108          2HB       ARG 108  11.177 -11.216   1.739
  849   2HB   ARG 108          1HB       ARG 108  10.560  -9.656   1.210
  850   1HG   ARG 108          2HG       ARG 108  12.427  -8.517   1.947
  851   2HG   ARG 108          1HG       ARG 108  12.873  -9.782   3.094
  852   1HD   ARG 108          2HD       ARG 108  14.436  -9.925   1.331
  853   2HD   ARG 108          1HD       ARG 108  13.312 -11.262   1.093
  854    HE   ARG 108           HE       ARG 108  12.639 -10.301  -0.874
  855   1HH1  ARG 108          1HH1      ARG 108  14.404  -7.938   0.991
  856   2HH1  ARG 108          2HH1      ARG 108  14.450  -6.776  -0.293
  857   1HH2  ARG 108          1HH2      ARG 108  12.699  -8.776  -2.563
  858   2HH2  ARG 108          2HH2      ARG 108  13.480  -7.251  -2.310
  859    H    PHE 109           H        PHE 109   8.053  -9.350   2.334
  860    HA   PHE 109           HA       PHE 109   8.301  -6.550   2.383
  861   1HB   PHE 109          2HB       PHE 109   6.659  -7.496   0.933
  862   2HB   PHE 109          1HB       PHE 109   5.916  -8.401   2.243
  863    HD1  PHE 109           1HD      PHE 109   6.868  -4.809   2.146
  864    HD2  PHE 109           2HD      PHE 109   3.715  -7.664   2.264
  865    HE1  PHE 109           1HE      PHE 109   5.239  -2.996   2.471
  866    HE2  PHE 109           2HE      PHE 109   2.081  -5.858   2.590
  867    HZ   PHE 109           HZ       PHE 109   2.843  -3.518   2.695
  868    H    LEU 110           H        LEU 110   6.979  -8.885   4.658
  869    HA   LEU 110           HA       LEU 110   5.723  -7.290   6.502
  870   1HB   LEU 110          2HB       LEU 110   6.358  -9.884   6.384
  871   2HB   LEU 110          1HB       LEU 110   7.499  -9.360   7.608
  872    HG   LEU 110           HG       LEU 110   4.533  -8.860   7.774
  873   1HD1  LEU 110          1HD1      LEU 110   4.511 -10.692   9.413
  874   2HD1  LEU 110          2HD1      LEU 110   6.187 -11.055   9.001
  875   3HD1  LEU 110          3HD1      LEU 110   4.921 -11.241   7.788
  876   1HD2  LEU 110          1HD2      LEU 110   6.859  -8.092   9.363
  877   2HD2  LEU 110          2HD2      LEU 110   5.584  -8.867  10.304
  878   3HD2  LEU 110          3HD2      LEU 110   5.225  -7.429   9.349
  879    H    LEU 111           H        LEU 111   9.177  -8.133   6.470
  880    HA   LEU 111           HA       LEU 111   9.955  -6.674   8.709
  881   1HB   LEU 111          2HB       LEU 111  11.533  -7.292   6.215
  882   2HB   LEU 111          1HB       LEU 111  12.223  -6.710   7.718
  883    HG   LEU 111           HG       LEU 111  10.810  -8.941   8.521
  884   1HD1  LEU 111          1HD1      LEU 111  11.732  -9.270   5.717
  885   2HD1  LEU 111          2HD1      LEU 111  10.338  -9.969   6.542
  886   3HD1  LEU 111          3HD1      LEU 111  11.951 -10.618   6.833
  887   1HD2  LEU 111          1HD2      LEU 111  12.935  -8.466   9.410
  888   2HD2  LEU 111          2HD2      LEU 111  13.700  -8.509   7.821
  889   3HD2  LEU 111          3HD2      LEU 111  13.118 -10.001   8.559
  890    H    THR 112           H        THR 112   9.882  -5.669   5.299
  891    HA   THR 112           HA       THR 112  10.966  -3.112   5.663
  892    HB   THR 112           HB       THR 112   8.992  -4.070   3.582
  893    HG1  THR 112           1HG      THR 112  11.809  -3.842   3.421
  894   1HG2  THR 112          1HG2      THR 112   9.949  -2.306   2.156
  895   2HG2  THR 112          2HG2      THR 112  10.806  -1.672   3.560
  896   3HG2  THR 112          3HG2      THR 112   9.043  -1.671   3.529
  897    H    ILE 113           H        ILE 113   7.631  -4.261   5.834
  898    HA   ILE 113           HA       ILE 113   6.220  -1.917   5.908
  899    HB   ILE 113           HB       ILE 113   5.820  -4.575   7.182
  900   1HG1  ILE 113          2HG1      ILE 113   5.155  -4.206   4.870
  901   2HG1  ILE 113          1HG1      ILE 113   3.734  -4.485   5.869
  902   1HG2  ILE 113          1HG2      ILE 113   4.200  -2.144   7.905
  903   2HG2  ILE 113          2HG2      ILE 113   5.104  -3.198   8.993
  904   3HG2  ILE 113          3HG2      ILE 113   3.666  -3.804   8.171
  905   1HD1  ILE 113          1HD1      ILE 113   3.962  -1.765   5.933
  906   2HD1  ILE 113          2HD1      ILE 113   2.908  -2.683   4.858
  907   3HD1  ILE 113          3HD1      ILE 113   4.496  -2.156   4.298
  908    H    LYS 114           H        LYS 114   7.615  -3.539   8.765
  909    HA   LYS 114           HA       LYS 114   6.912  -1.763  10.719
  910   1HB   LYS 114          2HB       LYS 114   8.152  -3.872  11.108
  911   2HB   LYS 114          1HB       LYS 114   9.603  -3.118  10.463
  912   1HG   LYS 114          2HG       LYS 114   8.317  -1.644  12.649
  913   2HG   LYS 114          1HG       LYS 114   8.953  -3.230  13.089
  914   1HD   LYS 114          2HD       LYS 114  11.055  -2.489  13.023
  915   2HD   LYS 114          1HD       LYS 114  10.820  -1.776  11.426
  916   1HE   LYS 114          2HE       LYS 114  11.296   0.092  12.675
  917   2HE   LYS 114          1HE       LYS 114   9.535   0.066  12.766
  918   1HZ   LYS 114          1HZ       LYS 114  10.355   0.441  14.939
  919   2HZ   LYS 114          2HZ       LYS 114  11.457  -0.839  14.835
  920   3HZ   LYS 114          3HZ       LYS 114   9.797  -1.157  14.909
  921    H    HIS 115           H        HIS 115   9.965  -1.684   8.899
  922    HA   HIS 115           HA       HIS 115  10.930   0.735   9.793
  923   1HB   HIS 115          2HB       HIS 115  12.152  -0.882   8.342
  924   2HB   HIS 115          1HB       HIS 115  11.200  -0.314   6.974
  925    HD1  HIS 115           1HD      HIS 115  14.199   0.435   8.942
  926    HD2  HIS 115           2HD      HIS 115  11.741   2.437   6.255
  927    HE1  HIS 115           1HE      HIS 115  15.507   2.455   8.211
  928    HE2  HIS 115           2HE      HIS 115  13.982   3.675   6.618
  929    H    ALA 116           H        ALA 116   8.379   0.115   7.484
  930    HA   ALA 116           HA       ALA 116   8.294   2.678   6.291
  931   1HB   ALA 116          1HB       ALA 116   5.868   0.955   6.665
  932   2HB   ALA 116          2HB       ALA 116   7.151   0.496   5.544
  933   3HB   ALA 116          3HB       ALA 116   6.283   2.015   5.316
  934    H    PHE 117           H        PHE 117   6.934   1.348   9.233
  935    HA   PHE 117           HA       PHE 117   5.256   3.614   9.772
  936   1HB   PHE 117          2HB       PHE 117   6.025   1.134  11.272
  937   2HB   PHE 117          1HB       PHE 117   5.204   2.451  12.107
  938    HD1  PHE 117           1HD      PHE 117   2.896   2.731  11.929
  939    HD2  PHE 117           2HD      PHE 117   4.908   0.101   9.256
  940    HE1  PHE 117           1HE      PHE 117   0.727   1.907  11.118
  941    HE2  PHE 117           2HE      PHE 117   2.743  -0.728   8.440
  942    HZ   PHE 117           HZ       PHE 117   0.647   0.180   9.369
  943    H    GLU 118           H        GLU 118   8.553   2.769  10.372
  944    HA   GLU 118           HA       GLU 118   9.156   4.185  12.664
  945   1HB   GLU 118          2HB       GLU 118  10.763   3.674  10.179
  946   2HB   GLU 118          1HB       GLU 118  11.434   4.530  11.561
  947   1HG   GLU 118          2HG       GLU 118  10.840   2.542  12.962
  948   2HG   GLU 118          1HG       GLU 118  10.431   1.698  11.468
  949    H    GLU 119           H        GLU 119   8.331   5.390   9.524
  950    HA   GLU 119           HA       GLU 119   9.437   7.981   9.785
  951   1HB   GLU 119          2HB       GLU 119   7.062   7.117   8.132
  952   2HB   GLU 119          1HB       GLU 119   8.001   8.588   7.911
  953   1HG   GLU 119          2HG       GLU 119   9.458   6.012   7.816
  954   2HG   GLU 119          1HG       GLU 119   8.398   6.404   6.463
  955    H    TYR 120           H        TYR 120   6.855   6.499  11.346
  956    HA   TYR 120           HA       TYR 120   5.953   9.086  12.376
  957   1HB   TYR 120          2HB       TYR 120   4.422   7.828  10.557
  958   2HB   TYR 120          1HB       TYR 120   3.854   7.018  12.013
  959    HD1  TYR 120           1HD      TYR 120   4.069   9.295  13.949
  960    HD2  TYR 120           2HD      TYR 120   2.566   9.141   9.972
  961    HE1  TYR 120           1HE      TYR 120   2.596  11.202  14.439
  962    HE2  TYR 120           2HE      TYR 120   1.091  11.049  10.450
  963    HH   TYR 120           HH       TYR 120   0.476  12.160  13.578
  964    H    SER 121           H        SER 121   7.737   7.132  13.481
  965    HA   SER 121           HA       SER 121   8.168   6.081  15.450
  966   1HB   SER 121          2HB       SER 121   5.674   7.591  16.245
  967   2HB   SER 121          1HB       SER 121   6.640   6.656  17.386
  968    HG   SER 121           HG       SER 121   8.248   8.078  17.225
  Start of MODEL   26
    1   1H    MET   1          1HT       MET   1  -2.502   3.195  15.530
    2   2H    MET   1          2HT       MET   1  -2.694   3.092  17.231
    3   3H    MET   1          3HT       MET   1  -2.905   1.696  16.256
    4    HA   MET   1           HA       MET   1  -0.448   3.132  16.940
    5   1HB   MET   1          2HB       MET   1  -1.484   0.305  17.153
    6   2HB   MET   1          1HB       MET   1   0.207   0.712  17.407
    7   1HG   MET   1          2HG       MET   1  -0.384   2.154  19.256
    8   2HG   MET   1          1HG       MET   1  -2.097   1.846  18.975
    9   1HE   MET   1          1HE       MET   1  -0.356   1.468  21.734
   10   2HE   MET   1          2HE       MET   1   1.031   0.835  20.850
   11   3HE   MET   1          3HE       MET   1   0.202  -0.177  22.031
   12    H    LYS   2           H        LYS   2  -1.285   0.200  15.098
   13    HA   LYS   2           HA       LYS   2   0.409   1.189  12.903
   14   1HB   LYS   2          2HB       LYS   2   0.286  -1.712  13.703
   15   2HB   LYS   2          1HB       LYS   2   1.429  -0.929  12.622
   16   1HG   LYS   2          2HG       LYS   2   1.542   0.282  15.223
   17   2HG   LYS   2          1HG       LYS   2   1.739  -1.466  15.350
   18   1HD   LYS   2          2HD       LYS   2   3.298  -0.715  13.158
   19   2HD   LYS   2          1HD       LYS   2   3.586   0.530  14.375
   20   1HE   LYS   2          2HE       LYS   2   5.202  -1.166  14.741
   21   2HE   LYS   2          1HE       LYS   2   4.000  -1.327  16.020
   22   1HZ   LYS   2          1HZ       LYS   2   3.720  -2.911  13.559
   23   2HZ   LYS   2          2HZ       LYS   2   3.170  -3.255  15.122
   24   3HZ   LYS   2          3HZ       LYS   2   4.813  -3.412  14.748
   25    H    ARG   3           H        ARG   3  -0.759   1.414  11.126
   26    HA   ARG   3           HA       ARG   3  -2.671  -0.667  10.386
   27   1HB   ARG   3          2HB       ARG   3  -3.442   2.241  10.208
   28   2HB   ARG   3          1HB       ARG   3  -4.467   0.832   9.974
   29   1HG   ARG   3          2HG       ARG   3  -5.132   1.316  12.064
   30   2HG   ARG   3          1HG       ARG   3  -3.685   0.412  12.509
   31   1HD   ARG   3          2HD       ARG   3  -2.550   2.273  13.147
   32   2HD   ARG   3          1HD       ARG   3  -3.343   3.298  11.952
   33    HE   ARG   3           HE       ARG   3  -5.084   2.421  14.065
   34   1HH1  ARG   3          1HH1      ARG   3  -2.767   4.840  13.086
   35   2HH1  ARG   3          2HH1      ARG   3  -3.378   6.043  14.171
   36   1HH2  ARG   3          1HH2      ARG   3  -5.888   4.003  15.493
   37   2HH2  ARG   3          2HH2      ARG   3  -5.148   5.569  15.538
   38    H    VAL   4           H        VAL   4  -2.626  -1.126   8.253
   39    HA   VAL   4           HA       VAL   4  -1.299   0.799   6.460
   40    HB   VAL   4           HB       VAL   4  -0.977  -2.196   6.261
   41   1HG1  VAL   4          1HG1      VAL   4   0.097   0.147   4.762
   42   2HG1  VAL   4          2HG1      VAL   4  -0.539  -1.378   4.153
   43   3HG1  VAL   4          3HG1      VAL   4   1.062  -1.320   4.889
   44   1HG2  VAL   4          1HG2      VAL   4   0.998  -0.199   7.365
   45   2HG2  VAL   4          2HG2      VAL   4   1.247  -1.935   7.183
   46   3HG2  VAL   4          3HG2      VAL   4   0.054  -1.331   8.334
   47    H    LEU   5           H        LEU   5  -1.846   0.480   4.156
   48    HA   LEU   5           HA       LEU   5  -4.592  -0.543   3.862
   49   1HB   LEU   5          2HB       LEU   5  -4.237   1.930   3.567
   50   2HB   LEU   5          1HB       LEU   5  -3.243   1.560   2.172
   51    HG   LEU   5           HG       LEU   5  -5.183   0.501   1.079
   52   1HD1  LEU   5          1HD1      LEU   5  -6.690  -0.271   2.572
   53   2HD1  LEU   5          2HD1      LEU   5  -7.414   1.315   2.307
   54   3HD1  LEU   5          3HD1      LEU   5  -6.393   1.037   3.716
   55   1HD2  LEU   5          1HD2      LEU   5  -6.595   2.824   1.255
   56   2HD2  LEU   5          2HD2      LEU   5  -5.181   2.576   0.229
   57   3HD2  LEU   5          3HD2      LEU   5  -5.001   3.331   1.812
   58    H    VAL   6           H        VAL   6  -5.017  -2.041   2.329
   59    HA   VAL   6           HA       VAL   6  -2.765  -2.830   0.588
   60    HB   VAL   6           HB       VAL   6  -4.977  -4.636   1.557
   61   1HG1  VAL   6          1HG1      VAL   6  -4.073  -5.463  -0.469
   62   2HG1  VAL   6          2HG1      VAL   6  -3.326  -6.400   0.826
   63   3HG1  VAL   6          3HG1      VAL   6  -2.423  -5.105   0.040
   64   1HG2  VAL   6          1HG2      VAL   6  -3.235  -5.613   3.035
   65   2HG2  VAL   6          2HG2      VAL   6  -3.691  -3.967   3.471
   66   3HG2  VAL   6          3HG2      VAL   6  -2.179  -4.265   2.613
   67    H    VAL   7           H        VAL   7  -3.371  -1.555  -1.181
   68    HA   VAL   7           HA       VAL   7  -6.030  -1.820  -2.296
   69    HB   VAL   7           HB       VAL   7  -3.624  -0.452  -3.510
   70   1HG1  VAL   7          1HG1      VAL   7  -6.473  -0.698  -4.249
   71   2HG1  VAL   7          2HG1      VAL   7  -5.048  -0.490  -5.267
   72   3HG1  VAL   7          3HG1      VAL   7  -5.746   0.898  -4.432
   73   1HG2  VAL   7          1HG2      VAL   7  -5.822   0.943  -2.023
   74   2HG2  VAL   7          2HG2      VAL   7  -4.219   1.540  -2.454
   75   3HG2  VAL   7          3HG2      VAL   7  -4.398   0.330  -1.184
   76    H    ASP   8           H        ASP   8  -6.476  -3.723  -3.233
   77    HA   ASP   8           HA       ASP   8  -4.660  -4.652  -5.342
   78   1HB   ASP   8          2HB       ASP   8  -4.184  -6.040  -3.398
   79   2HB   ASP   8          1HB       ASP   8  -5.897  -6.404  -3.205
   80    H    ASP   9           H        ASP   9  -5.651  -5.222  -7.177
   81    HA   ASP   9           HA       ASP   9  -8.264  -4.553  -7.737
   82   1HB   ASP   9          2HB       ASP   9  -6.699  -4.822  -9.525
   83   2HB   ASP   9          1HB       ASP   9  -6.422  -6.509  -9.116
   84    H    GLU  10           H        GLU  10  -6.982  -7.766  -6.885
   85    HA   GLU  10           HA       GLU  10  -9.338  -8.558  -5.580
   86   1HB   GLU  10          2HB       GLU  10 -10.153 -10.266  -7.173
   87   2HB   GLU  10          1HB       GLU  10 -10.342  -8.625  -7.775
   88   1HG   GLU  10          2HG       GLU  10  -8.896  -8.933  -9.472
   89   2HG   GLU  10          1HG       GLU  10  -7.845  -9.990  -8.531
   90    H    GLU  11           H        GLU  11  -8.969 -10.286  -4.324
   91    HA   GLU  11           HA       GLU  11  -7.707 -11.805  -3.177
   92   1HB   GLU  11          2HB       GLU  11  -7.290 -13.826  -4.401
   93   2HB   GLU  11          1HB       GLU  11  -8.774 -13.114  -5.015
   94   1HG   GLU  11          2HG       GLU  11  -7.858 -12.597  -7.041
   95   2HG   GLU  11          1HG       GLU  11  -6.223 -12.474  -6.398
   96    H    SER  12           H        SER  12  -5.493 -13.355  -3.964
   97    HA   SER  12           HA       SER  12  -3.236 -13.362  -4.158
   98   1HB   SER  12          2HB       SER  12  -3.447 -12.015  -6.180
   99   2HB   SER  12          1HB       SER  12  -3.558 -10.545  -5.217
  100    HG   SER  12           HG       SER  12  -1.463 -10.617  -4.824
  101    H    ILE  13           H        ILE  13  -3.354  -9.900  -3.444
  102    HA   ILE  13           HA       ILE  13  -1.731 -10.308  -1.112
  103    HB   ILE  13           HB       ILE  13  -3.029  -7.746  -2.037
  104   1HG1  ILE  13          2HG1      ILE  13  -1.655  -8.763  -3.821
  105   2HG1  ILE  13          1HG1      ILE  13  -0.938  -7.276  -3.209
  106   1HG2  ILE  13          1HG2      ILE  13  -0.526  -8.109  -0.408
  107   2HG2  ILE  13          2HG2      ILE  13  -2.122  -7.887   0.311
  108   3HG2  ILE  13          3HG2      ILE  13  -1.427  -6.622  -0.702
  109   1HD1  ILE  13          1HD1      ILE  13  -0.104 -10.057  -2.422
  110   2HD1  ILE  13          2HD1      ILE  13   0.645  -8.549  -1.896
  111   3HD1  ILE  13          3HD1      ILE  13   0.723  -9.028  -3.591
  112    H    THR  14           H        THR  14  -5.008  -9.033  -1.673
  113    HA   THR  14           HA       THR  14  -5.735  -8.418   0.901
  114    HB   THR  14           HB       THR  14  -8.096  -9.094   0.133
  115    HG1  THR  14           1HG      THR  14  -8.233  -9.464  -2.119
  116   1HG2  THR  14          1HG2      THR  14  -7.866  -6.867  -0.166
  117   2HG2  THR  14          2HG2      THR  14  -7.910  -7.353  -1.860
  118   3HG2  THR  14          3HG2      THR  14  -6.364  -7.028  -1.076
  119    H    SER  15           H        SER  15  -5.477 -11.592  -0.554
  120    HA   SER  15           HA       SER  15  -6.734 -12.872   1.736
  121   1HB   SER  15          2HB       SER  15  -5.974 -14.978   0.352
  122   2HB   SER  15          1HB       SER  15  -7.351 -14.012  -0.179
  123    HG   SER  15           HG       SER  15  -6.141 -13.130  -1.760
  124    H    SER  16           H        SER  16  -3.542 -12.818   0.169
  125    HA   SER  16           HA       SER  16  -2.332 -14.474   2.160
  126   1HB   SER  16          2HB       SER  16  -1.312 -14.563   0.034
  127   2HB   SER  16          1HB       SER  16  -1.247 -12.807  -0.102
  128    HG   SER  16           HG       SER  16   0.162 -14.221   1.901
  129    H    LEU  17           H        LEU  17  -1.486 -11.133   1.268
  130    HA   LEU  17           HA       LEU  17   0.051 -10.404   3.355
  131   1HB   LEU  17          2HB       LEU  17  -0.799  -9.056   1.326
  132   2HB   LEU  17          1HB       LEU  17  -2.091  -8.538   2.384
  133    HG   LEU  17           HG       LEU  17   0.257  -7.218   2.029
  134   1HD1  LEU  17          1HD1      LEU  17  -0.967  -5.760   3.140
  135   2HD1  LEU  17          2HD1      LEU  17  -0.604  -6.604   4.645
  136   3HD1  LEU  17          3HD1      LEU  17  -2.028  -7.051   3.705
  137   1HD2  LEU  17          1HD2      LEU  17   1.496  -7.419   4.178
  138   2HD2  LEU  17          2HD2      LEU  17   1.646  -8.826   3.128
  139   3HD2  LEU  17          3HD2      LEU  17   0.571  -8.878   4.523
  140    H    SER  18           H        SER  18  -3.506 -10.252   3.375
  141    HA   SER  18           HA       SER  18  -3.908  -9.148   5.874
  142   1HB   SER  18          2HB       SER  18  -5.654  -9.805   4.113
  143   2HB   SER  18          1HB       SER  18  -5.609 -11.413   4.834
  144    HG   SER  18           HG       SER  18  -7.063 -10.567   6.111
  145    H    ALA  19           H        ALA  19  -3.262 -12.530   5.054
  146    HA   ALA  19           HA       ALA  19  -3.607 -13.613   7.628
  147   1HB   ALA  19          1HB       ALA  19  -3.454 -15.071   5.730
  148   2HB   ALA  19          2HB       ALA  19  -2.102 -15.431   6.803
  149   3HB   ALA  19          3HB       ALA  19  -1.839 -14.478   5.343
  150    H    ILE  20           H        ILE  20  -0.962 -11.983   6.063
  151    HA   ILE  20           HA       ILE  20   0.982 -12.524   8.086
  152    HB   ILE  20           HB       ILE  20   0.903 -10.717   5.698
  153   1HG1  ILE  20          2HG1      ILE  20   3.138 -12.241   5.547
  154   2HG1  ILE  20          1HG1      ILE  20   2.068 -13.300   6.455
  155   1HG2  ILE  20          1HG2      ILE  20   2.854 -10.651   7.956
  156   2HG2  ILE  20          2HG2      ILE  20   2.139  -9.315   7.056
  157   3HG2  ILE  20          3HG2      ILE  20   3.390 -10.311   6.311
  158   1HD1  ILE  20          1HD1      ILE  20   1.661 -12.164   3.712
  159   2HD1  ILE  20          2HD1      ILE  20   0.360 -12.907   4.641
  160   3HD1  ILE  20          3HD1      ILE  20   1.776 -13.857   4.194
  161    H    LEU  21           H        LEU  21  -0.476  -9.379   7.091
  162    HA   LEU  21           HA       LEU  21   0.437  -8.025   9.307
  163   1HB   LEU  21          2HB       LEU  21  -0.961  -6.219   8.759
  164   2HB   LEU  21          1HB       LEU  21  -0.413  -6.940   7.270
  165    HG   LEU  21           HG       LEU  21  -3.032  -6.301   8.026
  166   1HD1  LEU  21          1HD1      LEU  21  -1.970  -7.928   5.726
  167   2HD1  LEU  21          2HD1      LEU  21  -2.154  -6.174   5.782
  168   3HD1  LEU  21          3HD1      LEU  21  -3.579  -7.211   5.812
  169   1HD2  LEU  21          1HD2      LEU  21  -4.067  -8.564   7.630
  170   2HD2  LEU  21          2HD2      LEU  21  -3.358  -8.277   9.214
  171   3HD2  LEU  21          3HD2      LEU  21  -2.487  -9.231   8.013
  172    H    GLU  22           H        GLU  22  -1.892 -10.424   9.290
  173    HA   GLU  22           HA       GLU  22  -3.312  -9.458  11.616
  174   1HB   GLU  22          2HB       GLU  22  -3.571 -11.704   9.735
  175   2HB   GLU  22          1HB       GLU  22  -4.054 -12.052  11.388
  176   1HG   GLU  22          2HG       GLU  22  -5.916 -10.835  11.227
  177   2HG   GLU  22          1HG       GLU  22  -5.101  -9.526  10.372
  178    H    GLU  23           H        GLU  23  -0.599 -11.483  10.858
  179    HA   GLU  23           HA       GLU  23  -0.526 -12.752  13.450
  180   1HB   GLU  23          2HB       GLU  23   0.296 -14.094  11.692
  181   2HB   GLU  23          1HB       GLU  23   1.259 -12.782  11.027
  182   1HG   GLU  23          2HG       GLU  23   3.014 -13.307  12.273
  183   2HG   GLU  23          1HG       GLU  23   2.039 -13.436  13.735
  184    H    GLU  24           H        GLU  24   1.033 -10.084  11.789
  185    HA   GLU  24           HA       GLU  24   2.998  -9.606  13.803
  186   1HB   GLU  24          2HB       GLU  24   2.044  -8.142  11.385
  187   2HB   GLU  24          1HB       GLU  24   3.039  -7.299  12.564
  188   1HG   GLU  24          2HG       GLU  24   4.305  -8.270  10.668
  189   2HG   GLU  24          1HG       GLU  24   4.838  -8.827  12.253
  190    H    GLY  25           H        GLY  25  -0.036  -7.974  12.914
  191   1HA   GLY  25          2HA       GLY  25  -1.496  -7.392  14.835
  192   2HA   GLY  25          1HA       GLY  25  -0.045  -6.764  15.593
  193    H    TYR  26           H        TYR  26  -1.605  -6.421  12.412
  194    HA   TYR  26           HA       TYR  26  -1.355  -3.498  12.719
  195   1HB   TYR  26          2HB       TYR  26  -1.046  -5.232  10.273
  196   2HB   TYR  26          1HB       TYR  26  -1.283  -3.494  10.171
  197    HD1  TYR  26           1HD      TYR  26   0.463  -1.957  10.949
  198    HD2  TYR  26           2HD      TYR  26   1.053  -6.170  10.968
  199    HE1  TYR  26           1HE      TYR  26   2.884  -1.611  11.192
  200    HE2  TYR  26           2HE      TYR  26   3.475  -5.836  11.214
  201    HH   TYR  26           HH       TYR  26   5.155  -4.171  10.838
  202    H    HIS  27           H        HIS  27  -2.829  -2.548  10.753
  203    HA   HIS  27           HA       HIS  27  -5.483  -3.794  10.946
  204   1HB   HIS  27          2HB       HIS  27  -4.844  -1.566  12.375
  205   2HB   HIS  27          1HB       HIS  27  -5.427  -0.839  10.882
  206    HD1  HIS  27           1HD      HIS  27  -6.566  -2.394  13.993
  207    HD2  HIS  27           2HD      HIS  27  -8.166  -1.561  10.249
  208    HE1  HIS  27           1HE      HIS  27  -9.059  -2.598  14.266
  209    HE2  HIS  27           2HE      HIS  27 -10.002  -2.153  11.973
  210    HA   PRO  28           HA       PRO  28  -4.566  -2.854   6.569
  211   1HB   PRO  28          2HB       PRO  28  -5.458  -5.138   5.516
  212   2HB   PRO  28          1HB       PRO  28  -3.890  -5.042   6.326
  213   1HG   PRO  28          2HG       PRO  28  -6.487  -6.097   7.353
  214   2HG   PRO  28          1HG       PRO  28  -4.861  -6.755   7.555
  215   1HD   PRO  28          2HD       PRO  28  -6.177  -5.241   9.449
  216   2HD   PRO  28          1HD       PRO  28  -4.414  -5.409   9.349
  217    H    ASP  29           H        ASP  29  -5.890  -1.584   5.518
  218    HA   ASP  29           HA       ASP  29  -8.769  -1.947   5.813
  219   1HB   ASP  29          2HB       ASP  29  -7.087   0.351   5.637
  220   2HB   ASP  29          1HB       ASP  29  -8.286   0.400   4.350
  221    H    THR  30           H        THR  30  -6.641  -3.138   3.897
  222    HA   THR  30           HA       THR  30  -6.441  -3.213   1.500
  223    HB   THR  30           HB       THR  30  -7.319  -5.348   1.039
  224    HG1  THR  30           1HG      THR  30  -9.235  -4.736   3.023
  225   1HG2  THR  30          1HG2      THR  30  -6.244  -6.489   2.613
  226   2HG2  THR  30          2HG2      THR  30  -7.293  -5.886   3.895
  227   3HG2  THR  30          3HG2      THR  30  -5.920  -4.920   3.352
  228    H    ALA  31           H        ALA  31  -7.089  -2.293  -0.270
  229    HA   ALA  31           HA       ALA  31  -9.956  -1.718  -0.633
  230   1HB   ALA  31          1HB       ALA  31  -8.786   0.347  -0.438
  231   2HB   ALA  31          2HB       ALA  31  -9.176   0.131  -2.145
  232   3HB   ALA  31          3HB       ALA  31  -7.538  -0.181  -1.568
  233    H    LYS  32           H        LYS  32 -10.561  -1.529  -3.016
  234    HA   LYS  32           HA       LYS  32  -9.593  -3.922  -4.351
  235   1HB   LYS  32          2HB       LYS  32 -11.729  -2.110  -5.432
  236   2HB   LYS  32          1HB       LYS  32 -11.529  -3.840  -5.668
  237   1HG   LYS  32          2HG       LYS  32 -12.191  -4.262  -3.379
  238   2HG   LYS  32          1HG       LYS  32 -12.310  -2.527  -3.074
  239   1HD   LYS  32          2HD       LYS  32 -14.060  -2.390  -4.826
  240   2HD   LYS  32          1HD       LYS  32 -13.987  -4.145  -4.991
  241   1HE   LYS  32          2HE       LYS  32 -14.723  -2.621  -2.493
  242   2HE   LYS  32          1HE       LYS  32 -15.843  -3.472  -3.557
  243   1HZ   LYS  32          1HZ       LYS  32 -14.772  -5.546  -3.004
  244   2HZ   LYS  32          2HZ       LYS  32 -15.262  -4.770  -1.584
  245   3HZ   LYS  32          3HZ       LYS  32 -13.633  -4.751  -2.038
  246    H    THR  33           H        THR  33  -9.687  -0.439  -4.857
  247    HA   THR  33           HA       THR  33  -7.494  -0.641  -6.722
  248    HB   THR  33           HB       THR  33  -8.775   0.794  -8.419
  249    HG1  THR  33           1HG      THR  33 -10.984   0.641  -8.361
  250   1HG2  THR  33          1HG2      THR  33  -8.345  -1.850  -8.404
  251   2HG2  THR  33          2HG2      THR  33  -9.195  -1.003  -9.697
  252   3HG2  THR  33          3HG2      THR  33 -10.108  -1.827  -8.433
  253    H    LEU  34           H        LEU  34  -7.164   1.757  -7.665
  254    HA   LEU  34           HA       LEU  34  -6.482   3.340  -5.447
  255   1HB   LEU  34          2HB       LEU  34  -6.822   4.313  -8.282
  256   2HB   LEU  34          1HB       LEU  34  -5.815   5.019  -7.032
  257    HG   LEU  34           HG       LEU  34  -5.304   2.229  -8.014
  258   1HD1  LEU  34          1HD1      LEU  34  -3.978   4.656  -9.177
  259   2HD1  LEU  34          2HD1      LEU  34  -5.400   3.918  -9.916
  260   3HD1  LEU  34          3HD1      LEU  34  -3.913   2.986  -9.740
  261   1HD2  LEU  34          1HD2      LEU  34  -4.249   3.588  -5.943
  262   2HD2  LEU  34          2HD2      LEU  34  -3.145   4.072  -7.229
  263   3HD2  LEU  34          3HD2      LEU  34  -3.372   2.363  -6.860
  264    H    ARG  35           H        ARG  35  -9.297   3.295  -7.531
  265    HA   ARG  35           HA       ARG  35 -10.402   5.766  -6.701
  266   1HB   ARG  35          2HB       ARG  35 -11.602   3.285  -7.925
  267   2HB   ARG  35          1HB       ARG  35 -12.583   4.684  -7.508
  268   1HG   ARG  35          2HG       ARG  35 -12.156   5.188  -9.672
  269   2HG   ARG  35          1HG       ARG  35 -10.735   5.934  -8.941
  270   1HD   ARG  35          2HD       ARG  35 -10.062   3.244  -9.371
  271   2HD   ARG  35          1HD       ARG  35 -10.895   3.774 -10.831
  272    HE   ARG  35           HE       ARG  35  -8.304   4.600  -9.920
  273   1HH1  ARG  35          1HH1      ARG  35 -11.077   5.522 -11.828
  274   2HH1  ARG  35          2HH1      ARG  35 -10.181   6.616 -12.828
  275   1HH2  ARG  35          1HH2      ARG  35  -7.124   6.039 -11.234
  276   2HH2  ARG  35          2HH2      ARG  35  -7.938   6.909 -12.491
  277    H    GLU  36           H        GLU  36 -10.946   2.417  -5.655
  278    HA   GLU  36           HA       GLU  36 -12.805   3.081  -3.615
  279   1HB   GLU  36          2HB       GLU  36 -12.007   0.752  -4.796
  280   2HB   GLU  36          1HB       GLU  36 -11.213   0.632  -3.232
  281   1HG   GLU  36          2HG       GLU  36 -14.079   1.397  -3.288
  282   2HG   GLU  36          1HG       GLU  36 -13.653  -0.278  -3.635
  283    H    ALA  37           H        ALA  37  -9.323   2.913  -3.778
  284    HA   ALA  37           HA       ALA  37  -8.866   2.887  -0.964
  285   1HB   ALA  37          1HB       ALA  37  -6.905   3.964  -2.960
  286   2HB   ALA  37          2HB       ALA  37  -7.251   2.237  -2.866
  287   3HB   ALA  37          3HB       ALA  37  -6.599   3.083  -1.463
  288    H    GLU  38           H        GLU  38  -9.310   5.399  -3.373
  289    HA   GLU  38           HA       GLU  38  -8.450   7.563  -1.748
  290   1HB   GLU  38          2HB       GLU  38 -10.232   7.418  -4.174
  291   2HB   GLU  38          1HB       GLU  38  -9.836   8.934  -3.377
  292   1HG   GLU  38          2HG       GLU  38  -7.576   8.780  -3.953
  293   2HG   GLU  38          1HG       GLU  38  -7.706   7.067  -4.352
  294    H    LYS  39           H        LYS  39 -11.579   6.055  -2.392
  295    HA   LYS  39           HA       LYS  39 -13.152   7.841  -0.886
  296   1HB   LYS  39          2HB       LYS  39 -14.208   6.348  -2.449
  297   2HB   LYS  39          1HB       LYS  39 -13.559   4.939  -1.624
  298   1HG   LYS  39          2HG       LYS  39 -15.359   6.804  -0.149
  299   2HG   LYS  39          1HG       LYS  39 -16.042   5.637  -1.284
  300   1HD   LYS  39          2HD       LYS  39 -14.463   3.975   0.036
  301   2HD   LYS  39          1HD       LYS  39 -14.647   5.187   1.306
  302   1HE   LYS  39          2HE       LYS  39 -17.127   4.364  -0.058
  303   2HE   LYS  39          1HE       LYS  39 -16.348   3.126   0.927
  304   1HZ   LYS  39          1HZ       LYS  39 -17.567   4.111   2.531
  305   2HZ   LYS  39          2HZ       LYS  39 -17.646   5.603   1.739
  306   3HZ   LYS  39          3HZ       LYS  39 -16.253   5.173   2.598
  307    H    LYS  40           H        LYS  40 -11.246   5.025  -0.031
  308    HA   LYS  40           HA       LYS  40 -12.261   4.828   2.644
  309   1HB   LYS  40          2HB       LYS  40  -9.789   3.662   1.357
  310   2HB   LYS  40          1HB       LYS  40 -10.349   3.270   2.976
  311   1HG   LYS  40          2HG       LYS  40 -12.179   2.906   0.649
  312   2HG   LYS  40          1HG       LYS  40 -10.927   1.709   0.985
  313   1HD   LYS  40          2HD       LYS  40 -12.622   0.828   2.233
  314   2HD   LYS  40          1HD       LYS  40 -11.915   1.908   3.436
  315   1HE   LYS  40          2HE       LYS  40 -13.683   3.539   2.103
  316   2HE   LYS  40          1HE       LYS  40 -14.529   1.993   2.145
  317   1HZ   LYS  40          1HZ       LYS  40 -15.138   3.083   4.102
  318   2HZ   LYS  40          2HZ       LYS  40 -13.562   3.611   4.423
  319   3HZ   LYS  40          3HZ       LYS  40 -13.958   1.977   4.599
  320    H    ILE  41           H        ILE  41  -9.372   6.194   1.124
  321    HA   ILE  41           HA       ILE  41  -8.181   7.042   3.573
  322    HB   ILE  41           HB       ILE  41  -7.646   8.044   0.775
  323   1HG1  ILE  41          2HG1      ILE  41  -5.845   6.107   2.130
  324   2HG1  ILE  41          1HG1      ILE  41  -7.372   5.481   1.514
  325   1HG2  ILE  41          1HG2      ILE  41  -6.019   8.213   3.305
  326   2HG2  ILE  41          2HG2      ILE  41  -6.762   9.552   2.430
  327   3HG2  ILE  41          3HG2      ILE  41  -5.433   8.652   1.701
  328   1HD1  ILE  41          1HD1      ILE  41  -6.739   6.567  -0.693
  329   2HD1  ILE  41          2HD1      ILE  41  -5.825   5.141  -0.202
  330   3HD1  ILE  41          3HD1      ILE  41  -5.124   6.747  -0.008
  331    H    LYS  42           H        LYS  42 -10.513   8.409   1.383
  332    HA   LYS  42           HA       LYS  42 -10.296  11.112   1.873
  333   1HB   LYS  42          2HB       LYS  42 -12.029   9.548   0.498
  334   2HB   LYS  42          1HB       LYS  42 -13.052  10.104   1.815
  335   1HG   LYS  42          2HG       LYS  42 -13.059  12.248   1.093
  336   2HG   LYS  42          1HG       LYS  42 -11.428  12.146   0.428
  337   1HD   LYS  42          2HD       LYS  42 -12.270  11.828  -1.605
  338   2HD   LYS  42          1HD       LYS  42 -13.094  10.373  -1.044
  339   1HE   LYS  42          2HE       LYS  42 -15.088  11.411  -0.883
  340   2HE   LYS  42          1HE       LYS  42 -14.376  12.908  -0.286
  341   1HZ   LYS  42          1HZ       LYS  42 -15.436  12.655  -2.706
  342   2HZ   LYS  42          2HZ       LYS  42 -13.830  12.261  -3.065
  343   3HZ   LYS  42          3HZ       LYS  42 -14.197  13.750  -2.352
  344    H    GLU  43           H        GLU  43 -11.444   8.610   3.978
  345    HA   GLU  43           HA       GLU  43 -12.085  10.646   5.999
  346   1HB   GLU  43          2HB       GLU  43 -13.341   7.911   5.722
  347   2HB   GLU  43          1HB       GLU  43 -13.729   9.109   6.949
  348   1HG   GLU  43          2HG       GLU  43 -14.801  10.502   5.429
  349   2HG   GLU  43          1HG       GLU  43 -14.032   9.735   4.041
  350    H    LEU  44           H        LEU  44 -10.844   7.384   5.423
  351    HA   LEU  44           HA       LEU  44  -9.804   7.184   8.118
  352   1HB   LEU  44          2HB       LEU  44 -10.514   5.364   6.095
  353   2HB   LEU  44          1HB       LEU  44  -8.783   5.182   6.309
  354    HG   LEU  44           HG       LEU  44  -9.982   3.595   7.701
  355   1HD1  LEU  44          1HD1      LEU  44  -8.943   4.083   9.823
  356   2HD1  LEU  44          2HD1      LEU  44  -8.775   5.783   9.386
  357   3HD1  LEU  44          3HD1      LEU  44  -7.860   4.553   8.513
  358   1HD2  LEU  44          1HD2      LEU  44 -11.661   4.113   9.170
  359   2HD2  LEU  44          2HD2      LEU  44 -11.965   5.308   7.909
  360   3HD2  LEU  44          3HD2      LEU  44 -11.114   5.777   9.382
  361    H    PHE  45           H        PHE  45  -7.694   7.351   8.736
  362    HA   PHE  45           HA       PHE  45  -5.861   8.490   6.743
  363   1HB   PHE  45          2HB       PHE  45  -6.399   9.822   8.803
  364   2HB   PHE  45          1HB       PHE  45  -5.609   8.569   9.755
  365    HD1  PHE  45           1HD      PHE  45  -5.169  11.591   7.962
  366    HD2  PHE  45           2HD      PHE  45  -3.159   8.038   9.162
  367    HE1  PHE  45           1HE      PHE  45  -3.003  12.705   7.618
  368    HE2  PHE  45           2HE      PHE  45  -0.988   9.145   8.822
  369    HZ   PHE  45           HZ       PHE  45  -0.908  11.483   8.049
  370    H    PHE  46           H        PHE  46  -4.779   6.834   5.821
  371    HA   PHE  46           HA       PHE  46  -3.749   4.679   7.499
  372   1HB   PHE  46          2HB       PHE  46  -3.640   5.000   4.493
  373   2HB   PHE  46          1HB       PHE  46  -3.176   3.564   5.399
  374    HD1  PHE  46           1HD      PHE  46  -5.511   4.549   3.262
  375    HD2  PHE  46           2HD      PHE  46  -5.293   3.135   7.268
  376    HE1  PHE  46           1HE      PHE  46  -7.814   3.706   3.082
  377    HE2  PHE  46           2HE      PHE  46  -7.597   2.287   7.097
  378    HZ   PHE  46           HZ       PHE  46  -8.861   2.574   5.002
  379    HA   PRO  47           HA       PRO  47   0.202   6.825   7.550
  380   1HB   PRO  47          2HB       PRO  47   1.507   5.065   9.128
  381   2HB   PRO  47          1HB       PRO  47   0.323   6.209   9.773
  382   1HG   PRO  47          2HG       PRO  47  -0.005   3.313   9.112
  383   2HG   PRO  47          1HG       PRO  47  -0.595   4.211  10.522
  384   1HD   PRO  47          2HD       PRO  47  -2.167   3.591   8.383
  385   2HD   PRO  47          1HD       PRO  47  -2.420   5.027   9.391
  386    H    VAL  48           H        VAL  48  -0.570   3.738   6.307
  387    HA   VAL  48           HA       VAL  48   1.733   3.797   4.563
  388    HB   VAL  48           HB       VAL  48   1.163   1.213   5.967
  389   1HG1  VAL  48          1HG1      VAL  48   2.730   1.806   3.842
  390   2HG1  VAL  48          2HG1      VAL  48   3.008   0.452   4.937
  391   3HG1  VAL  48          3HG1      VAL  48   3.885   1.966   5.166
  392   1HG2  VAL  48          1HG2      VAL  48   1.571   2.783   7.743
  393   2HG2  VAL  48          2HG2      VAL  48   3.011   3.383   6.922
  394   3HG2  VAL  48          3HG2      VAL  48   2.974   1.733   7.543
  395    H    ILE  49           H        ILE  49   1.247   3.035   2.585
  396    HA   ILE  49           HA       ILE  49  -1.311   1.630   2.213
  397    HB   ILE  49           HB       ILE  49   0.051   3.265   0.082
  398   1HG1  ILE  49          2HG1      ILE  49  -0.358   4.808   1.901
  399   2HG1  ILE  49          1HG1      ILE  49  -1.553   5.089   0.639
  400   1HG2  ILE  49          1HG2      ILE  49  -2.464   1.778   0.360
  401   2HG2  ILE  49          2HG2      ILE  49  -1.524   2.163  -1.081
  402   3HG2  ILE  49          3HG2      ILE  49  -2.616   3.364  -0.393
  403   1HD1  ILE  49          1HD1      ILE  49  -1.911   3.859   3.335
  404   2HD1  ILE  49          2HD1      ILE  49  -3.054   3.528   2.033
  405   3HD1  ILE  49          3HD1      ILE  49  -2.796   5.185   2.581
  406    H    VAL  50           H        VAL  50  -1.331   0.138   0.282
  407    HA   VAL  50           HA       VAL  50   1.288  -0.769  -0.581
  408    HB   VAL  50           HB       VAL  50  -0.602  -2.637   0.851
  409   1HG1  VAL  50          1HG1      VAL  50   1.697  -4.009   0.605
  410   2HG1  VAL  50          2HG1      VAL  50   1.759  -3.054  -0.876
  411   3HG1  VAL  50          3HG1      VAL  50   0.379  -4.108  -0.563
  412   1HG2  VAL  50          1HG2      VAL  50   1.168  -2.802   2.521
  413   2HG2  VAL  50          2HG2      VAL  50   0.576  -1.148   2.376
  414   3HG2  VAL  50          3HG2      VAL  50   2.114  -1.601   1.641
  415    H    LEU  51           H        LEU  51   0.764  -0.303  -2.646
  416    HA   LEU  51           HA       LEU  51  -1.672  -1.217  -3.869
  417   1HB   LEU  51          2HB       LEU  51  -0.286   0.848  -4.495
  418   2HB   LEU  51          1HB       LEU  51   0.786  -0.267  -5.316
  419    HG   LEU  51           HG       LEU  51  -0.904  -0.886  -6.881
  420   1HD1  LEU  51          1HD1      LEU  51  -2.846  -1.064  -5.539
  421   2HD1  LEU  51          2HD1      LEU  51  -3.184   0.182  -6.740
  422   3HD1  LEU  51          3HD1      LEU  51  -2.776   0.640  -5.087
  423   1HD2  LEU  51          1HD2      LEU  51  -0.584   2.037  -6.369
  424   2HD2  LEU  51          2HD2      LEU  51  -1.649   1.483  -7.662
  425   3HD2  LEU  51          3HD2      LEU  51   0.060   1.047  -7.678
  426    H    ASP  52           H        ASP  52  -1.457  -2.488  -6.005
  427    HA   ASP  52           HA       ASP  52   0.577  -4.586  -5.819
  428   1HB   ASP  52          2HB       ASP  52  -1.749  -5.142  -4.710
  429   2HB   ASP  52          1HB       ASP  52  -2.241  -5.415  -6.379
  430    H    VAL  53           H        VAL  53  -2.134  -3.289  -7.715
  431    HA   VAL  53           HA       VAL  53  -2.378  -2.937  -9.952
  432    HB   VAL  53           HB       VAL  53   0.570  -3.531 -10.214
  433   1HG1  VAL  53          1HG1      VAL  53   0.409  -2.880 -12.344
  434   2HG1  VAL  53          2HG1      VAL  53  -0.608  -1.499 -11.933
  435   3HG1  VAL  53          3HG1      VAL  53  -1.331  -3.092 -12.156
  436   1HG2  VAL  53          1HG2      VAL  53   0.289  -1.829  -8.522
  437   2HG2  VAL  53          2HG2      VAL  53  -0.800  -0.923  -9.571
  438   3HG2  VAL  53          3HG2      VAL  53   0.902  -1.092 -10.003
  439    H    TRP  54           H        TRP  54  -2.941  -5.492  -8.930
  440    HA   TRP  54           HA       TRP  54  -1.804  -7.629 -10.324
  441   1HB   TRP  54          2HB       TRP  54  -3.234  -8.036  -8.423
  442   2HB   TRP  54          1HB       TRP  54  -4.601  -7.275  -9.226
  443    HD1  TRP  54           HD       TRP  54  -6.289  -9.109  -9.786
  444    HE1  TRP  54           1HE      TRP  54  -6.182 -11.473 -10.796
  445    HE3  TRP  54           3HE      TRP  54  -1.216  -9.580 -10.216
  446    HZ2  TRP  54           2HZ      TRP  54  -4.208 -13.298 -11.660
  447    HZ3  TRP  54           3HZ      TRP  54  -0.300 -11.667 -11.143
  448    HH2  TRP  54           HH       TRP  54  -1.767 -13.487 -11.850
  449    H    MET  55           H        MET  55  -5.130  -6.585 -10.992
  450    HA   MET  55           HA       MET  55  -4.523  -6.272 -13.816
  451   1HB   MET  55          2HB       MET  55  -6.086  -8.531 -12.677
  452   2HB   MET  55          1HB       MET  55  -6.693  -7.796 -14.154
  453   1HG   MET  55          2HG       MET  55  -3.826  -8.414 -14.168
  454   2HG   MET  55          1HG       MET  55  -4.895  -9.811 -14.061
  455   1HE   MET  55          1HE       MET  55  -6.691 -10.258 -16.996
  456   2HE   MET  55          2HE       MET  55  -7.477  -8.746 -16.538
  457   3HE   MET  55          3HE       MET  55  -6.990  -9.899 -15.295
  458    HA   PRO  56           HA       PRO  56  -8.071  -3.671 -12.200
  459   1HB   PRO  56          2HB       PRO  56  -6.496  -1.402 -11.573
  460   2HB   PRO  56          1HB       PRO  56  -7.252  -2.515 -10.435
  461   1HG   PRO  56          2HG       PRO  56  -4.512  -2.179 -10.817
  462   2HG   PRO  56          1HG       PRO  56  -5.285  -3.536  -9.988
  463   1HD   PRO  56          2HD       PRO  56  -4.262  -3.356 -12.789
  464   2HD   PRO  56          1HD       PRO  56  -4.230  -4.723 -11.658
  465    H    ASP  57           H        ASP  57  -7.874  -0.883 -12.687
  466    HA   ASP  57           HA       ASP  57  -6.989  -0.582 -15.440
  467   1HB   ASP  57          2HB       ASP  57  -9.880  -0.170 -14.650
  468   2HB   ASP  57          1HB       ASP  57  -9.181   0.202 -16.223
  469    H    GLY  58           H        GLY  58  -6.069   0.586 -13.033
  470   1HA   GLY  58          2HA       GLY  58  -6.768   3.403 -13.560
  471   2HA   GLY  58          1HA       GLY  58  -6.643   2.800 -11.915
  472    H    ASP  59           H        ASP  59  -5.130   4.928 -12.597
  473    HA   ASP  59           HA       ASP  59  -2.441   3.842 -13.082
  474   1HB   ASP  59          2HB       ASP  59  -3.786   6.237 -13.961
  475   2HB   ASP  59          1HB       ASP  59  -2.324   6.658 -13.074
  476    H    GLY  60           H        GLY  60  -1.382   3.395 -11.268
  477   1HA   GLY  60          2HA       GLY  60  -2.018   4.723  -8.784
  478   2HA   GLY  60          1HA       GLY  60  -0.832   3.448  -9.013
  479    H    VAL  61           H        VAL  61   0.278   5.191 -11.305
  480    HA   VAL  61           HA       VAL  61   2.464   6.243  -9.997
  481    HB   VAL  61           HB       VAL  61   1.329   7.355 -12.562
  482   1HG1  VAL  61          1HG1      VAL  61   3.971   7.424 -11.200
  483   2HG1  VAL  61          2HG1      VAL  61   3.115   8.694 -12.076
  484   3HG1  VAL  61          3HG1      VAL  61   3.923   7.402 -12.963
  485   1HG2  VAL  61          1HG2      VAL  61   2.816   4.805 -12.025
  486   2HG2  VAL  61          2HG2      VAL  61   2.908   5.610 -13.592
  487   3HG2  VAL  61          3HG2      VAL  61   1.352   5.056 -12.976
  488    H    ASN  62           H        ASN  62  -0.461   7.957 -11.081
  489    HA   ASN  62           HA       ASN  62   0.391  10.426  -9.867
  490   1HB   ASN  62          2HB       ASN  62  -1.481   9.682 -11.837
  491   2HB   ASN  62          1HB       ASN  62  -2.413  10.399 -10.528
  492   1HD2  ASN  62          1HD2      ASN  62   0.513  10.954 -12.446
  493   2HD2  ASN  62          2HD2      ASN  62   0.329  12.669 -12.548
  494    H    PHE  63           H        PHE  63  -1.176   7.622  -8.768
  495    HA   PHE  63           HA       PHE  63  -2.891   8.806  -6.828
  496   1HB   PHE  63          2HB       PHE  63  -3.275   6.532  -7.649
  497   2HB   PHE  63          1HB       PHE  63  -1.742   6.010  -6.956
  498    HD1  PHE  63           1HD      PHE  63  -4.740   7.898  -5.775
  499    HD2  PHE  63           2HD      PHE  63  -1.948   4.771  -5.045
  500    HE1  PHE  63           1HE      PHE  63  -5.874   7.385  -3.654
  501    HE2  PHE  63           2HE      PHE  63  -3.080   4.252  -2.922
  502    HZ   PHE  63           HZ       PHE  63  -5.047   5.562  -2.224
  503    H    ILE  64           H        ILE  64   0.432   7.626  -6.783
  504    HA   ILE  64           HA       ILE  64   0.978   7.513  -4.102
  505    HB   ILE  64           HB       ILE  64   2.795   8.659  -6.227
  506   1HG1  ILE  64          2HG1      ILE  64   3.408   5.971  -5.396
  507   2HG1  ILE  64          1HG1      ILE  64   1.730   6.058  -5.919
  508   1HG2  ILE  64          1HG2      ILE  64   4.615   7.915  -4.713
  509   2HG2  ILE  64          2HG2      ILE  64   3.400   7.560  -3.485
  510   3HG2  ILE  64          3HG2      ILE  64   3.633   9.218  -4.043
  511   1HD1  ILE  64          1HD1      ILE  64   3.553   5.495  -7.640
  512   2HD1  ILE  64          2HD1      ILE  64   3.906   7.223  -7.599
  513   3HD1  ILE  64          3HD1      ILE  64   2.304   6.662  -8.075
  514    H    ASP  65           H        ASP  65   0.414  10.355  -6.040
  515    HA   ASP  65           HA       ASP  65   1.424  12.201  -4.080
  516   1HB   ASP  65          2HB       ASP  65   0.868  12.395  -6.756
  517   2HB   ASP  65          1HB       ASP  65  -0.512  13.229  -6.047
  518    H    PHE  66           H        PHE  66  -1.672  10.798  -4.918
  519    HA   PHE  66           HA       PHE  66  -3.346  12.494  -3.443
  520   1HB   PHE  66          2HB       PHE  66  -4.269  10.919  -5.036
  521   2HB   PHE  66          1HB       PHE  66  -3.628   9.558  -4.124
  522    HD1  PHE  66           1HD      PHE  66  -4.741   8.733  -2.179
  523    HD2  PHE  66           2HD      PHE  66  -6.186  12.189  -4.198
  524    HE1  PHE  66           1HE      PHE  66  -6.844   8.591  -0.912
  525    HE2  PHE  66           2HE      PHE  66  -8.291  12.053  -2.933
  526    HZ   PHE  66           HZ       PHE  66  -8.623  10.251  -1.287
  527    H    ILE  67           H        ILE  67  -1.468   9.655  -2.525
  528    HA   ILE  67           HA       ILE  67  -2.496   9.305   0.063
  529    HB   ILE  67           HB       ILE  67   0.219   8.662  -1.092
  530   1HG1  ILE  67          2HG1      ILE  67  -0.767   6.294  -0.725
  531   2HG1  ILE  67          1HG1      ILE  67  -2.314   7.122  -0.583
  532   1HG2  ILE  67          1HG2      ILE  67   0.885   8.632   1.072
  533   2HG2  ILE  67          2HG2      ILE  67   0.096   7.055   1.053
  534   3HG2  ILE  67          3HG2      ILE  67  -0.759   8.460   1.689
  535   1HD1  ILE  67          1HD1      ILE  67  -0.699   7.824  -2.937
  536   2HD1  ILE  67          2HD1      ILE  67  -2.434   7.546  -2.786
  537   3HD1  ILE  67          3HD1      ILE  67  -1.326   6.176  -2.887
  538    H    LYS  68           H        LYS  68   0.242  11.239  -1.122
  539    HA   LYS  68           HA       LYS  68   0.819  12.295   1.492
  540   1HB   LYS  68          2HB       LYS  68   1.774  13.382  -1.157
  541   2HB   LYS  68          1HB       LYS  68   2.523  13.587   0.420
  542   1HG   LYS  68          2HG       LYS  68   2.431  10.844   0.091
  543   2HG   LYS  68          1HG       LYS  68   2.821  11.454  -1.519
  544   1HD   LYS  68          2HD       LYS  68   4.832  12.313  -0.855
  545   2HD   LYS  68          1HD       LYS  68   4.282  12.613   0.794
  546   1HE   LYS  68          2HE       LYS  68   4.689  10.449   1.468
  547   2HE   LYS  68          1HE       LYS  68   4.541   9.801  -0.165
  548   1HZ   LYS  68          1HZ       LYS  68   6.855  10.926   1.180
  549   2HZ   LYS  68          2HZ       LYS  68   6.674  11.362  -0.446
  550   3HZ   LYS  68          3HZ       LYS  68   6.770   9.730  -0.013
  551    H    GLU  69           H        GLU  69  -1.227  13.125  -1.161
  552    HA   GLU  69           HA       GLU  69  -1.528  15.885  -0.691
  553   1HB   GLU  69          2HB       GLU  69  -2.244  14.641  -2.750
  554   2HB   GLU  69          1HB       GLU  69  -3.598  14.010  -1.826
  555   1HG   GLU  69          2HG       GLU  69  -4.597  16.116  -1.631
  556   2HG   GLU  69          1HG       GLU  69  -3.118  16.954  -2.100
  557    H    ASN  70           H        ASN  70  -3.030  13.052   0.712
  558    HA   ASN  70           HA       ASN  70  -4.376  14.803   2.654
  559   1HB   ASN  70          2HB       ASN  70  -6.059  12.672   2.620
  560   2HB   ASN  70          1HB       ASN  70  -6.314  14.141   1.685
  561   1HD2  ASN  70          1HD2      ASN  70  -5.166  14.109  -0.495
  562   2HD2  ASN  70          2HD2      ASN  70  -5.298  12.647  -1.404
  563    H    SER  71           H        SER  71  -1.867  13.021   2.526
  564    HA   SER  71           HA       SER  71  -2.011  12.130   5.223
  565   1HB   SER  71          2HB       SER  71  -2.699  10.228   3.143
  566   2HB   SER  71          1HB       SER  71  -1.279   9.698   4.043
  567    HG   SER  71           HG       SER  71  -2.477   9.905   5.953
  568    HA   PRO  72           HA       PRO  72   2.180  13.102   3.429
  569   1HB   PRO  72          2HB       PRO  72   2.390  14.968   5.665
  570   2HB   PRO  72          1HB       PRO  72   2.559  15.281   3.936
  571   1HG   PRO  72          2HG       PRO  72   0.450  16.168   5.382
  572   2HG   PRO  72          1HG       PRO  72   0.326  15.739   3.667
  573   1HD   PRO  72          2HD       PRO  72  -0.486  14.167   6.080
  574   2HD   PRO  72          1HD       PRO  72  -1.320  14.352   4.522
  575    H    ASP  73           H        ASP  73   0.914  12.239   6.480
  576    HA   ASP  73           HA       ASP  73   3.540  11.441   7.500
  577   1HB   ASP  73          2HB       ASP  73   2.003  12.729   8.981
  578   2HB   ASP  73          1HB       ASP  73   0.871  11.383   8.915
  579    H    SER  74           H        SER  74   2.230  10.047   5.294
  580    HA   SER  74           HA       SER  74   1.783   7.426   6.555
  581   1HB   SER  74          2HB       SER  74  -0.185   8.244   5.338
  582   2HB   SER  74          1HB       SER  74   0.787   8.432   3.879
  583    HG   SER  74           HG       SER  74  -0.099   6.478   3.623
  584    H    VAL  75           H        VAL  75   2.030   5.896   4.176
  585    HA   VAL  75           HA       VAL  75   4.624   6.476   3.034
  586    HB   VAL  75           HB       VAL  75   4.286   3.906   4.582
  587   1HG1  VAL  75          1HG1      VAL  75   6.315   5.033   2.725
  588   2HG1  VAL  75          2HG1      VAL  75   5.792   3.365   2.953
  589   3HG1  VAL  75          3HG1      VAL  75   6.905   4.105   4.105
  590   1HG2  VAL  75          1HG2      VAL  75   4.483   5.693   6.170
  591   2HG2  VAL  75          2HG2      VAL  75   5.817   6.413   5.270
  592   3HG2  VAL  75          3HG2      VAL  75   6.034   4.861   6.079
  593    H    VAL  76           H        VAL  76   4.842   5.620   1.051
  594    HA   VAL  76           HA       VAL  76   2.686   3.822   0.159
  595    HB   VAL  76           HB       VAL  76   4.381   5.500  -1.669
  596   1HG1  VAL  76          1HG1      VAL  76   2.867   3.499  -2.383
  597   2HG1  VAL  76          2HG1      VAL  76   2.854   4.996  -3.314
  598   3HG1  VAL  76          3HG1      VAL  76   1.561   4.663  -2.161
  599   1HG2  VAL  76          1HG2      VAL  76   1.877   6.265  -0.191
  600   2HG2  VAL  76          2HG2      VAL  76   2.384   7.065  -1.679
  601   3HG2  VAL  76          3HG2      VAL  76   3.418   7.121  -0.251
  602    H    ILE  77           H        ILE  77   3.309   1.785   0.057
  603    HA   ILE  77           HA       ILE  77   6.016   1.173  -0.928
  604    HB   ILE  77           HB       ILE  77   4.220  -0.647   0.678
  605   1HG1  ILE  77          2HG1      ILE  77   4.904   1.357   1.972
  606   2HG1  ILE  77          1HG1      ILE  77   5.610  -0.127   2.606
  607   1HG2  ILE  77          1HG2      ILE  77   6.394  -1.254  -0.894
  608   2HG2  ILE  77          2HG2      ILE  77   5.764  -2.241   0.424
  609   3HG2  ILE  77          3HG2      ILE  77   7.093  -1.120   0.719
  610   1HD1  ILE  77          1HD1      ILE  77   7.468   0.844   0.770
  611   2HD1  ILE  77          2HD1      ILE  77   7.577   0.878   2.530
  612   3HD1  ILE  77          3HD1      ILE  77   6.899   2.256   1.661
  613    H    VAL  78           H        VAL  78   4.079   1.808  -2.781
  614    HA   VAL  78           HA       VAL  78   2.417  -0.049  -3.864
  615    HB   VAL  78           HB       VAL  78   4.358   1.642  -5.457
  616   1HG1  VAL  78          1HG1      VAL  78   1.641   1.107  -6.463
  617   2HG1  VAL  78          2HG1      VAL  78   2.726  -0.281  -6.439
  618   3HG1  VAL  78          3HG1      VAL  78   3.177   1.176  -7.325
  619   1HG2  VAL  78          1HG2      VAL  78   1.977   2.968  -5.473
  620   2HG2  VAL  78          2HG2      VAL  78   3.336   3.339  -4.413
  621   3HG2  VAL  78          3HG2      VAL  78   2.018   2.322  -3.833
  622    H    ILE  79           H        ILE  79   2.621  -2.099  -4.464
  623    HA   ILE  79           HA       ILE  79   5.238  -3.033  -5.454
  624    HB   ILE  79           HB       ILE  79   3.293  -4.897  -4.141
  625   1HG1  ILE  79          2HG1      ILE  79   5.409  -3.258  -2.731
  626   2HG1  ILE  79          1HG1      ILE  79   3.670  -3.104  -2.520
  627   1HG2  ILE  79          1HG2      ILE  79   5.523  -6.017  -3.582
  628   2HG2  ILE  79          2HG2      ILE  79   6.231  -4.895  -4.743
  629   3HG2  ILE  79          3HG2      ILE  79   4.994  -6.039  -5.264
  630   1HD1  ILE  79          1HD1      ILE  79   4.491  -4.327  -0.674
  631   2HD1  ILE  79          2HD1      ILE  79   5.423  -5.402  -1.715
  632   3HD1  ILE  79          3HD1      ILE  79   3.662  -5.481  -1.719
  633    H    THR  80           H        THR  80   5.219  -4.591  -7.127
  634    HA   THR  80           HA       THR  80   2.721  -5.436  -8.290
  635    HB   THR  80           HB       THR  80   2.976  -4.348 -10.425
  636    HG1  THR  80           1HG      THR  80   4.980  -3.947 -10.920
  637   1HG2  THR  80          1HG2      THR  80   1.863  -3.017  -8.665
  638   2HG2  THR  80          2HG2      THR  80   2.637  -2.043  -9.913
  639   3HG2  THR  80          3HG2      THR  80   3.405  -2.231  -8.337
  640    H    GLY  81           H        GLY  81   3.107  -6.755 -10.303
  641   1HA   GLY  81          2HA       GLY  81   5.786  -7.999 -10.234
  642   2HA   GLY  81          1HA       GLY  81   4.322  -8.971 -10.253
  643    H    HIS  82           H        HIS  82   5.828  -6.320 -12.099
  644    HA   HIS  82           HA       HIS  82   4.620  -7.362 -14.544
  645   1HB   HIS  82          2HB       HIS  82   4.803  -4.841 -13.781
  646   2HB   HIS  82          1HB       HIS  82   6.401  -4.960 -14.511
  647    HD1  HIS  82           1HD      HIS  82   2.946  -4.281 -15.325
  648    HD2  HIS  82           2HD      HIS  82   6.240  -5.820 -17.338
  649    HE1  HIS  82           1HE      HIS  82   2.390  -4.090 -17.770
  650    HE2  HIS  82           2HE      HIS  82   4.434  -4.944 -18.969
  651    H    GLY  83           H        GLY  83   7.720  -7.051 -12.967
  652   1HA   GLY  83          2HA       GLY  83   9.663  -8.236 -13.401
  653   2HA   GLY  83          1HA       GLY  83   8.880  -8.943 -14.806
  654    H    SER  84           H        SER  84   8.810  -5.511 -14.536
  655    HA   SER  84           HA       SER  84  10.954  -5.324 -16.550
  656   1HB   SER  84          2HB       SER  84   8.556  -3.494 -16.340
  657   2HB   SER  84          1HB       SER  84   9.754  -3.545 -17.634
  658    HG   SER  84           HG       SER  84   8.260  -4.791 -18.490
  659    H    VAL  85           H        VAL  85  10.069  -4.485 -13.439
  660    HA   VAL  85           HA       VAL  85  10.698  -2.874 -11.943
  661    HB   VAL  85           HB       VAL  85  13.121  -2.476 -11.848
  662   1HG1  VAL  85          1HG1      VAL  85  12.296  -5.311 -12.454
  663   2HG1  VAL  85          2HG1      VAL  85  12.280  -4.510 -10.883
  664   3HG1  VAL  85          3HG1      VAL  85  13.814  -4.854 -11.681
  665   1HG2  VAL  85          1HG2      VAL  85  14.627  -3.280 -13.506
  666   2HG2  VAL  85          2HG2      VAL  85  13.414  -2.305 -14.336
  667   3HG2  VAL  85          3HG2      VAL  85  13.324  -4.065 -14.398
  668    H    ASP  86           H        ASP  86   9.532  -1.805 -14.387
  669    HA   ASP  86           HA       ASP  86  10.947   0.774 -14.563
  670   1HB   ASP  86          2HB       ASP  86   9.734   1.095 -16.707
  671   2HB   ASP  86          1HB       ASP  86  10.781  -0.322 -16.723
  672    H    THR  87           H        THR  87   8.229  -0.723 -13.256
  673    HA   THR  87           HA       THR  87   6.550   1.655 -13.378
  674    HB   THR  87           HB       THR  87   5.729  -0.817 -13.510
  675    HG1  THR  87           1HG      THR  87   4.425   0.939 -11.712
  676   1HG2  THR  87          1HG2      THR  87   6.760  -1.672 -11.486
  677   2HG2  THR  87          2HG2      THR  87   5.002  -1.755 -11.382
  678   3HG2  THR  87          3HG2      THR  87   5.876  -0.490 -10.521
  679    H    ALA  88           H        ALA  88   8.520  -0.178 -11.135
  680    HA   ALA  88           HA       ALA  88   7.830   1.080  -8.739
  681   1HB   ALA  88          1HB       ALA  88   9.954   0.298  -7.893
  682   2HB   ALA  88          2HB       ALA  88  10.562   0.075  -9.533
  683   3HB   ALA  88          3HB       ALA  88   9.254  -0.944  -8.932
  684    H    VAL  89           H        VAL  89  10.570   1.758 -10.885
  685    HA   VAL  89           HA       VAL  89  11.472   4.086  -9.667
  686    HB   VAL  89           HB       VAL  89  12.578   4.615 -11.768
  687   1HG1  VAL  89          1HG1      VAL  89  12.568   1.856 -10.714
  688   2HG1  VAL  89          2HG1      VAL  89  13.888   3.018 -10.844
  689   3HG1  VAL  89          3HG1      VAL  89  13.374   2.106 -12.262
  690   1HG2  VAL  89          1HG2      VAL  89  12.027   2.759 -13.630
  691   2HG2  VAL  89          2HG2      VAL  89  11.237   4.335 -13.570
  692   3HG2  VAL  89          3HG2      VAL  89  10.435   2.920 -12.888
  693    H    LYS  90           H        LYS  90   8.752   3.528 -11.745
  694    HA   LYS  90           HA       LYS  90   8.308   6.308 -12.366
  695   1HB   LYS  90          2HB       LYS  90   7.659   4.698 -14.014
  696   2HB   LYS  90          1HB       LYS  90   6.712   3.793 -12.844
  697   1HG   LYS  90          2HG       LYS  90   5.133   5.653 -12.685
  698   2HG   LYS  90          1HG       LYS  90   6.083   6.554 -13.869
  699   1HD   LYS  90          2HD       LYS  90   4.269   5.545 -15.039
  700   2HD   LYS  90          1HD       LYS  90   5.729   4.650 -15.463
  701   1HE   LYS  90          2HE       LYS  90   5.117   2.803 -14.212
  702   2HE   LYS  90          1HE       LYS  90   4.026   3.733 -13.186
  703   1HZ   LYS  90          1HZ       LYS  90   3.375   3.562 -16.027
  704   2HZ   LYS  90          2HZ       LYS  90   2.348   3.591 -14.682
  705   3HZ   LYS  90          3HZ       LYS  90   3.153   2.165 -15.102
  706    H    ALA  91           H        ALA  91   7.466   4.144  -9.826
  707    HA   ALA  91           HA       ALA  91   5.273   5.871  -8.933
  708   1HB   ALA  91          1HB       ALA  91   5.250   3.892  -7.132
  709   2HB   ALA  91          2HB       ALA  91   6.005   3.045  -8.483
  710   3HB   ALA  91          3HB       ALA  91   4.420   3.792  -8.685
  711    H    ILE  92           H        ILE  92   8.393   4.579  -7.874
  712    HA   ILE  92           HA       ILE  92   8.334   5.770  -5.304
  713    HB   ILE  92           HB       ILE  92  10.616   5.150  -5.071
  714   1HG1  ILE  92          2HG1      ILE  92  10.671   4.849  -8.085
  715   2HG1  ILE  92          1HG1      ILE  92  11.496   6.091  -7.150
  716   1HG2  ILE  92          1HG2      ILE  92  10.495   2.786  -6.324
  717   2HG2  ILE  92          2HG2      ILE  92   8.807   3.273  -6.466
  718   3HG2  ILE  92          3HG2      ILE  92   9.559   3.160  -4.876
  719   1HD1  ILE  92          1HD1      ILE  92  12.948   4.450  -6.166
  720   2HD1  ILE  92          2HD1      ILE  92  12.983   4.283  -7.921
  721   3HD1  ILE  92          3HD1      ILE  92  12.058   3.143  -6.945
  722    H    LYS  93           H        LYS  93   9.342   6.881  -8.452
  723    HA   LYS  93           HA       LYS  93  10.849   9.120  -7.612
  724   1HB   LYS  93          2HB       LYS  93  10.880   8.125  -9.911
  725   2HB   LYS  93          1HB       LYS  93   9.289   8.823 -10.183
  726   1HG   LYS  93          2HG       LYS  93  10.134  10.828 -10.638
  727   2HG   LYS  93          1HG       LYS  93  11.203  10.786  -9.234
  728   1HD   LYS  93          2HD       LYS  93  11.957   9.004 -11.455
  729   2HD   LYS  93          1HD       LYS  93  12.061  10.732 -11.799
  730   1HE   LYS  93          2HE       LYS  93  13.341   9.342  -9.448
  731   2HE   LYS  93          1HE       LYS  93  14.175   9.811 -10.929
  732   1HZ   LYS  93          1HZ       LYS  93  14.628  11.605  -9.635
  733   2HZ   LYS  93          2HZ       LYS  93  13.202  11.479  -8.732
  734   3HZ   LYS  93          3HZ       LYS  93  13.163  12.137 -10.290
  735    H    LYS  94           H        LYS  94   7.449   8.520  -7.890
  736    HA   LYS  94           HA       LYS  94   6.625  11.252  -7.936
  737   1HB   LYS  94          2HB       LYS  94   5.177   8.684  -7.334
  738   2HB   LYS  94          1HB       LYS  94   4.387  10.254  -7.288
  739   1HG   LYS  94          2HG       LYS  94   5.826   9.208  -9.709
  740   2HG   LYS  94          1HG       LYS  94   4.104   8.956  -9.415
  741   1HD   LYS  94          2HD       LYS  94   3.628  11.247  -9.582
  742   2HD   LYS  94          1HD       LYS  94   5.321  11.701  -9.381
  743   1HE   LYS  94          2HE       LYS  94   3.989  10.467 -11.777
  744   2HE   LYS  94          1HE       LYS  94   4.831  12.013 -11.670
  745   1HZ   LYS  94          1HZ       LYS  94   6.450  10.760 -12.617
  746   2HZ   LYS  94          2HZ       LYS  94   5.922   9.314 -11.916
  747   3HZ   LYS  94          3HZ       LYS  94   6.807  10.426 -10.997
  748    H    GLY  95           H        GLY  95   6.380   8.755  -5.384
  749   1HA   GLY  95          2HA       GLY  95   7.364  10.424  -3.343
  750   2HA   GLY  95          1HA       GLY  95   5.612  10.525  -3.349
  751    H    ALA  96           H        ALA  96   7.366   7.587  -4.190
  752    HA   ALA  96           HA       ALA  96   6.055   6.252  -1.960
  753   1HB   ALA  96          1HB       ALA  96   6.162   4.344  -3.159
  754   2HB   ALA  96          2HB       ALA  96   7.799   4.670  -3.731
  755   3HB   ALA  96          3HB       ALA  96   6.421   5.446  -4.511
  756    H    TYR  97           H        TYR  97   7.871   4.171  -1.499
  757    HA   TYR  97           HA       TYR  97   9.975   5.654  -0.104
  758   1HB   TYR  97          2HB       TYR  97   8.886   4.563   1.593
  759   2HB   TYR  97          1HB       TYR  97   8.395   3.225   0.563
  760    HD1  TYR  97           1HD      TYR  97  11.331   4.673   2.329
  761    HD2  TYR  97           2HD      TYR  97   9.572   1.197   0.618
  762    HE1  TYR  97           1HE      TYR  97  13.135   3.298   3.280
  763    HE2  TYR  97           2HE      TYR  97  11.369  -0.187   1.565
  764    HH   TYR  97           HH       TYR  97  13.001  -0.124   3.342
  765    H    GLU  98           H        GLU  98   9.430   3.323  -2.515
  766    HA   GLU  98           HA       GLU  98  11.576   3.268  -3.967
  767   1HB   GLU  98          2HB       GLU  98  13.254   1.670  -3.056
  768   2HB   GLU  98          1HB       GLU  98  13.153   3.172  -2.153
  769   1HG   GLU  98          2HG       GLU  98  12.705   2.080  -0.280
  770   2HG   GLU  98          1HG       GLU  98  11.357   1.235  -1.039
  771    H    PHE  99           H        PHE  99   8.875   1.876  -3.208
  772    HA   PHE  99           HA       PHE  99   7.696   0.088  -3.979
  773   1HB   PHE  99          2HB       PHE  99   9.603   0.677  -5.972
  774   2HB   PHE  99          1HB       PHE  99   9.608  -1.073  -5.798
  775    HD1  PHE  99           1HD      PHE  99   8.198  -2.230  -7.177
  776    HD2  PHE  99           2HD      PHE  99   7.107   1.697  -5.951
  777    HE1  PHE  99           1HE      PHE  99   6.169  -2.367  -8.561
  778    HE2  PHE  99           2HE      PHE  99   5.077   1.567  -7.334
  779    HZ   PHE  99           HZ       PHE  99   4.605  -0.466  -8.640
  780    H    LEU 100           H        LEU 100   7.691  -2.324  -4.062
  781    HA   LEU 100           HA       LEU 100   9.642  -3.388  -2.145
  782   1HB   LEU 100          2HB       LEU 100   7.095  -3.332  -1.683
  783   2HB   LEU 100          1HB       LEU 100   7.011  -4.667  -2.814
  784    HG   LEU 100           HG       LEU 100   7.060  -5.546  -0.581
  785   1HD1  LEU 100          1HD1      LEU 100   8.415  -6.612  -2.459
  786   2HD1  LEU 100          2HD1      LEU 100   8.788  -7.105  -0.808
  787   3HD1  LEU 100          3HD1      LEU 100   9.834  -5.956  -1.643
  788   1HD2  LEU 100          1HD2      LEU 100   9.591  -3.942  -0.243
  789   2HD2  LEU 100          2HD2      LEU 100   8.983  -5.131   0.909
  790   3HD2  LEU 100          3HD2      LEU 100   8.052  -3.670   0.576
  791    H    GLU 101           H        GLU 101  11.259  -4.134  -3.446
  792    HA   GLU 101           HA       GLU 101  10.890  -5.448  -5.910
  793   1HB   GLU 101          2HB       GLU 101  13.248  -6.132  -5.672
  794   2HB   GLU 101          1HB       GLU 101  13.013  -4.423  -5.329
  795   1HG   GLU 101          2HG       GLU 101  12.926  -5.080  -2.880
  796   2HG   GLU 101          1HG       GLU 101  13.529  -6.655  -3.394
  797    H    LYS 102           H        LYS 102  11.582  -7.716  -6.353
  798    HA   LYS 102           HA       LYS 102  11.304  -9.956  -6.133
  799   1HB   LYS 102          2HB       LYS 102  12.002  -9.074  -3.402
  800   2HB   LYS 102          1HB       LYS 102  11.211 -10.640  -3.508
  801   1HG   LYS 102          2HG       LYS 102  13.564 -10.990  -3.552
  802   2HG   LYS 102          1HG       LYS 102  12.934 -11.328  -5.165
  803   1HD   LYS 102          2HD       LYS 102  13.764  -8.545  -4.734
  804   2HD   LYS 102          1HD       LYS 102  15.072  -9.727  -4.631
  805   1HE   LYS 102          2HE       LYS 102  13.708 -10.566  -6.847
  806   2HE   LYS 102          1HE       LYS 102  13.532  -8.815  -6.947
  807   1HZ   LYS 102          1HZ       LYS 102  15.603 -10.032  -7.958
  808   2HZ   LYS 102          2HZ       LYS 102  16.188  -9.909  -6.376
  809   3HZ   LYS 102          3HZ       LYS 102  15.757  -8.513  -7.230
  810    HA   PRO 103           HA       PRO 103   6.787  -9.094  -5.026
  811   1HB   PRO 103          2HB       PRO 103   6.310  -9.596  -7.879
  812   2HB   PRO 103          1HB       PRO 103   5.787  -8.240  -6.879
  813   1HG   PRO 103          2HG       PRO 103   7.680  -7.979  -8.779
  814   2HG   PRO 103          1HG       PRO 103   7.704  -7.033  -7.279
  815   1HD   PRO 103          2HD       PRO 103   9.300  -9.456  -8.018
  816   2HD   PRO 103          1HD       PRO 103   9.804  -7.993  -7.151
  817    H    PHE 104           H        PHE 104   7.798 -11.325  -4.201
  818    HA   PHE 104           HA       PHE 104   6.165 -13.410  -5.458
  819   1HB   PHE 104          2HB       PHE 104   9.006 -13.319  -5.516
  820   2HB   PHE 104          1HB       PHE 104   8.538 -14.627  -4.436
  821    HD1  PHE 104           1HD      PHE 104   8.303 -13.341  -7.872
  822    HD2  PHE 104           2HD      PHE 104   7.522 -16.613  -5.265
  823    HE1  PHE 104           1HE      PHE 104   7.866 -14.782  -9.817
  824    HE2  PHE 104           2HE      PHE 104   7.085 -18.060  -7.206
  825    HZ   PHE 104           HZ       PHE 104   7.256 -17.145  -9.486
  826    H    SER 105           H        SER 105   8.391 -12.979  -2.700
  827    HA   SER 105           HA       SER 105   6.482 -14.413  -1.007
  828   1HB   SER 105          2HB       SER 105   8.256 -14.872   0.459
  829   2HB   SER 105          1HB       SER 105   9.007 -14.961  -1.133
  830    HG   SER 105           HG       SER 105   9.534 -12.650  -0.733
  831    H    VAL 106           H        VAL 106   5.429 -13.502   0.667
  832    HA   VAL 106           HA       VAL 106   5.360 -10.622   0.811
  833    HB   VAL 106           HB       VAL 106   3.293 -11.950   0.982
  834   1HG1  VAL 106          1HG1      VAL 106   3.894 -12.747   3.772
  835   2HG1  VAL 106          2HG1      VAL 106   4.630 -13.694   2.480
  836   3HG1  VAL 106          3HG1      VAL 106   2.876 -13.528   2.562
  837   1HG2  VAL 106          1HG2      VAL 106   3.703 -10.564   3.612
  838   2HG2  VAL 106          2HG2      VAL 106   2.256 -10.624   2.604
  839   3HG2  VAL 106          3HG2      VAL 106   3.648  -9.669   2.093
  840    H    GLU 107           H        GLU 107   6.543 -13.278   2.807
  841    HA   GLU 107           HA       GLU 107   6.989 -12.101   5.219
  842   1HB   GLU 107          2HB       GLU 107   7.568 -14.464   4.440
  843   2HB   GLU 107          1HB       GLU 107   9.095 -13.786   3.892
  844   1HG   GLU 107          2HG       GLU 107   9.212 -12.866   6.333
  845   2HG   GLU 107          1HG       GLU 107   8.073 -14.173   6.654
  846    H    ARG 108           H        ARG 108   8.958 -11.770   2.305
  847    HA   ARG 108           HA       ARG 108  11.027 -10.231   3.447
  848   1HB   ARG 108          2HB       ARG 108  10.775 -11.409   1.088
  849   2HB   ARG 108          1HB       ARG 108  10.207  -9.818   0.604
  850   1HG   ARG 108          2HG       ARG 108  12.299  -9.144   0.388
  851   2HG   ARG 108          1HG       ARG 108  12.570  -9.440   2.105
  852   1HD   ARG 108          2HD       ARG 108  12.604 -11.919   0.644
  853   2HD   ARG 108          1HD       ARG 108  13.736 -10.771  -0.069
  854    HE   ARG 108           HE       ARG 108  15.046 -10.937   1.805
  855   1HH1  ARG 108          1HH1      ARG 108  11.929 -12.364   2.457
  856   2HH1  ARG 108          2HH1      ARG 108  12.418 -13.046   3.971
  857   1HH2  ARG 108          1HH2      ARG 108  15.691 -11.830   3.796
  858   2HH2  ARG 108          2HH2      ARG 108  14.555 -12.742   4.733
  859    H    PHE 109           H        PHE 109   7.895  -9.430   2.106
  860    HA   PHE 109           HA       PHE 109   8.259  -6.621   1.988
  861   1HB   PHE 109          2HB       PHE 109   6.496  -7.537   0.680
  862   2HB   PHE 109          1HB       PHE 109   5.809  -8.384   2.060
  863    HD1  PHE 109           1HD      PHE 109   6.907  -4.846   1.829
  864    HD2  PHE 109           2HD      PHE 109   3.645  -7.553   2.201
  865    HE1  PHE 109           1HE      PHE 109   5.390  -2.955   2.243
  866    HE2  PHE 109           2HE      PHE 109   2.121  -5.667   2.615
  867    HZ   PHE 109           HZ       PHE 109   2.996  -3.364   2.637
  868    H    LEU 110           H        LEU 110   7.392  -8.844   4.522
  869    HA   LEU 110           HA       LEU 110   6.111  -7.245   6.355
  870   1HB   LEU 110          2HB       LEU 110   7.197  -9.761   6.349
  871   2HB   LEU 110          1HB       LEU 110   8.150  -8.934   7.565
  872    HG   LEU 110           HG       LEU 110   5.173  -8.739   7.684
  873   1HD1  LEU 110          1HD1      LEU 110   4.999 -10.780   8.925
  874   2HD1  LEU 110          2HD1      LEU 110   6.737 -11.056   8.806
  875   3HD1  LEU 110          3HD1      LEU 110   5.730 -11.140   7.361
  876   1HD2  LEU 110          1HD2      LEU 110   7.484  -8.242   9.414
  877   2HD2  LEU 110          2HD2      LEU 110   6.142  -9.069  10.206
  878   3HD2  LEU 110          3HD2      LEU 110   5.880  -7.512   9.422
  879    H    LEU 111           H        LEU 111   9.579  -7.528   5.758
  880    HA   LEU 111           HA       LEU 111  10.523  -5.959   7.852
  881   1HB   LEU 111          2HB       LEU 111  11.647  -6.188   5.059
  882   2HB   LEU 111          1HB       LEU 111  12.514  -5.593   6.463
  883    HG   LEU 111           HG       LEU 111  11.670  -8.076   7.301
  884   1HD1  LEU 111          1HD1      LEU 111  12.205  -8.135   4.353
  885   2HD1  LEU 111          2HD1      LEU 111  10.901  -8.899   5.261
  886   3HD1  LEU 111          3HD1      LEU 111  12.543  -9.529   5.378
  887   1HD2  LEU 111          1HD2      LEU 111  13.949  -6.809   7.334
  888   2HD2  LEU 111          2HD2      LEU 111  14.287  -7.776   5.897
  889   3HD2  LEU 111          3HD2      LEU 111  13.915  -8.570   7.428
  890    H    THR 112           H        THR 112   9.867  -4.930   4.496
  891    HA   THR 112           HA       THR 112  10.381  -2.255   4.689
  892    HB   THR 112           HB       THR 112   8.095  -3.549   3.191
  893    HG1  THR 112           1HG      THR 112  10.754  -2.945   2.412
  894   1HG2  THR 112          1HG2      THR 112   8.896  -1.502   1.630
  895   2HG2  THR 112          2HG2      THR 112   9.078  -0.787   3.232
  896   3HG2  THR 112          3HG2      THR 112   7.519  -1.437   2.728
  897    H    ILE 113           H        ILE 113   7.376  -3.898   5.628
  898    HA   ILE 113           HA       ILE 113   5.833  -1.679   6.282
  899    HB   ILE 113           HB       ILE 113   5.903  -4.441   7.498
  900   1HG1  ILE 113          2HG1      ILE 113   5.198  -4.374   5.177
  901   2HG1  ILE 113          1HG1      ILE 113   3.807  -4.715   6.200
  902   1HG2  ILE 113          1HG2      ILE 113   3.944  -2.214   8.023
  903   2HG2  ILE 113          2HG2      ILE 113   5.005  -3.001   9.192
  904   3HG2  ILE 113          3HG2      ILE 113   3.678  -3.903   8.459
  905   1HD1  ILE 113          1HD1      ILE 113   3.868  -1.941   5.947
  906   2HD1  ILE 113          2HD1      ILE 113   2.754  -3.066   5.173
  907   3HD1  ILE 113          3HD1      ILE 113   4.228  -2.573   4.340
  908    H    LYS 114           H        LYS 114   7.465  -3.725   8.690
  909    HA   LYS 114           HA       LYS 114   7.343  -1.939  10.814
  910   1HB   LYS 114          2HB       LYS 114   7.870  -4.216  11.247
  911   2HB   LYS 114          1HB       LYS 114   9.255  -4.178  10.173
  912   1HG   LYS 114          2HG       LYS 114   9.224  -2.398  12.564
  913   2HG   LYS 114          1HG       LYS 114   9.553  -4.116  12.774
  914   1HD   LYS 114          2HD       LYS 114  11.132  -2.082  11.219
  915   2HD   LYS 114          1HD       LYS 114  11.664  -3.099  12.552
  916   1HE   LYS 114          2HE       LYS 114  10.917  -4.978  10.753
  917   2HE   LYS 114          1HE       LYS 114  11.460  -3.690   9.677
  918   1HZ   LYS 114          1HZ       LYS 114  13.598  -3.810  10.466
  919   2HZ   LYS 114          2HZ       LYS 114  13.140  -5.435  10.556
  920   3HZ   LYS 114          3HZ       LYS 114  13.147  -4.482  11.953
  921    H    HIS 115           H        HIS 115   9.282  -1.818   8.012
  922    HA   HIS 115           HA       HIS 115  11.304  -0.098   9.198
  923   1HB   HIS 115          2HB       HIS 115  11.036  -1.624   6.718
  924   2HB   HIS 115          1HB       HIS 115  11.768  -0.038   6.506
  925    HD1  HIS 115           1HD      HIS 115  12.664  -3.409   7.204
  926    HD2  HIS 115           2HD      HIS 115  14.007   0.299   8.514
  927    HE1  HIS 115           1HE      HIS 115  14.962  -3.818   8.143
  928    HE2  HIS 115           2HE      HIS 115  15.785  -1.546   8.854
  929    H    ALA 116           H        ALA 116   8.326   0.109   7.517
  930    HA   ALA 116           HA       ALA 116   8.744   2.827   6.586
  931   1HB   ALA 116          1HB       ALA 116   6.558   2.665   5.625
  932   2HB   ALA 116          2HB       ALA 116   6.193   1.220   6.569
  933   3HB   ALA 116          3HB       ALA 116   7.411   1.159   5.296
  934    H    PHE 117           H        PHE 117   7.015   1.135   9.145
  935    HA   PHE 117           HA       PHE 117   5.635   3.439  10.114
  936   1HB   PHE 117          2HB       PHE 117   6.108   0.663  11.147
  937   2HB   PHE 117          1HB       PHE 117   5.426   1.888  12.210
  938    HD1  PHE 117           1HD      PHE 117   3.279   3.015  11.534
  939    HD2  PHE 117           2HD      PHE 117   4.783  -0.447   9.566
  940    HE1  PHE 117           1HE      PHE 117   1.042   2.572  10.610
  941    HE2  PHE 117           2HE      PHE 117   2.550  -0.895   8.639
  942    HZ   PHE 117           HZ       PHE 117   0.675   0.622   9.160
  943    H    GLU 118           H        GLU 118   8.641   1.795  10.963
  944    HA   GLU 118           HA       GLU 118   9.168   3.412  13.256
  945   1HB   GLU 118          2HB       GLU 118  10.765   1.452  11.658
  946   2HB   GLU 118          1HB       GLU 118  11.542   2.443  12.885
  947   1HG   GLU 118          2HG       GLU 118   9.385   1.471  14.234
  948   2HG   GLU 118          1HG       GLU 118   9.788   0.125  13.168
  949    H    GLU 119           H        GLU 119   9.839   3.686   9.853
  950    HA   GLU 119           HA       GLU 119  11.887   5.659  10.109
  951   1HB   GLU 119          2HB       GLU 119  10.380   4.417   7.898
  952   2HB   GLU 119          1HB       GLU 119  11.037   6.020   7.594
  953   1HG   GLU 119          2HG       GLU 119  13.227   4.969   8.563
  954   2HG   GLU 119          1HG       GLU 119  12.451   3.455   8.103
  955    H    TYR 120           H        TYR 120   8.624   5.815  10.697
  956    HA   TYR 120           HA       TYR 120   8.658   8.728  10.397
  957   1HB   TYR 120          2HB       TYR 120   7.220   7.130   8.678
  958   2HB   TYR 120          1HB       TYR 120   6.022   7.545   9.901
  959    HD1  TYR 120           1HD      TYR 120   6.512  10.244  10.627
  960    HD2  TYR 120           2HD      TYR 120   6.949   8.435   6.801
  961    HE1  TYR 120           1HE      TYR 120   6.180  12.434   9.560
  962    HE2  TYR 120           2HE      TYR 120   6.620  10.621   5.724
  963    HH   TYR 120           HH       TYR 120   5.295  13.185   7.132
  964    H    SER 121           H        SER 121   9.036   6.967  12.683
  965    HA   SER 121           HA       SER 121   7.477   8.312  14.579
  966   1HB   SER 121          2HB       SER 121   6.281   5.860  13.479
  967   2HB   SER 121          1HB       SER 121   6.370   5.891  15.240
  968    HG   SER 121           HG       SER 121   5.351   8.062  13.741
  Start of MODEL   27
    1   1H    MET   1          1HT       MET   1  -4.034  -0.268  18.254
    2   2H    MET   1          2HT       MET   1  -3.825  -1.493  17.071
    3   3H    MET   1          3HT       MET   1  -4.507   0.019  16.632
    4    HA   MET   1           HA       MET   1  -2.531   1.131  16.873
    5   1HB   MET   1          2HB       MET   1  -1.813  -1.299  18.467
    6   2HB   MET   1          1HB       MET   1  -0.526  -0.353  17.730
    7   1HG   MET   1          2HG       MET   1  -2.111   1.547  18.952
    8   2HG   MET   1          1HG       MET   1  -2.129   0.194  20.081
    9   1HE   MET   1          1HE       MET   1   0.143  -1.251  19.938
   10   2HE   MET   1          2HE       MET   1   1.553  -0.516  20.700
   11   3HE   MET   1          3HE       MET   1   1.435  -0.581  18.942
   12    H    LYS   2           H        LYS   2  -1.040   1.221  15.219
   13    HA   LYS   2           HA       LYS   2  -0.072   0.718  13.224
   14   1HB   LYS   2          2HB       LYS   2  -0.303  -2.159  14.124
   15   2HB   LYS   2          1HB       LYS   2   0.768  -1.533  12.876
   16   1HG   LYS   2          2HG       LYS   2   0.956  -0.480  15.663
   17   2HG   LYS   2          1HG       LYS   2   1.693  -2.029  15.245
   18   1HD   LYS   2          2HD       LYS   2   2.867  -0.845  13.364
   19   2HD   LYS   2          1HD       LYS   2   2.276   0.673  14.044
   20   1HE   LYS   2          2HE       LYS   2   3.700   0.597  15.805
   21   2HE   LYS   2          1HE       LYS   2   3.644  -1.163  15.911
   22   1HZ   LYS   2          1HZ       LYS   2   5.370  -1.392  14.502
   23   2HZ   LYS   2          2HZ       LYS   2   5.753   0.171  15.023
   24   3HZ   LYS   2          3HZ       LYS   2   4.943  -0.057  13.556
   25    H    ARG   3           H        ARG   3  -1.163   1.010  11.405
   26    HA   ARG   3           HA       ARG   3  -3.073  -1.002  10.521
   27   1HB   ARG   3          2HB       ARG   3  -3.904   1.891  10.487
   28   2HB   ARG   3          1HB       ARG   3  -4.897   0.465  10.217
   29   1HG   ARG   3          2HG       ARG   3  -5.514   1.176  12.337
   30   2HG   ARG   3          1HG       ARG   3  -4.366  -0.125  12.655
   31   1HD   ARG   3          2HD       ARG   3  -3.220   1.296  13.923
   32   2HD   ARG   3          1HD       ARG   3  -2.815   2.188  12.460
   33    HE   ARG   3           HE       ARG   3  -4.855   2.874  14.423
   34   1HH1  ARG   3          1HH1      ARG   3  -3.358   3.577  11.344
   35   2HH1  ARG   3          2HH1      ARG   3  -3.993   5.183  11.265
   36   1HH2  ARG   3          1HH2      ARG   3  -5.686   4.987  14.314
   37   2HH2  ARG   3          2HH2      ARG   3  -5.310   5.986  12.949
   38    H    VAL   4           H        VAL   4  -2.722  -1.431   8.444
   39    HA   VAL   4           HA       VAL   4  -1.489   0.662   6.771
   40    HB   VAL   4           HB       VAL   4  -1.106  -2.319   6.460
   41   1HG1  VAL   4          1HG1      VAL   4   0.891  -1.400   5.089
   42   2HG1  VAL   4          2HG1      VAL   4  -0.048   0.089   5.036
   43   3HG1  VAL   4          3HG1      VAL   4  -0.719  -1.397   4.369
   44   1HG2  VAL   4          1HG2      VAL   4   0.816  -0.295   7.605
   45   2HG2  VAL   4          2HG2      VAL   4   1.108  -2.020   7.393
   46   3HG2  VAL   4          3HG2      VAL   4  -0.100  -1.467   8.553
   47    H    LEU   5           H        LEU   5  -1.970   0.508   4.459
   48    HA   LEU   5           HA       LEU   5  -4.663  -0.586   3.984
   49   1HB   LEU   5          2HB       LEU   5  -4.510   1.887   3.938
   50   2HB   LEU   5          1HB       LEU   5  -3.342   1.771   2.637
   51    HG   LEU   5           HG       LEU   5  -5.093   0.651   1.245
   52   1HD1  LEU   5          1HD1      LEU   5  -7.314   0.509   1.914
   53   2HD1  LEU   5          2HD1      LEU   5  -7.085   1.635   3.251
   54   3HD1  LEU   5          3HD1      LEU   5  -6.423   0.005   3.350
   55   1HD2  LEU   5          1HD2      LEU   5  -6.280   3.240   2.041
   56   2HD2  LEU   5          2HD2      LEU   5  -5.814   2.644   0.448
   57   3HD2  LEU   5          3HD2      LEU   5  -4.586   3.255   1.554
   58    H    VAL   6           H        VAL   6  -4.992  -1.903   2.263
   59    HA   VAL   6           HA       VAL   6  -2.661  -2.404   0.521
   60    HB   VAL   6           HB       VAL   6  -4.718  -4.498   1.171
   61   1HG1  VAL   6          1HG1      VAL   6  -3.500  -5.189  -0.676
   62   2HG1  VAL   6          2HG1      VAL   6  -2.624  -5.933   0.662
   63   3HG1  VAL   6          3HG1      VAL   6  -2.004  -4.462  -0.088
   64   1HG2  VAL   6          1HG2      VAL   6  -3.322  -5.353   2.922
   65   2HG2  VAL   6          2HG2      VAL   6  -3.672  -3.660   3.269
   66   3HG2  VAL   6          3HG2      VAL   6  -2.100  -4.118   2.616
   67    H    VAL   7           H        VAL   7  -3.319  -1.105  -1.197
   68    HA   VAL   7           HA       VAL   7  -5.969  -1.358  -2.299
   69    HB   VAL   7           HB       VAL   7  -3.556  -0.045  -3.567
   70   1HG1  VAL   7          1HG1      VAL   7  -5.312  -0.435  -5.156
   71   2HG1  VAL   7          2HG1      VAL   7  -5.287   1.281  -4.753
   72   3HG1  VAL   7          3HG1      VAL   7  -6.517   0.229  -4.054
   73   1HG2  VAL   7          1HG2      VAL   7  -5.548   0.984  -1.568
   74   2HG2  VAL   7          2HG2      VAL   7  -4.687   2.068  -2.661
   75   3HG2  VAL   7          3HG2      VAL   7  -3.787   1.068  -1.520
   76    H    ASP   8           H        ASP   8  -6.613  -2.963  -3.577
   77    HA   ASP   8           HA       ASP   8  -4.985  -3.924  -5.722
   78   1HB   ASP   8          2HB       ASP   8  -3.922  -5.225  -4.006
   79   2HB   ASP   8          1HB       ASP   8  -5.471  -5.714  -3.332
   80    H    ASP   9           H        ASP   9  -6.128  -5.363  -7.129
   81    HA   ASP   9           HA       ASP   9  -8.984  -4.914  -7.051
   82   1HB   ASP   9          2HB       ASP   9  -7.759  -4.588  -9.149
   83   2HB   ASP   9          1HB       ASP   9  -7.255  -6.274  -9.131
   84    H    GLU  10           H        GLU  10  -8.400  -6.493  -4.963
   85    HA   GLU  10           HA       GLU  10  -9.506  -9.093  -5.776
   86   1HB   GLU  10          2HB       GLU  10  -6.965  -8.935  -5.000
   87   2HB   GLU  10          1HB       GLU  10  -7.704  -8.981  -3.406
   88   1HG   GLU  10          2HG       GLU  10  -8.403 -11.131  -3.635
   89   2HG   GLU  10          1HG       GLU  10  -8.580 -11.005  -5.385
   90    H    GLU  11           H        GLU  11 -11.124  -9.891  -4.506
   91    HA   GLU  11           HA       GLU  11 -12.635  -8.137  -2.951
   92   1HB   GLU  11          2HB       GLU  11 -13.346 -10.330  -4.078
   93   2HB   GLU  11          1HB       GLU  11 -12.740 -11.130  -2.635
   94   1HG   GLU  11          2HG       GLU  11 -14.316  -9.275  -1.503
   95   2HG   GLU  11          1HG       GLU  11 -15.165  -9.510  -3.030
   96    H    SER  12           H        SER  12 -11.003 -11.056  -1.700
   97    HA   SER  12           HA       SER  12 -10.981  -9.916   0.963
   98   1HB   SER  12          2HB       SER  12 -10.301 -12.070   1.719
   99   2HB   SER  12          1HB       SER  12 -11.479 -12.358   0.439
  100    HG   SER  12           HG       SER  12  -9.052 -13.303   0.575
  101    H    ILE  13           H        ILE  13  -8.650 -10.974   2.011
  102    HA   ILE  13           HA       ILE  13  -6.797  -8.970   1.655
  103    HB   ILE  13           HB       ILE  13  -5.908 -11.767   2.306
  104   1HG1  ILE  13          2HG1      ILE  13  -7.849 -11.506   3.673
  105   2HG1  ILE  13          1HG1      ILE  13  -6.464 -11.162   4.703
  106   1HG2  ILE  13          1HG2      ILE  13  -4.021 -10.516   2.388
  107   2HG2  ILE  13          2HG2      ILE  13  -4.611 -10.192   4.016
  108   3HG2  ILE  13          3HG2      ILE  13  -4.893  -9.022   2.727
  109   1HD1  ILE  13          1HD1      ILE  13  -7.185  -8.698   3.640
  110   2HD1  ILE  13          2HD1      ILE  13  -7.483  -9.285   5.276
  111   3HD1  ILE  13          3HD1      ILE  13  -8.709  -9.496   4.027
  112    H    THR  14           H        THR  14  -4.542  -9.162   0.768
  113    HA   THR  14           HA       THR  14  -4.742 -10.097  -1.965
  114    HB   THR  14           HB       THR  14  -2.709  -8.781  -2.362
  115    HG1  THR  14           1HG      THR  14  -1.785  -7.631  -0.674
  116   1HG2  THR  14          1HG2      THR  14  -3.577  -6.617  -2.081
  117   2HG2  THR  14          2HG2      THR  14  -4.549  -7.101  -0.692
  118   3HG2  THR  14          3HG2      THR  14  -4.975  -7.668  -2.308
  119    H    SER  15           H        SER  15  -1.596  -9.936  -0.546
  120    HA   SER  15           HA       SER  15  -1.181 -12.743  -1.207
  121   1HB   SER  15          2HB       SER  15   0.367 -10.662  -1.790
  122   2HB   SER  15          1HB       SER  15   1.044 -11.025  -0.204
  123    HG   SER  15           HG       SER  15   1.325 -12.360  -2.562
  124    H    SER  16           H        SER  16   1.098 -13.070   0.573
  125    HA   SER  16           HA       SER  16  -0.011 -14.433   2.675
  126   1HB   SER  16          2HB       SER  16   2.652 -12.996   2.655
  127   2HB   SER  16          1HB       SER  16   2.188 -14.269   3.783
  128    HG   SER  16           HG       SER  16   1.988 -15.674   1.991
  129    H    LEU  17           H        LEU  17   0.315 -11.023   2.314
  130    HA   LEU  17           HA       LEU  17   0.497  -9.826   4.666
  131   1HB   LEU  17          2HB       LEU  17  -0.822  -9.271   2.245
  132   2HB   LEU  17          1HB       LEU  17  -2.015  -8.978   3.486
  133    HG   LEU  17           HG       LEU  17   0.054  -7.264   2.583
  134   1HD1  LEU  17          1HD1      LEU  17  -1.258  -5.674   3.479
  135   2HD1  LEU  17          2HD1      LEU  17  -1.476  -6.545   4.995
  136   3HD1  LEU  17          3HD1      LEU  17  -2.414  -7.003   3.573
  137   1HD2  LEU  17          1HD2      LEU  17   1.076  -6.605   4.735
  138   2HD2  LEU  17          2HD2      LEU  17   1.575  -8.208   4.202
  139   3HD2  LEU  17          3HD2      LEU  17   0.373  -8.040   5.481
  140    H    SER  18           H        SER  18  -2.429 -11.502   3.605
  141    HA   SER  18           HA       SER  18  -4.097 -11.130   5.746
  142   1HB   SER  18          2HB       SER  18  -4.526 -12.406   3.569
  143   2HB   SER  18          1HB       SER  18  -3.800 -13.802   4.362
  144    HG   SER  18           HG       SER  18  -5.772 -14.096   5.053
  145    H    ALA  19           H        ALA  19  -2.129 -14.082   5.366
  146    HA   ALA  19           HA       ALA  19  -2.440 -15.008   7.975
  147   1HB   ALA  19          1HB       ALA  19  -0.931 -15.728   5.654
  148   2HB   ALA  19          2HB       ALA  19  -1.427 -16.736   7.014
  149   3HB   ALA  19          3HB       ALA  19   0.098 -15.851   7.081
  150    H    ILE  20           H        ILE  20  -0.017 -12.872   6.576
  151    HA   ILE  20           HA       ILE  20   1.732 -12.744   8.764
  152    HB   ILE  20           HB       ILE  20   1.181 -10.903   6.464
  153   1HG1  ILE  20          2HG1      ILE  20   3.811 -12.126   7.140
  154   2HG1  ILE  20          1HG1      ILE  20   2.539 -13.152   6.483
  155   1HG2  ILE  20          1HG2      ILE  20   2.985 -10.372   8.802
  156   2HG2  ILE  20          2HG2      ILE  20   1.756  -9.319   8.099
  157   3HG2  ILE  20          3HG2      ILE  20   3.250  -9.639   7.218
  158   1HD1  ILE  20          1HD1      ILE  20   3.967 -12.389   4.711
  159   2HD1  ILE  20          2HD1      ILE  20   3.723 -10.709   5.191
  160   3HD1  ILE  20          3HD1      ILE  20   2.376 -11.646   4.545
  161    H    LEU  21           H        LEU  21  -0.634 -10.237   7.781
  162    HA   LEU  21           HA       LEU  21  -0.495  -8.587   9.942
  163   1HB   LEU  21          2HB       LEU  21  -2.999  -9.435   8.495
  164   2HB   LEU  21          1HB       LEU  21  -2.845  -8.002   9.491
  165    HG   LEU  21           HG       LEU  21  -0.812  -8.126   7.410
  166   1HD1  LEU  21          1HD1      LEU  21  -3.206  -9.144   6.579
  167   2HD1  LEU  21          2HD1      LEU  21  -2.008  -8.363   5.550
  168   3HD1  LEU  21          3HD1      LEU  21  -3.363  -7.432   6.186
  169   1HD2  LEU  21          1HD2      LEU  21  -2.707  -6.181   8.602
  170   2HD2  LEU  21          2HD2      LEU  21  -2.092  -5.845   6.984
  171   3HD2  LEU  21          3HD2      LEU  21  -0.969  -6.053   8.328
  172    H    GLU  22           H        GLU  22  -2.171 -11.673   9.749
  173    HA   GLU  22           HA       GLU  22  -3.557 -11.475  12.205
  174   1HB   GLU  22          2HB       GLU  22  -3.800 -13.137  10.184
  175   2HB   GLU  22          1HB       GLU  22  -2.687 -14.113  11.133
  176   1HG   GLU  22          2HG       GLU  22  -4.579 -13.347  12.974
  177   2HG   GLU  22          1HG       GLU  22  -5.520 -13.613  11.508
  178    H    GLU  23           H        GLU  23  -0.296 -12.355  11.377
  179    HA   GLU  23           HA       GLU  23   0.245 -13.510  13.979
  180   1HB   GLU  23          2HB       GLU  23   1.390 -14.586  12.224
  181   2HB   GLU  23          1HB       GLU  23   1.861 -13.066  11.481
  182   1HG   GLU  23          2HG       GLU  23   3.575 -12.711  12.977
  183   2HG   GLU  23          1HG       GLU  23   2.871 -13.772  14.196
  184    H    GLU  24           H        GLU  24   1.052 -10.595  12.141
  185    HA   GLU  24           HA       GLU  24   2.692  -9.489  14.206
  186   1HB   GLU  24          2HB       GLU  24   1.562  -8.442  11.639
  187   2HB   GLU  24          1HB       GLU  24   2.340  -7.353  12.781
  188   1HG   GLU  24          2HG       GLU  24   3.744  -9.829  11.883
  189   2HG   GLU  24          1HG       GLU  24   3.712  -8.401  10.849
  190    H    GLY  25           H        GLY  25  -0.631  -8.964  13.104
  191   1HA   GLY  25          2HA       GLY  25  -2.403  -8.462  14.601
  192   2HA   GLY  25          1HA       GLY  25  -1.224  -7.790  15.715
  193    H    TYR  26           H        TYR  26  -1.321  -7.051  12.293
  194    HA   TYR  26           HA       TYR  26  -1.535  -4.234  12.881
  195   1HB   TYR  26          2HB       TYR  26  -1.150  -5.842  10.373
  196   2HB   TYR  26          1HB       TYR  26  -1.533  -4.129  10.284
  197    HD1  TYR  26           1HD      TYR  26   0.080  -2.457  10.941
  198    HD2  TYR  26           2HD      TYR  26   0.997  -6.597  11.253
  199    HE1  TYR  26           1HE      TYR  26   2.457  -1.901  11.226
  200    HE2  TYR  26           2HE      TYR  26   3.377  -6.057  11.540
  201    HH   TYR  26           HH       TYR  26   4.553  -2.725  11.317
  202    H    HIS  27           H        HIS  27  -2.962  -3.111  10.972
  203    HA   HIS  27           HA       HIS  27  -5.648  -4.295  11.080
  204   1HB   HIS  27          2HB       HIS  27  -4.878  -2.061  12.550
  205   2HB   HIS  27          1HB       HIS  27  -5.684  -1.379  11.142
  206    HD1  HIS  27           1HD      HIS  27  -6.526  -4.395  13.315
  207    HD2  HIS  27           2HD      HIS  27  -8.231  -0.888  11.879
  208    HE1  HIS  27           1HE      HIS  27  -8.900  -4.412  14.145
  209    HE2  HIS  27           2HE      HIS  27  -9.918  -2.288  13.251
  210    HA   PRO  28           HA       PRO  28  -4.665  -3.132   6.767
  211   1HB   PRO  28          2HB       PRO  28  -5.499  -5.392   5.604
  212   2HB   PRO  28          1HB       PRO  28  -3.934  -5.296   6.419
  213   1HG   PRO  28          2HG       PRO  28  -6.504  -6.476   7.385
  214   2HG   PRO  28          1HG       PRO  28  -4.850  -7.083   7.577
  215   1HD   PRO  28          2HD       PRO  28  -6.252  -5.691   9.509
  216   2HD   PRO  28          1HD       PRO  28  -4.485  -5.812   9.440
  217    H    ASP  29           H        ASP  29  -6.008  -2.086   5.438
  218    HA   ASP  29           HA       ASP  29  -8.881  -2.554   5.792
  219   1HB   ASP  29          2HB       ASP  29  -7.855  -0.277   6.457
  220   2HB   ASP  29          1HB       ASP  29  -7.822   0.024   4.723
  221    H    THR  30           H        THR  30  -6.563  -3.257   3.785
  222    HA   THR  30           HA       THR  30  -6.339  -3.116   1.420
  223    HB   THR  30           HB       THR  30  -7.169  -5.220   0.669
  224    HG1  THR  30           1HG      THR  30  -8.745  -6.342   1.833
  225   1HG2  THR  30          1HG2      THR  30  -5.764  -6.310   1.974
  226   2HG2  THR  30          2HG2      THR  30  -6.933  -6.284   3.294
  227   3HG2  THR  30          3HG2      THR  30  -5.783  -4.960   3.108
  228    H    ALA  31           H        ALA  31  -6.999  -1.994  -0.225
  229    HA   ALA  31           HA       ALA  31  -9.853  -1.369  -0.501
  230   1HB   ALA  31          1HB       ALA  31  -8.147   0.484  -0.373
  231   2HB   ALA  31          2HB       ALA  31  -9.225   0.537  -1.767
  232   3HB   ALA  31          3HB       ALA  31  -7.571  -0.047  -1.952
  233    H    LYS  32           H        LYS  32 -10.284  -0.872  -3.027
  234    HA   LYS  32           HA       LYS  32  -9.834  -3.437  -4.337
  235   1HB   LYS  32          2HB       LYS  32 -12.111  -2.942  -4.349
  236   2HB   LYS  32          1HB       LYS  32 -11.838  -1.229  -4.633
  237   1HG   LYS  32          2HG       LYS  32 -11.125  -1.750  -6.922
  238   2HG   LYS  32          1HG       LYS  32 -11.491  -3.449  -6.629
  239   1HD   LYS  32          2HD       LYS  32 -13.776  -3.075  -6.543
  240   2HD   LYS  32          1HD       LYS  32 -13.583  -1.366  -6.152
  241   1HE   LYS  32          2HE       LYS  32 -14.334  -1.426  -8.384
  242   2HE   LYS  32          1HE       LYS  32 -12.606  -1.087  -8.472
  243   1HZ   LYS  32          1HZ       LYS  32 -13.521  -2.821 -10.051
  244   2HZ   LYS  32          2HZ       LYS  32 -13.673  -3.836  -8.706
  245   3HZ   LYS  32          3HZ       LYS  32 -12.150  -3.260  -9.163
  246    H    THR  33           H        THR  33  -9.336   0.009  -4.813
  247    HA   THR  33           HA       THR  33  -7.113  -0.446  -6.534
  248    HB   THR  33           HB       THR  33  -8.828  -0.829  -8.197
  249    HG1  THR  33           1HG      THR  33  -8.155   0.642  -9.670
  250   1HG2  THR  33          1HG2      THR  33  -9.917   1.909  -7.628
  251   2HG2  THR  33          2HG2      THR  33 -10.661   0.412  -7.064
  252   3HG2  THR  33          3HG2      THR  33 -10.519   0.729  -8.793
  253    H    LEU  34           H        LEU  34  -7.098   2.036  -7.838
  254    HA   LEU  34           HA       LEU  34  -6.199   3.708  -5.726
  255   1HB   LEU  34          2HB       LEU  34  -6.772   4.539  -8.567
  256   2HB   LEU  34          1HB       LEU  34  -5.677   5.310  -7.433
  257    HG   LEU  34           HG       LEU  34  -5.249   2.491  -8.392
  258   1HD1  LEU  34          1HD1      LEU  34  -3.456   4.313  -9.639
  259   2HD1  LEU  34          2HD1      LEU  34  -5.109   4.828  -9.976
  260   3HD1  LEU  34          3HD1      LEU  34  -4.594   3.192 -10.385
  261   1HD2  LEU  34          1HD2      LEU  34  -4.113   3.771  -6.328
  262   2HD2  LEU  34          2HD2      LEU  34  -3.039   4.293  -7.626
  263   3HD2  LEU  34          3HD2      LEU  34  -3.268   2.573  -7.309
  264    H    ARG  35           H        ARG  35  -9.024   3.853  -7.880
  265    HA   ARG  35           HA       ARG  35 -10.118   6.220  -6.835
  266   1HB   ARG  35          2HB       ARG  35 -11.383   3.845  -8.202
  267   2HB   ARG  35          1HB       ARG  35 -12.307   5.264  -7.727
  268   1HG   ARG  35          2HG       ARG  35 -11.150   6.652  -9.232
  269   2HG   ARG  35          1HG       ARG  35  -9.888   5.447  -9.494
  270   1HD   ARG  35          2HD       ARG  35 -11.227   4.143 -10.851
  271   2HD   ARG  35          1HD       ARG  35 -12.721   4.787 -10.168
  272    HE   ARG  35           HE       ARG  35 -12.649   6.495 -11.696
  273   1HH1  ARG  35          1HH1      ARG  35  -9.551   4.888 -11.637
  274   2HH1  ARG  35          2HH1      ARG  35  -8.947   5.731 -13.025
  275   1HH2  ARG  35          1HH2      ARG  35 -11.856   7.606 -13.519
  276   2HH2  ARG  35          2HH2      ARG  35 -10.254   7.276 -14.091
  277    H    GLU  36           H        GLU  36 -10.630   2.818  -5.987
  278    HA   GLU  36           HA       GLU  36 -12.502   3.356  -3.910
  279   1HB   GLU  36          2HB       GLU  36 -11.939   1.132  -5.242
  280   2HB   GLU  36          1HB       GLU  36 -10.839   0.875  -3.896
  281   1HG   GLU  36          2HG       GLU  36 -12.568  -0.056  -2.863
  282   2HG   GLU  36          1HG       GLU  36 -13.162   1.588  -2.635
  283    H    ALA  37           H        ALA  37  -9.010   3.034  -4.078
  284    HA   ALA  37           HA       ALA  37  -8.574   2.898  -1.267
  285   1HB   ALA  37          1HB       ALA  37  -6.224   3.421  -1.836
  286   2HB   ALA  37          2HB       ALA  37  -6.717   3.701  -3.506
  287   3HB   ALA  37          3HB       ALA  37  -6.882   2.095  -2.794
  288    H    GLU  38           H        GLU  38  -8.842   5.512  -3.599
  289    HA   GLU  38           HA       GLU  38  -7.903   7.572  -1.903
  290   1HB   GLU  38          2HB       GLU  38  -9.642   7.554  -4.354
  291   2HB   GLU  38          1HB       GLU  38  -9.301   9.042  -3.482
  292   1HG   GLU  38          2HG       GLU  38  -6.917   8.724  -3.853
  293   2HG   GLU  38          1HG       GLU  38  -7.243   7.218  -4.705
  294    H    LYS  39           H        LYS  39 -11.100   6.214  -2.537
  295    HA   LYS  39           HA       LYS  39 -12.582   8.038  -0.993
  296   1HB   LYS  39          2HB       LYS  39 -13.676   6.511  -2.539
  297   2HB   LYS  39          1HB       LYS  39 -13.106   5.125  -1.622
  298   1HG   LYS  39          2HG       LYS  39 -14.817   7.171  -0.288
  299   2HG   LYS  39          1HG       LYS  39 -15.549   5.958  -1.342
  300   1HD   LYS  39          2HD       LYS  39 -14.023   4.342   0.118
  301   2HD   LYS  39          1HD       LYS  39 -14.219   5.643   1.294
  302   1HE   LYS  39          2HE       LYS  39 -15.940   3.949   1.592
  303   2HE   LYS  39          1HE       LYS  39 -16.651   5.475   1.068
  304   1HZ   LYS  39          1HZ       LYS  39 -15.937   3.609  -1.043
  305   2HZ   LYS  39          2HZ       LYS  39 -17.297   4.604  -0.889
  306   3HZ   LYS  39          3HZ       LYS  39 -17.223   3.139  -0.050
  307    H    LYS  40           H        LYS  40 -10.840   5.089  -0.196
  308    HA   LYS  40           HA       LYS  40 -11.709   4.991   2.525
  309   1HB   LYS  40          2HB       LYS  40  -9.431   3.644   1.079
  310   2HB   LYS  40          1HB       LYS  40  -9.837   3.333   2.762
  311   1HG   LYS  40          2HG       LYS  40 -12.170   2.743   1.898
  312   2HG   LYS  40          1HG       LYS  40 -11.420   2.686   0.302
  313   1HD   LYS  40          2HD       LYS  40 -10.226   0.805   0.779
  314   2HD   LYS  40          1HD       LYS  40 -10.081   1.200   2.493
  315   1HE   LYS  40          2HE       LYS  40 -12.695   0.402   1.245
  316   2HE   LYS  40          1HE       LYS  40 -11.553  -0.787   1.872
  317   1HZ   LYS  40          1HZ       LYS  40 -13.259   1.081   3.303
  318   2HZ   LYS  40          2HZ       LYS  40 -11.706   0.866   3.940
  319   3HZ   LYS  40          3HZ       LYS  40 -12.733  -0.464   3.747
  320    H    ILE  41           H        ILE  41  -8.664   5.969   0.943
  321    HA   ILE  41           HA       ILE  41  -7.385   6.788   3.335
  322    HB   ILE  41           HB       ILE  41  -6.822   7.745   0.526
  323   1HG1  ILE  41          2HG1      ILE  41  -5.245   5.586   1.850
  324   2HG1  ILE  41          1HG1      ILE  41  -6.817   5.167   1.175
  325   1HG2  ILE  41          1HG2      ILE  41  -5.028   7.632   2.948
  326   2HG2  ILE  41          2HG2      ILE  41  -5.786   9.090   2.307
  327   3HG2  ILE  41          3HG2      ILE  41  -4.591   8.222   1.344
  328   1HD1  ILE  41          1HD1      ILE  41  -5.941   6.330  -0.958
  329   2HD1  ILE  41          2HD1      ILE  41  -5.369   4.711  -0.558
  330   3HD1  ILE  41          3HD1      ILE  41  -4.354   6.113  -0.219
  331    H    LYS  42           H        LYS  42  -9.610   8.354   1.179
  332    HA   LYS  42           HA       LYS  42  -9.099  11.030   1.830
  333   1HB   LYS  42          2HB       LYS  42 -10.405  10.637  -0.085
  334   2HB   LYS  42          1HB       LYS  42 -11.501   9.564   0.773
  335   1HG   LYS  42          2HG       LYS  42 -12.663  11.299   1.735
  336   2HG   LYS  42          1HG       LYS  42 -11.327  12.436   1.548
  337   1HD   LYS  42          2HD       LYS  42 -12.376  11.352  -0.971
  338   2HD   LYS  42          1HD       LYS  42 -13.525  12.335  -0.061
  339   1HE   LYS  42          2HE       LYS  42 -11.526  13.994   0.137
  340   2HE   LYS  42          1HE       LYS  42 -10.889  13.103  -1.246
  341   1HZ   LYS  42          1HZ       LYS  42 -13.351  13.552  -2.091
  342   2HZ   LYS  42          2HZ       LYS  42 -12.086  14.644  -2.355
  343   3HZ   LYS  42          3HZ       LYS  42 -13.176  14.901  -1.087
  344    H    GLU  43           H        GLU  43 -10.714   8.512   3.574
  345    HA   GLU  43           HA       GLU  43 -11.718  10.478   5.511
  346   1HB   GLU  43          2HB       GLU  43 -12.571   7.597   5.213
  347   2HB   GLU  43          1HB       GLU  43 -13.313   8.817   6.240
  348   1HG   GLU  43          2HG       GLU  43 -14.260   9.938   4.439
  349   2HG   GLU  43          1HG       GLU  43 -13.168   9.186   3.276
  350    H    LEU  44           H        LEU  44 -10.019   7.385   5.209
  351    HA   LEU  44           HA       LEU  44  -9.298   7.462   8.033
  352   1HB   LEU  44          2HB       LEU  44  -9.706   5.414   6.118
  353   2HB   LEU  44          1HB       LEU  44  -8.028   5.324   6.616
  354    HG   LEU  44           HG       LEU  44  -9.404   3.852   7.974
  355   1HD1  LEU  44          1HD1      LEU  44  -8.305   4.303   9.890
  356   2HD1  LEU  44          2HD1      LEU  44  -8.841   5.983   9.931
  357   3HD1  LEU  44          3HD1      LEU  44  -7.498   5.510   8.889
  358   1HD2  LEU  44          1HD2      LEU  44 -11.534   4.945   7.831
  359   2HD2  LEU  44          2HD2      LEU  44 -10.911   6.370   8.662
  360   3HD2  LEU  44          3HD2      LEU  44 -11.073   4.843   9.530
  361    H    PHE  45           H        PHE  45  -7.394   8.133   8.784
  362    HA   PHE  45           HA       PHE  45  -5.435   9.182   6.938
  363   1HB   PHE  45          2HB       PHE  45  -6.021  10.417   8.991
  364   2HB   PHE  45          1HB       PHE  45  -5.411   9.082   9.964
  365    HD1  PHE  45           1HD      PHE  45  -3.998  10.714   6.932
  366    HD2  PHE  45           2HD      PHE  45  -3.557   9.880  11.081
  367    HE1  PHE  45           1HE      PHE  45  -1.752  11.720   6.891
  368    HE2  PHE  45           2HE      PHE  45  -1.311  10.885  11.049
  369    HZ   PHE  45           HZ       PHE  45  -0.406  11.806   8.951
  370    H    PHE  46           H        PHE  46  -5.281   6.784   6.196
  371    HA   PHE  46           HA       PHE  46  -3.959   4.835   7.650
  372   1HB   PHE  46          2HB       PHE  46  -3.985   5.428   4.695
  373   2HB   PHE  46          1HB       PHE  46  -3.192   4.007   5.367
  374    HD1  PHE  46           1HD      PHE  46  -6.149   5.229   3.977
  375    HD2  PHE  46           2HD      PHE  46  -4.723   2.583   6.990
  376    HE1  PHE  46           1HE      PHE  46  -8.291   4.021   3.922
  377    HE2  PHE  46           2HE      PHE  46  -6.862   1.369   6.940
  378    HZ   PHE  46           HZ       PHE  46  -8.650   2.088   5.407
  379    HA   PRO  47           HA       PRO  47   0.083   6.766   8.027
  380   1HB   PRO  47          2HB       PRO  47   1.256   4.793   9.454
  381   2HB   PRO  47          1HB       PRO  47   0.106   5.924  10.177
  382   1HG   PRO  47          2HG       PRO  47  -0.339   3.126   9.215
  383   2HG   PRO  47          1HG       PRO  47  -0.927   3.906  10.693
  384   1HD   PRO  47          2HD       PRO  47  -2.466   3.586   8.473
  385   2HD   PRO  47          1HD       PRO  47  -2.670   4.937   9.605
  386    H    VAL  48           H        VAL  48  -0.643   3.633   6.709
  387    HA   VAL  48           HA       VAL  48   1.668   3.843   4.939
  388    HB   VAL  48           HB       VAL  48   0.961   1.218   6.225
  389   1HG1  VAL  48          1HG1      VAL  48   2.458   1.755   4.027
  390   2HG1  VAL  48          2HG1      VAL  48   2.683   0.350   5.069
  391   3HG1  VAL  48          3HG1      VAL  48   3.686   1.784   5.293
  392   1HG2  VAL  48          1HG2      VAL  48   1.612   2.360   8.097
  393   2HG2  VAL  48          2HG2      VAL  48   2.702   3.420   7.202
  394   3HG2  VAL  48          3HG2      VAL  48   3.160   1.745   7.514
  395    H    ILE  49           H        ILE  49   1.056   3.538   2.913
  396    HA   ILE  49           HA       ILE  49  -1.431   2.080   2.352
  397    HB   ILE  49           HB       ILE  49  -0.155   4.006   0.430
  398   1HG1  ILE  49          2HG1      ILE  49  -0.464   5.291   2.467
  399   2HG1  ILE  49          1HG1      ILE  49  -1.692   5.756   1.295
  400   1HG2  ILE  49          1HG2      ILE  49  -2.702   2.543   0.670
  401   2HG2  ILE  49          2HG2      ILE  49  -1.791   3.016  -0.764
  402   3HG2  ILE  49          3HG2      ILE  49  -2.811   4.195   0.060
  403   1HD1  ILE  49          1HD1      ILE  49  -2.002   4.725   3.948
  404   2HD1  ILE  49          2HD1      ILE  49  -2.827   3.687   2.786
  405   3HD1  ILE  49          3HD1      ILE  49  -3.210   5.408   2.860
  406    H    VAL  50           H        VAL  50  -1.460   0.696   0.489
  407    HA   VAL  50           HA       VAL  50   1.169   0.002  -0.613
  408    HB   VAL  50           HB       VAL  50  -0.810  -2.131   0.184
  409   1HG1  VAL  50          1HG1      VAL  50   1.612  -3.292   0.245
  410   2HG1  VAL  50          2HG1      VAL  50   1.900  -2.053  -0.977
  411   3HG1  VAL  50          3HG1      VAL  50   0.602  -3.225  -1.199
  412   1HG2  VAL  50          1HG2      VAL  50   0.222  -2.459   2.248
  413   2HG2  VAL  50          2HG2      VAL  50   0.097  -0.704   2.138
  414   3HG2  VAL  50          3HG2      VAL  50   1.633  -1.500   1.802
  415    H    LEU  51           H        LEU  51   0.670  -1.742  -2.508
  416    HA   LEU  51           HA       LEU  51  -1.845  -1.369  -3.801
  417   1HB   LEU  51          2HB       LEU  51  -0.921   0.761  -4.395
  418   2HB   LEU  51          1HB       LEU  51   0.588   0.024  -4.895
  419    HG   LEU  51           HG       LEU  51  -0.492  -1.013  -6.799
  420   1HD1  LEU  51          1HD1      LEU  51  -2.804  -0.772  -7.300
  421   2HD1  LEU  51          2HD1      LEU  51  -3.043   0.334  -5.946
  422   3HD1  LEU  51          3HD1      LEU  51  -2.681  -1.366  -5.644
  423   1HD2  LEU  51          1HD2      LEU  51  -0.654   1.899  -6.359
  424   2HD2  LEU  51          2HD2      LEU  51  -1.531   1.264  -7.750
  425   3HD2  LEU  51          3HD2      LEU  51   0.203   0.980  -7.598
  426    H    ASP  52           H        ASP  52  -1.573  -3.672  -3.537
  427    HA   ASP  52           HA       ASP  52   0.459  -5.105  -4.923
  428   1HB   ASP  52          2HB       ASP  52  -0.983  -5.910  -2.951
  429   2HB   ASP  52          1HB       ASP  52  -2.224  -6.241  -4.156
  430    H    VAL  53           H        VAL  53   0.083  -3.719  -6.919
  431    HA   VAL  53           HA       VAL  53  -2.071  -3.808  -8.597
  432    HB   VAL  53           HB       VAL  53   0.814  -4.011  -9.475
  433   1HG1  VAL  53          1HG1      VAL  53  -0.323  -4.314 -11.439
  434   2HG1  VAL  53          2HG1      VAL  53  -0.260  -2.552 -11.383
  435   3HG1  VAL  53          3HG1      VAL  53  -1.729  -3.397 -10.896
  436   1HG2  VAL  53          1HG2      VAL  53   0.695  -2.158  -8.028
  437   2HG2  VAL  53          2HG2      VAL  53  -0.872  -1.660  -8.665
  438   3HG2  VAL  53          3HG2      VAL  53   0.577  -1.493  -9.657
  439    H    TRP  54           H        TRP  54  -3.184  -5.762  -8.592
  440    HA   TRP  54           HA       TRP  54  -1.865  -8.224  -9.294
  441   1HB   TRP  54          2HB       TRP  54  -3.739  -8.317  -7.764
  442   2HB   TRP  54          1HB       TRP  54  -4.790  -7.533  -8.938
  443    HD1  TRP  54           HD       TRP  54  -6.460  -9.273  -9.777
  444    HE1  TRP  54           1HE      TRP  54  -6.346 -11.727 -10.542
  445    HE3  TRP  54           3HE      TRP  54  -1.515 -10.182  -8.855
  446    HZ2  TRP  54           2HZ      TRP  54  -4.415 -13.779 -10.730
  447    HZ3  TRP  54           3HZ      TRP  54  -0.613 -12.415  -9.354
  448    HH2  TRP  54           HH       TRP  54  -2.034 -14.176 -10.272
  449    H    MET  55           H        MET  55  -4.822  -6.968 -10.797
  450    HA   MET  55           HA       MET  55  -3.556  -6.835 -13.397
  451   1HB   MET  55          2HB       MET  55  -4.457  -9.268 -12.771
  452   2HB   MET  55          1HB       MET  55  -5.972  -8.569 -13.321
  453   1HG   MET  55          2HG       MET  55  -4.337  -7.821 -15.328
  454   2HG   MET  55          1HG       MET  55  -3.576  -9.333 -14.839
  455   1HE   MET  55          1HE       MET  55  -4.840  -9.652 -17.943
  456   2HE   MET  55          2HE       MET  55  -5.152 -11.298 -17.395
  457   3HE   MET  55          3HE       MET  55  -3.743 -10.423 -16.796
  458    HA   PRO  56           HA       PRO  56  -7.357  -4.166 -12.859
  459   1HB   PRO  56          2HB       PRO  56  -6.116  -1.901 -11.792
  460   2HB   PRO  56          1HB       PRO  56  -7.030  -3.102 -10.882
  461   1HG   PRO  56          2HG       PRO  56  -4.259  -2.570 -10.707
  462   2HG   PRO  56          1HG       PRO  56  -5.144  -3.894  -9.936
  463   1HD   PRO  56          2HD       PRO  56  -3.517  -3.898 -12.423
  464   2HD   PRO  56          1HD       PRO  56  -3.809  -5.203 -11.258
  465    H    ASP  57           H        ASP  57  -7.092  -1.415 -13.304
  466    HA   ASP  57           HA       ASP  57  -5.325  -0.961 -15.532
  467   1HB   ASP  57          2HB       ASP  57  -8.302  -1.192 -15.964
  468   2HB   ASP  57          1HB       ASP  57  -7.209  -0.415 -17.105
  469    H    GLY  58           H        GLY  58  -5.095   0.468 -13.391
  470   1HA   GLY  58          2HA       GLY  58  -6.391   3.023 -14.071
  471   2HA   GLY  58          1HA       GLY  58  -6.389   2.461 -12.407
  472    H    ASP  59           H        ASP  59  -3.558   1.570 -14.035
  473    HA   ASP  59           HA       ASP  59  -1.384   2.184 -13.746
  474   1HB   ASP  59          2HB       ASP  59  -2.408   5.023 -13.872
  475   2HB   ASP  59          1HB       ASP  59  -0.829   4.423 -14.371
  476    H    GLY  60           H        GLY  60  -0.236   4.449 -12.492
  477   1HA   GLY  60          2HA       GLY  60  -1.291   4.919  -9.908
  478   2HA   GLY  60          1HA       GLY  60  -0.115   3.617  -9.835
  479    H    VAL  61           H        VAL  61   0.189   6.249 -12.117
  480    HA   VAL  61           HA       VAL  61   2.716   6.987 -10.917
  481    HB   VAL  61           HB       VAL  61   1.439   8.114 -13.403
  482   1HG1  VAL  61          1HG1      VAL  61   4.173   8.169 -12.209
  483   2HG1  VAL  61          2HG1      VAL  61   3.190   9.500 -12.814
  484   3HG1  VAL  61          3HG1      VAL  61   3.940   8.373 -13.944
  485   1HG2  VAL  61          1HG2      VAL  61   3.455   5.890 -13.370
  486   2HG2  VAL  61          2HG2      VAL  61   2.451   6.453 -14.706
  487   3HG2  VAL  61          3HG2      VAL  61   1.721   5.574 -13.365
  488    H    ASN  62           H        ASN  62  -0.375   8.512 -11.767
  489    HA   ASN  62           HA       ASN  62   0.418  10.984 -10.457
  490   1HB   ASN  62          2HB       ASN  62  -1.403  10.279 -12.534
  491   2HB   ASN  62          1HB       ASN  62  -2.324  11.042 -11.242
  492   1HD2  ASN  62          1HD2      ASN  62   0.413  11.438 -13.406
  493   2HD2  ASN  62          2HD2      ASN  62   0.409  13.166 -13.395
  494    H    PHE  63           H        PHE  63  -0.463   8.201  -9.187
  495    HA   PHE  63           HA       PHE  63  -2.596   9.149  -7.452
  496   1HB   PHE  63          2HB       PHE  63  -2.725   6.853  -8.288
  497   2HB   PHE  63          1HB       PHE  63  -1.171   6.481  -7.548
  498    HD1  PHE  63           1HD      PHE  63  -4.071   8.364  -6.188
  499    HD2  PHE  63           2HD      PHE  63  -1.620   4.896  -5.917
  500    HE1  PHE  63           1HE      PHE  63  -5.215   7.724  -4.108
  501    HE2  PHE  63           2HE      PHE  63  -2.762   4.248  -3.834
  502    HZ   PHE  63           HZ       PHE  63  -4.564   5.664  -2.928
  503    H    ILE  64           H        ILE  64   0.817   8.330  -7.302
  504    HA   ILE  64           HA       ILE  64   1.323   8.223  -4.620
  505    HB   ILE  64           HB       ILE  64   3.020   9.643  -6.678
  506   1HG1  ILE  64          2HG1      ILE  64   4.141   7.171  -6.156
  507   2HG1  ILE  64          1HG1      ILE  64   2.414   6.827  -6.162
  508   1HG2  ILE  64          1HG2      ILE  64   4.890   9.210  -5.188
  509   2HG2  ILE  64          2HG2      ILE  64   3.806   8.459  -4.018
  510   3HG2  ILE  64          3HG2      ILE  64   3.664  10.181  -4.372
  511   1HD1  ILE  64          1HD1      ILE  64   4.063   8.019  -8.368
  512   2HD1  ILE  64          2HD1      ILE  64   2.302   7.984  -8.382
  513   3HD1  ILE  64          3HD1      ILE  64   3.210   6.477  -8.356
  514    H    ASP  65           H        ASP  65   0.460  11.033  -6.497
  515    HA   ASP  65           HA       ASP  65   1.246  12.957  -4.536
  516   1HB   ASP  65          2HB       ASP  65   0.599  13.135  -7.163
  517   2HB   ASP  65          1HB       ASP  65  -0.910  13.675  -6.433
  518    H    PHE  66           H        PHE  66  -1.709  11.198  -5.261
  519    HA   PHE  66           HA       PHE  66  -3.446  12.662  -3.602
  520   1HB   PHE  66          2HB       PHE  66  -4.242  11.063  -5.296
  521   2HB   PHE  66          1HB       PHE  66  -3.559   9.734  -4.365
  522    HD1  PHE  66           1HD      PHE  66  -4.435   9.459  -1.945
  523    HD2  PHE  66           2HD      PHE  66  -6.434  11.698  -4.961
  524    HE1  PHE  66           1HE      PHE  66  -6.543   9.259  -0.693
  525    HE2  PHE  66           2HE      PHE  66  -8.546  11.503  -3.714
  526    HZ   PHE  66           HZ       PHE  66  -8.602  10.282  -1.576
  527    H    ILE  67           H        ILE  67  -1.423   9.817  -3.011
  528    HA   ILE  67           HA       ILE  67  -2.222   9.312  -0.376
  529    HB   ILE  67           HB       ILE  67   0.452   8.818  -1.699
  530   1HG1  ILE  67          2HG1      ILE  67  -0.606   6.393  -1.479
  531   2HG1  ILE  67          1HG1      ILE  67  -2.113   7.304  -1.477
  532   1HG2  ILE  67          1HG2      ILE  67   0.782   7.144   0.122
  533   2HG2  ILE  67          2HG2      ILE  67  -0.618   7.837   0.942
  534   3HG2  ILE  67          3HG2      ILE  67   0.818   8.822   0.665
  535   1HD1  ILE  67          1HD1      ILE  67  -0.382   8.201  -3.591
  536   2HD1  ILE  67          2HD1      ILE  67  -2.025   7.566  -3.671
  537   3HD1  ILE  67          3HD1      ILE  67  -0.651   6.461  -3.684
  538    H    LYS  68           H        LYS  68   0.173  11.535  -1.710
  539    HA   LYS  68           HA       LYS  68   1.023  12.380   0.933
  540   1HB   LYS  68          2HB       LYS  68   1.743  13.451  -1.804
  541   2HB   LYS  68          1HB       LYS  68   2.494  13.940  -0.291
  542   1HG   LYS  68          2HG       LYS  68   2.825  11.252  -0.187
  543   2HG   LYS  68          1HG       LYS  68   2.920  11.544  -1.925
  544   1HD   LYS  68          2HD       LYS  68   4.913  12.564  -1.758
  545   2HD   LYS  68          1HD       LYS  68   4.431  13.467  -0.321
  546   1HE   LYS  68          2HE       LYS  68   5.125  10.540  -0.264
  547   2HE   LYS  68          1HE       LYS  68   6.320  11.812  -0.021
  548   1HZ   LYS  68          1HZ       LYS  68   4.914  12.627   1.833
  549   2HZ   LYS  68          2HZ       LYS  68   5.555  11.084   2.097
  550   3HZ   LYS  68          3HZ       LYS  68   3.933  11.260   1.653
  551    H    GLU  69           H        GLU  69  -1.340  13.249  -1.397
  552    HA   GLU  69           HA       GLU  69  -1.629  15.991  -0.734
  553   1HB   GLU  69          2HB       GLU  69  -2.475  14.849  -2.823
  554   2HB   GLU  69          1HB       GLU  69  -3.765  14.178  -1.837
  555   1HG   GLU  69          2HG       GLU  69  -4.725  16.274  -1.457
  556   2HG   GLU  69          1HG       GLU  69  -3.272  17.129  -1.973
  557    H    ASN  70           H        ASN  70  -2.823  13.024   0.626
  558    HA   ASN  70           HA       ASN  70  -4.150  14.576   2.738
  559   1HB   ASN  70          2HB       ASN  70  -5.672  12.334   2.728
  560   2HB   ASN  70          1HB       ASN  70  -6.100  13.810   1.868
  561   1HD2  ASN  70          1HD2      ASN  70  -5.092  13.933  -0.385
  562   2HD2  ASN  70          2HD2      ASN  70  -5.187  12.496  -1.337
  563    H    SER  71           H        SER  71  -1.601  12.761   2.178
  564    HA   SER  71           HA       SER  71  -1.439  11.825   4.890
  565   1HB   SER  71          2HB       SER  71  -2.144   9.984   2.745
  566   2HB   SER  71          1HB       SER  71  -0.666   9.497   3.574
  567    HG   SER  71           HG       SER  71  -3.136   9.162   4.392
  568    HA   PRO  72           HA       PRO  72   2.541  13.052   2.804
  569   1HB   PRO  72          2HB       PRO  72   2.817  15.073   4.865
  570   2HB   PRO  72          1HB       PRO  72   2.720  15.286   3.116
  571   1HG   PRO  72          2HG       PRO  72   0.755  16.067   4.841
  572   2HG   PRO  72          1HG       PRO  72   0.457  15.615   3.153
  573   1HD   PRO  72          2HD       PRO  72   0.051  14.014   5.648
  574   2HD   PRO  72          1HD       PRO  72  -0.962  14.113   4.191
  575    H    ASP  73           H        ASP  73   1.514  12.195   5.929
  576    HA   ASP  73           HA       ASP  73   4.266  11.586   6.760
  577   1HB   ASP  73          2HB       ASP  73   2.551  13.034   8.160
  578   2HB   ASP  73          1HB       ASP  73   2.007  11.443   8.686
  579    H    SER  74           H        SER  74   2.568   9.993   4.935
  580    HA   SER  74           HA       SER  74   2.226   7.556   6.543
  581   1HB   SER  74          2HB       SER  74   0.216   8.284   5.325
  582   2HB   SER  74          1HB       SER  74   1.113   8.229   3.807
  583    HG   SER  74           HG       SER  74  -0.193   6.264   4.977
  584    H    VAL  75           H        VAL  75   2.320   5.695   4.428
  585    HA   VAL  75           HA       VAL  75   4.922   6.060   3.168
  586    HB   VAL  75           HB       VAL  75   4.410   3.583   4.800
  587   1HG1  VAL  75          1HG1      VAL  75   7.142   4.216   4.093
  588   2HG1  VAL  75          2HG1      VAL  75   6.121   4.156   2.658
  589   3HG1  VAL  75          3HG1      VAL  75   6.200   2.767   3.742
  590   1HG2  VAL  75          1HG2      VAL  75   4.712   5.183   6.455
  591   2HG2  VAL  75          2HG2      VAL  75   5.826   6.137   5.475
  592   3HG2  VAL  75          3HG2      VAL  75   6.354   4.606   6.173
  593    H    VAL  76           H        VAL  76   5.028   5.229   1.226
  594    HA   VAL  76           HA       VAL  76   2.822   3.489   0.358
  595    HB   VAL  76           HB       VAL  76   4.622   4.746  -1.644
  596   1HG1  VAL  76          1HG1      VAL  76   2.596   3.188  -2.029
  597   2HG1  VAL  76          2HG1      VAL  76   2.780   4.620  -3.041
  598   3HG1  VAL  76          3HG1      VAL  76   1.635   4.629  -1.699
  599   1HG2  VAL  76          1HG2      VAL  76   2.758   6.245   0.148
  600   2HG2  VAL  76          2HG2      VAL  76   2.943   6.744  -1.533
  601   3HG2  VAL  76          3HG2      VAL  76   4.345   6.713  -0.465
  602    H    ILE  77           H        ILE  77   3.299   1.419   0.353
  603    HA   ILE  77           HA       ILE  77   5.983   0.570  -0.507
  604    HB   ILE  77           HB       ILE  77   3.976  -1.092   1.018
  605   1HG1  ILE  77          2HG1      ILE  77   4.612   0.835   2.380
  606   2HG1  ILE  77          1HG1      ILE  77   5.350  -0.632   3.017
  607   1HG2  ILE  77          1HG2      ILE  77   5.427  -2.612   0.109
  608   2HG2  ILE  77          2HG2      ILE  77   6.281  -2.222   1.602
  609   3HG2  ILE  77          3HG2      ILE  77   6.776  -1.476   0.082
  610   1HD1  ILE  77          1HD1      ILE  77   7.351   0.162   1.472
  611   2HD1  ILE  77          2HD1      ILE  77   7.137   0.753   3.120
  612   3HD1  ILE  77          3HD1      ILE  77   6.601   1.733   1.756
  613    H    VAL  78           H        VAL  78   4.026   1.342  -2.383
  614    HA   VAL  78           HA       VAL  78   2.342  -0.469  -3.501
  615    HB   VAL  78           HB       VAL  78   4.317   1.230  -5.046
  616   1HG1  VAL  78          1HG1      VAL  78   1.713   0.867  -6.248
  617   2HG1  VAL  78          2HG1      VAL  78   2.524  -0.679  -5.997
  618   3HG1  VAL  78          3HG1      VAL  78   3.313   0.591  -6.930
  619   1HG2  VAL  78          1HG2      VAL  78   1.910   2.529  -5.097
  620   2HG2  VAL  78          2HG2      VAL  78   3.258   2.918  -4.028
  621   3HG2  VAL  78          3HG2      VAL  78   1.951   1.879  -3.458
  622    H    ILE  79           H        ILE  79   2.561  -2.543  -3.917
  623    HA   ILE  79           HA       ILE  79   5.173  -3.593  -4.763
  624    HB   ILE  79           HB       ILE  79   2.938  -5.402  -3.971
  625   1HG1  ILE  79          2HG1      ILE  79   4.678  -3.995  -1.941
  626   2HG1  ILE  79          1HG1      ILE  79   3.002  -3.566  -2.264
  627   1HG2  ILE  79          1HG2      ILE  79   5.234  -6.264  -2.769
  628   2HG2  ILE  79          2HG2      ILE  79   5.845  -5.491  -4.231
  629   3HG2  ILE  79          3HG2      ILE  79   4.654  -6.786  -4.350
  630   1HD1  ILE  79          1HD1      ILE  79   2.798  -4.917  -0.426
  631   2HD1  ILE  79          2HD1      ILE  79   4.114  -5.980  -0.925
  632   3HD1  ILE  79          3HD1      ILE  79   2.550  -6.072  -1.735
  633    H    THR  80           H        THR  80   4.744  -5.784  -6.090
  634    HA   THR  80           HA       THR  80   4.219  -6.676  -8.105
  635    HB   THR  80           HB       THR  80   1.686  -5.755  -8.766
  636    HG1  THR  80           1HG      THR  80   1.874  -5.989  -5.950
  637   1HG2  THR  80          1HG2      THR  80   1.943  -8.032  -8.853
  638   2HG2  THR  80          2HG2      THR  80   0.934  -7.833  -7.420
  639   3HG2  THR  80          3HG2      THR  80   2.665  -8.121  -7.246
  640    H    GLY  81           H        GLY  81   5.037  -6.101  -9.990
  641   1HA   GLY  81          2HA       GLY  81   4.340  -3.461 -11.094
  642   2HA   GLY  81          1HA       GLY  81   6.026  -3.941 -10.978
  643    H    HIS  82           H        HIS  82   5.208  -3.266 -13.409
  644    HA   HIS  82           HA       HIS  82   4.061  -5.356 -14.941
  645   1HB   HIS  82          2HB       HIS  82   5.806  -3.046 -15.821
  646   2HB   HIS  82          1HB       HIS  82   4.862  -4.072 -16.894
  647    HD1  HIS  82           1HD      HIS  82   3.730  -1.729 -17.583
  648    HD2  HIS  82           2HD      HIS  82   2.910  -3.115 -13.753
  649    HE1  HIS  82           1HE      HIS  82   1.714  -0.436 -16.817
  650    HE2  HIS  82           2HE      HIS  82   1.184  -1.355 -14.532
  651    H    GLY  83           H        GLY  83   7.402  -4.117 -15.149
  652   1HA   GLY  83          2HA       GLY  83   8.675  -6.587 -14.753
  653   2HA   GLY  83          1HA       GLY  83   8.414  -6.376 -16.477
  654    H    SER  84           H        SER  84  10.887  -6.430 -14.785
  655    HA   SER  84           HA       SER  84  12.913  -5.401 -14.694
  656   1HB   SER  84          2HB       SER  84  13.660  -4.334 -16.644
  657   2HB   SER  84          1HB       SER  84  12.364  -5.376 -17.228
  658    HG   SER  84           HG       SER  84  12.568  -2.701 -17.352
  659    H    VAL  85           H        VAL  85  10.690  -4.286 -13.182
  660    HA   VAL  85           HA       VAL  85  10.024  -2.410 -12.049
  661    HB   VAL  85           HB       VAL  85  11.927  -1.152 -11.019
  662   1HG1  VAL  85          1HG1      VAL  85  11.509  -4.072 -10.880
  663   2HG1  VAL  85          2HG1      VAL  85  11.384  -2.843  -9.621
  664   3HG1  VAL  85          3HG1      VAL  85  12.966  -3.450 -10.106
  665   1HG2  VAL  85          1HG2      VAL  85  14.192  -1.847 -11.421
  666   2HG2  VAL  85          2HG2      VAL  85  13.465  -1.376 -12.957
  667   3HG2  VAL  85          3HG2      VAL  85  13.656  -3.083 -12.558
  668    H    ASP  86           H        ASP  86   9.314  -1.753 -14.418
  669    HA   ASP  86           HA       ASP  86  10.607   0.787 -15.135
  670   1HB   ASP  86          2HB       ASP  86   9.379   0.587 -17.276
  671   2HB   ASP  86          1HB       ASP  86  10.427  -0.797 -16.976
  672    H    THR  87           H        THR  87   7.795  -0.531 -13.691
  673    HA   THR  87           HA       THR  87   6.225   1.888 -14.150
  674    HB   THR  87           HB       THR  87   5.257  -0.516 -14.167
  675    HG1  THR  87           1HG      THR  87   3.839   1.149 -14.210
  676   1HG2  THR  87          1HG2      THR  87   6.165  -1.335 -12.073
  677   2HG2  THR  87          2HG2      THR  87   4.402  -1.307 -12.021
  678   3HG2  THR  87          3HG2      THR  87   5.328  -0.057 -11.193
  679    H    ALA  88           H        ALA  88   7.963   0.168 -11.659
  680    HA   ALA  88           HA       ALA  88   7.203   1.624  -9.405
  681   1HB   ALA  88          1HB       ALA  88   9.206   0.818  -8.382
  682   2HB   ALA  88          2HB       ALA  88   9.967   0.552  -9.949
  683   3HB   ALA  88          3HB       ALA  88   8.610  -0.455  -9.447
  684    H    VAL  89           H        VAL  89  10.045   2.064 -11.474
  685    HA   VAL  89           HA       VAL  89  11.026   4.396 -10.381
  686    HB   VAL  89           HB       VAL  89  12.092   4.831 -12.556
  687   1HG1  VAL  89          1HG1      VAL  89  12.309   1.900 -12.443
  688   2HG1  VAL  89          2HG1      VAL  89  12.564   2.739 -10.913
  689   3HG1  VAL  89          3HG1      VAL  89  13.558   3.139 -12.314
  690   1HG2  VAL  89          1HG2      VAL  89  11.627   3.469 -14.497
  691   2HG2  VAL  89          2HG2      VAL  89  10.143   4.257 -13.963
  692   3HG2  VAL  89          3HG2      VAL  89  10.415   2.553 -13.602
  693    H    LYS  90           H        LYS  90   8.240   3.916 -12.412
  694    HA   LYS  90           HA       LYS  90   7.943   6.761 -12.949
  695   1HB   LYS  90          2HB       LYS  90   7.357   4.966 -14.634
  696   2HB   LYS  90          1HB       LYS  90   5.996   4.552 -13.599
  697   1HG   LYS  90          2HG       LYS  90   5.079   6.787 -13.875
  698   2HG   LYS  90          1HG       LYS  90   6.459   7.242 -14.872
  699   1HD   LYS  90          2HD       LYS  90   5.423   4.891 -16.001
  700   2HD   LYS  90          1HD       LYS  90   4.032   5.903 -15.618
  701   1HE   LYS  90          2HE       LYS  90   5.435   7.787 -16.733
  702   2HE   LYS  90          1HE       LYS  90   6.325   6.450 -17.457
  703   1HZ   LYS  90          1HZ       LYS  90   4.003   7.549 -18.392
  704   2HZ   LYS  90          2HZ       LYS  90   3.502   6.096 -17.683
  705   3HZ   LYS  90          3HZ       LYS  90   4.686   6.085 -18.891
  706    H    ALA  91           H        ALA  91   7.946   5.987 -10.217
  707    HA   ALA  91           HA       ALA  91   5.604   7.302  -9.318
  708   1HB   ALA  91          1HB       ALA  91   4.788   5.327  -7.928
  709   2HB   ALA  91          2HB       ALA  91   5.743   4.314  -9.011
  710   3HB   ALA  91          3HB       ALA  91   4.424   5.294  -9.653
  711    H    ILE  92           H        ILE  92   8.230   5.080  -8.478
  712    HA   ILE  92           HA       ILE  92   8.424   6.006  -5.776
  713    HB   ILE  92           HB       ILE  92  10.089   4.450  -5.448
  714   1HG1  ILE  92          2HG1      ILE  92  10.831   4.786  -8.363
  715   2HG1  ILE  92          1HG1      ILE  92  11.774   5.270  -6.957
  716   1HG2  ILE  92          1HG2      ILE  92   9.259   2.930  -7.796
  717   2HG2  ILE  92          2HG2      ILE  92   7.912   3.639  -6.906
  718   3HG2  ILE  92          3HG2      ILE  92   9.050   2.574  -6.082
  719   1HD1  ILE  92          1HD1      ILE  92  12.637   3.243  -8.047
  720   2HD1  ILE  92          2HD1      ILE  92  11.115   2.426  -7.693
  721   3HD1  ILE  92          3HD1      ILE  92  12.156   2.960  -6.374
  722    H    LYS  93           H        LYS  93  10.311   7.069  -4.863
  723    HA   LYS  93           HA       LYS  93  11.978   8.633  -4.792
  724   1HB   LYS  93          2HB       LYS  93  12.403   7.485  -7.276
  725   2HB   LYS  93          1HB       LYS  93  12.237   9.196  -7.645
  726   1HG   LYS  93          2HG       LYS  93  14.000   9.724  -6.051
  727   2HG   LYS  93          1HG       LYS  93  14.151   8.015  -5.642
  728   1HD   LYS  93          2HD       LYS  93  14.339   8.572  -8.509
  729   2HD   LYS  93          1HD       LYS  93  15.615   9.324  -7.550
  730   1HE   LYS  93          2HE       LYS  93  16.386   7.169  -8.232
  731   2HE   LYS  93          1HE       LYS  93  16.039   7.098  -6.505
  732   1HZ   LYS  93          1HZ       LYS  93  14.068   5.907  -6.891
  733   2HZ   LYS  93          2HZ       LYS  93  15.222   5.178  -7.891
  734   3HZ   LYS  93          3HZ       LYS  93  14.079   6.236  -8.551
  735    H    LYS  94           H        LYS  94   8.951   8.984  -6.041
  736    HA   LYS  94           HA       LYS  94   9.176  11.909  -6.241
  737   1HB   LYS  94          2HB       LYS  94   7.337   9.933  -7.537
  738   2HB   LYS  94          1HB       LYS  94   6.837  11.606  -7.332
  739   1HG   LYS  94          2HG       LYS  94   9.410  10.861  -8.682
  740   2HG   LYS  94          1HG       LYS  94   7.880  10.977  -9.554
  741   1HD   LYS  94          2HD       LYS  94   8.659  13.255  -7.814
  742   2HD   LYS  94          1HD       LYS  94   9.541  13.039  -9.327
  743   1HE   LYS  94          2HE       LYS  94   7.845  14.336 -10.103
  744   2HE   LYS  94          1HE       LYS  94   7.073  12.760 -10.271
  745   1HZ   LYS  94          1HZ       LYS  94   6.773  14.439  -7.848
  746   2HZ   LYS  94          2HZ       LYS  94   5.855  13.091  -8.298
  747   3HZ   LYS  94          3HZ       LYS  94   5.714  14.537  -9.164
  748    H    GLY  95           H        GLY  95   7.725   9.240  -4.592
  749   1HA   GLY  95          2HA       GLY  95   6.904  10.821  -2.399
  750   2HA   GLY  95          1HA       GLY  95   5.511  10.429  -3.396
  751    H    ALA  96           H        ALA  96   6.491   7.829  -4.217
  752    HA   ALA  96           HA       ALA  96   5.504   6.296  -2.046
  753   1HB   ALA  96          1HB       ALA  96   6.046   4.340  -3.445
  754   2HB   ALA  96          2HB       ALA  96   6.882   5.402  -4.576
  755   3HB   ALA  96          3HB       ALA  96   5.145   5.570  -4.329
  756    H    TYR  97           H        TYR  97   6.837   4.178  -1.494
  757    HA   TYR  97           HA       TYR  97   9.433   5.117  -0.483
  758   1HB   TYR  97          2HB       TYR  97   7.637   4.477   1.158
  759   2HB   TYR  97          1HB       TYR  97   7.770   2.828   0.557
  760    HD1  TYR  97           1HD      TYR  97   9.201   1.368   1.632
  761    HD2  TYR  97           2HD      TYR  97   9.906   5.549   1.968
  762    HE1  TYR  97           1HE      TYR  97  11.022   0.925   3.223
  763    HE2  TYR  97           2HE      TYR  97  11.731   5.119   3.560
  764    HH   TYR  97           HH       TYR  97  12.215   2.114   5.034
  765    H    GLU  98           H        GLU  98   8.975   3.985  -3.122
  766    HA   GLU  98           HA       GLU  98  10.239   2.722  -4.547
  767   1HB   GLU  98          2HB       GLU  98  12.243   1.902  -3.886
  768   2HB   GLU  98          1HB       GLU  98  11.895   2.813  -2.428
  769   1HG   GLU  98          2HG       GLU  98  12.407   0.882  -1.416
  770   2HG   GLU  98          1HG       GLU  98  10.739   0.464  -1.796
  771    H    PHE  99           H        PHE  99   9.870   0.814  -5.604
  772    HA   PHE  99           HA       PHE  99   7.583  -0.658  -4.820
  773   1HB   PHE  99          2HB       PHE  99   9.424  -0.595  -7.103
  774   2HB   PHE  99          1HB       PHE  99   8.747  -2.184  -6.781
  775    HD1  PHE  99           1HD      PHE  99   7.218   1.182  -6.390
  776    HD2  PHE  99           2HD      PHE  99   7.183  -2.543  -8.447
  777    HE1  PHE  99           1HE      PHE  99   5.148   1.843  -7.543
  778    HE2  PHE  99           2HE      PHE  99   5.113  -1.888  -9.604
  779    HZ   PHE  99           HZ       PHE  99   4.092   0.307  -9.153
  780    H    LEU 100           H        LEU 100   7.348  -2.710  -4.028
  781    HA   LEU 100           HA       LEU 100   9.649  -3.805  -2.634
  782   1HB   LEU 100          2HB       LEU 100   7.244  -3.460  -1.703
  783   2HB   LEU 100          1HB       LEU 100   6.878  -4.945  -2.555
  784    HG   LEU 100           HG       LEU 100   7.327  -5.561  -0.322
  785   1HD1  LEU 100          1HD1      LEU 100   8.402  -6.935  -2.102
  786   2HD1  LEU 100          2HD1      LEU 100   9.189  -7.038  -0.525
  787   3HD1  LEU 100          3HD1      LEU 100   9.899  -6.052  -1.803
  788   1HD2  LEU 100          1HD2      LEU 100   9.442  -3.510  -0.533
  789   2HD2  LEU 100          2HD2      LEU 100   9.795  -4.912   0.478
  790   3HD2  LEU 100          3HD2      LEU 100   8.379  -3.915   0.816
  791    H    GLU 101           H        GLU 101  10.849  -4.705  -4.327
  792    HA   GLU 101           HA       GLU 101   9.915  -6.318  -6.381
  793   1HB   GLU 101          2HB       GLU 101  12.565  -6.634  -4.965
  794   2HB   GLU 101          1HB       GLU 101  12.183  -7.124  -6.610
  795   1HG   GLU 101          2HG       GLU 101  12.380  -4.320  -5.544
  796   2HG   GLU 101          1HG       GLU 101  13.462  -5.113  -6.688
  797    H    LYS 102           H        LYS 102  10.813  -8.736  -6.514
  798    HA   LYS 102           HA       LYS 102  10.459 -10.904  -5.935
  799   1HB   LYS 102          2HB       LYS 102  10.980  -9.633  -3.274
  800   2HB   LYS 102          1HB       LYS 102  10.468 -11.314  -3.345
  801   1HG   LYS 102          2HG       LYS 102  12.562 -10.936  -5.232
  802   2HG   LYS 102          1HG       LYS 102  13.062 -10.241  -3.689
  803   1HD   LYS 102          2HD       LYS 102  12.942 -12.267  -2.587
  804   2HD   LYS 102          1HD       LYS 102  11.789 -12.943  -3.741
  805   1HE   LYS 102          2HE       LYS 102  13.839 -14.050  -4.135
  806   2HE   LYS 102          1HE       LYS 102  13.651 -12.885  -5.445
  807   1HZ   LYS 102          1HZ       LYS 102  15.907 -12.939  -4.480
  808   2HZ   LYS 102          2HZ       LYS 102  15.274 -12.405  -3.006
  809   3HZ   LYS 102          3HZ       LYS 102  15.181 -11.414  -4.374
  810    HA   PRO 103           HA       PRO 103   5.929  -9.678  -5.273
  811   1HB   PRO 103          2HB       PRO 103   5.787 -11.510  -7.615
  812   2HB   PRO 103          1HB       PRO 103   4.928  -9.995  -7.317
  813   1HG   PRO 103          2HG       PRO 103   6.955 -10.091  -9.041
  814   2HG   PRO 103          1HG       PRO 103   6.728  -8.691  -7.977
  815   1HD   PRO 103          2HD       PRO 103   8.694 -10.930  -7.775
  816   2HD   PRO 103          1HD       PRO 103   8.897  -9.210  -7.383
  817    H    PHE 104           H        PHE 104   4.064 -11.353  -5.230
  818    HA   PHE 104           HA       PHE 104   3.144 -13.205  -4.287
  819   1HB   PHE 104          2HB       PHE 104   5.533 -14.223  -5.676
  820   2HB   PHE 104          1HB       PHE 104   4.940 -15.262  -4.383
  821    HD1  PHE 104           1HD      PHE 104   3.226 -13.139  -6.928
  822    HD2  PHE 104           2HD      PHE 104   3.770 -17.022  -5.272
  823    HE1  PHE 104           1HE      PHE 104   1.496 -14.021  -8.438
  824    HE2  PHE 104           2HE      PHE 104   2.041 -17.911  -6.779
  825    HZ   PHE 104           HZ       PHE 104   0.901 -16.410  -8.364
  826    H    SER 105           H        SER 105   2.850 -13.616  -2.195
  827    HA   SER 105           HA       SER 105   3.215 -13.793   0.041
  828   1HB   SER 105          2HB       SER 105   6.051 -14.584  -0.637
  829   2HB   SER 105          1HB       SER 105   5.112 -15.037   0.786
  830    HG   SER 105           HG       SER 105   3.818 -16.321  -0.504
  831    H    VAL 106           H        VAL 106   3.184 -11.917   1.093
  832    HA   VAL 106           HA       VAL 106   5.220  -9.909   0.616
  833    HB   VAL 106           HB       VAL 106   3.884  -8.460   2.062
  834   1HG1  VAL 106          1HG1      VAL 106   2.689  -9.890  -0.240
  835   2HG1  VAL 106          2HG1      VAL 106   3.085  -8.182  -0.045
  836   3HG1  VAL 106          3HG1      VAL 106   1.630  -8.842   0.704
  837   1HG2  VAL 106          1HG2      VAL 106   1.546  -9.532   2.649
  838   2HG2  VAL 106          2HG2      VAL 106   2.922  -9.666   3.743
  839   3HG2  VAL 106          3HG2      VAL 106   2.501 -11.014   2.687
  840    H    GLU 107           H        GLU 107   5.426 -12.574   2.350
  841    HA   GLU 107           HA       GLU 107   5.914 -12.061   4.972
  842   1HB   GLU 107          2HB       GLU 107   6.106 -14.288   4.114
  843   2HB   GLU 107          1HB       GLU 107   7.426 -13.829   3.047
  844   1HG   GLU 107          2HG       GLU 107   8.904 -13.540   4.874
  845   2HG   GLU 107          1HG       GLU 107   7.591 -13.718   6.036
  846    H    ARG 108           H        ARG 108   8.184 -11.575   2.276
  847    HA   ARG 108           HA       ARG 108  10.255 -10.493   3.910
  848   1HB   ARG 108          2HB       ARG 108  10.751 -11.505   1.739
  849   2HB   ARG 108          1HB       ARG 108   9.784 -10.281   0.929
  850   1HG   ARG 108          2HG       ARG 108  12.094  -9.730   0.672
  851   2HG   ARG 108          1HG       ARG 108  11.357  -8.557   1.765
  852   1HD   ARG 108          2HD       ARG 108  13.319  -9.056   2.868
  853   2HD   ARG 108          1HD       ARG 108  12.188 -10.177   3.625
  854    HE   ARG 108           HE       ARG 108  13.525 -11.312   1.365
  855   1HH1  ARG 108          1HH1      ARG 108  13.820 -10.627   4.773
  856   2HH1  ARG 108          2HH1      ARG 108  14.965 -11.894   5.057
  857   1HH2  ARG 108          1HH2      ARG 108  15.031 -12.979   1.735
  858   2HH2  ARG 108          2HH2      ARG 108  15.654 -13.229   3.332
  859    H    PHE 109           H        PHE 109   7.484  -9.213   2.246
  860    HA   PHE 109           HA       PHE 109   8.203  -6.481   2.260
  861   1HB   PHE 109          2HB       PHE 109   6.447  -6.836   0.826
  862   2HB   PHE 109          1HB       PHE 109   5.717  -8.057   1.850
  863    HD1  PHE 109           1HD      PHE 109   5.637  -4.645   0.801
  864    HD2  PHE 109           2HD      PHE 109   4.472  -7.289   3.926
  865    HE1  PHE 109           1HE      PHE 109   3.970  -3.005   1.565
  866    HE2  PHE 109           2HE      PHE 109   2.804  -5.653   4.694
  867    HZ   PHE 109           HZ       PHE 109   2.552  -3.506   3.514
  868    H    LEU 110           H        LEU 110   7.005  -8.628   4.702
  869    HA   LEU 110           HA       LEU 110   5.722  -7.010   6.493
  870   1HB   LEU 110          2HB       LEU 110   6.619  -9.537   6.554
  871   2HB   LEU 110          1HB       LEU 110   7.756  -8.793   7.660
  872    HG   LEU 110           HG       LEU 110   4.795  -8.433   8.007
  873   1HD1  LEU 110          1HD1      LEU 110   5.102 -10.294   9.756
  874   2HD1  LEU 110          2HD1      LEU 110   6.507 -10.759   8.796
  875   3HD1  LEU 110          3HD1      LEU 110   4.901 -10.752   8.064
  876   1HD2  LEU 110          1HD2      LEU 110   7.243  -7.793   9.498
  877   2HD2  LEU 110          2HD2      LEU 110   5.938  -8.483  10.464
  878   3HD2  LEU 110          3HD2      LEU 110   5.659  -7.018   9.522
  879    H    LEU 111           H        LEU 111   9.226  -7.489   6.240
  880    HA   LEU 111           HA       LEU 111  10.019  -5.788   8.293
  881   1HB   LEU 111          2HB       LEU 111  11.410  -6.396   5.685
  882   2HB   LEU 111          1HB       LEU 111  12.166  -5.601   7.053
  883    HG   LEU 111           HG       LEU 111  11.373  -7.793   8.319
  884   1HD1  LEU 111          1HD1      LEU 111  11.257  -8.479   5.432
  885   2HD1  LEU 111          2HD1      LEU 111  10.295  -9.084   6.781
  886   3HD1  LEU 111          3HD1      LEU 111  11.943  -9.664   6.543
  887   1HD2  LEU 111          1HD2      LEU 111  13.617  -7.393   8.450
  888   2HD2  LEU 111          2HD2      LEU 111  13.799  -7.202   6.706
  889   3HD2  LEU 111          3HD2      LEU 111  13.628  -8.812   7.404
  890    H    THR 112           H        THR 112   9.505  -5.062   4.847
  891    HA   THR 112           HA       THR 112  10.250  -2.418   4.782
  892    HB   THR 112           HB       THR 112   7.914  -3.723   3.372
  893    HG1  THR 112           1HG      THR 112  10.544  -3.206   2.457
  894   1HG2  THR 112          1HG2      THR 112   8.485  -1.941   1.616
  895   2HG2  THR 112          2HG2      THR 112   9.212  -1.064   2.963
  896   3HG2  THR 112          3HG2      THR 112   7.499  -1.478   3.003
  897    H    ILE 113           H        ILE 113   7.243  -3.812   5.982
  898    HA   ILE 113           HA       ILE 113   5.877  -1.366   6.408
  899    HB   ILE 113           HB       ILE 113   5.536  -4.159   7.462
  900   1HG1  ILE 113          2HG1      ILE 113   4.744  -3.689   5.208
  901   2HG1  ILE 113          1HG1      ILE 113   3.375  -3.972   6.279
  902   1HG2  ILE 113          1HG2      ILE 113   4.199  -1.682   8.472
  903   2HG2  ILE 113          2HG2      ILE 113   4.870  -3.038   9.378
  904   3HG2  ILE 113          3HG2      ILE 113   3.361  -3.233   8.488
  905   1HD1  ILE 113          1HD1      ILE 113   3.264  -1.429   6.500
  906   2HD1  ILE 113          2HD1      ILE 113   2.735  -2.154   4.981
  907   3HD1  ILE 113          3HD1      ILE 113   4.324  -1.396   5.090
  908    H    LYS 114           H        LYS 114   7.345  -3.579   8.796
  909    HA   LYS 114           HA       LYS 114   7.261  -1.874  10.964
  910   1HB   LYS 114          2HB       LYS 114   9.140  -3.239  11.885
  911   2HB   LYS 114          1HB       LYS 114   7.714  -4.131  11.378
  912   1HG   LYS 114          2HG       LYS 114   9.410  -5.379  10.531
  913   2HG   LYS 114          1HG       LYS 114   8.925  -4.389   9.161
  914   1HD   LYS 114          2HD       LYS 114  11.426  -4.632   9.542
  915   2HD   LYS 114          1HD       LYS 114  10.814  -2.991   9.365
  916   1HE   LYS 114          2HE       LYS 114  12.477  -3.263  11.190
  917   2HE   LYS 114          1HE       LYS 114  10.927  -2.618  11.723
  918   1HZ   LYS 114          1HZ       LYS 114  10.795  -4.271  13.172
  919   2HZ   LYS 114          2HZ       LYS 114  12.266  -4.907  12.634
  920   3HZ   LYS 114          3HZ       LYS 114  10.816  -5.406  11.919
  921    H    HIS 115           H        HIS 115   9.163  -1.619   8.194
  922    HA   HIS 115           HA       HIS 115  11.264  -0.054   9.460
  923   1HB   HIS 115          2HB       HIS 115  10.889  -1.357   6.850
  924   2HB   HIS 115          1HB       HIS 115  11.748   0.178   6.805
  925    HD1  HIS 115           1HD      HIS 115  12.352  -3.315   7.183
  926    HD2  HIS 115           2HD      HIS 115  13.996   0.134   8.815
  927    HE1  HIS 115           1HE      HIS 115  14.601  -4.000   8.074
  928    HE2  HIS 115           2HE      HIS 115  15.617  -1.875   8.968
  929    H    ALA 116           H        ALA 116   8.262   0.340   7.897
  930    HA   ALA 116           HA       ALA 116   8.730   3.109   7.139
  931   1HB   ALA 116          1HB       ALA 116   6.083   2.713   6.713
  932   2HB   ALA 116          2HB       ALA 116   6.696   1.066   6.566
  933   3HB   ALA 116          3HB       ALA 116   7.346   2.343   5.538
  934    H    PHE 117           H        PHE 117   6.601   1.283   9.332
  935    HA   PHE 117           HA       PHE 117   5.288   3.440  10.505
  936   1HB   PHE 117          2HB       PHE 117   5.930   0.660  11.433
  937   2HB   PHE 117          1HB       PHE 117   5.177   1.801  12.542
  938    HD1  PHE 117           1HD      PHE 117   2.883   2.378  12.347
  939    HD2  PHE 117           2HD      PHE 117   4.751  -0.022   9.373
  940    HE1  PHE 117           1HE      PHE 117   0.676   1.835  11.407
  941    HE2  PHE 117           2HE      PHE 117   2.550  -0.569   8.427
  942    HZ   PHE 117           HZ       PHE 117   0.507   0.364   9.444
  943    H    GLU 118           H        GLU 118   8.472   2.135  11.083
  944    HA   GLU 118           HA       GLU 118   9.052   3.196  13.575
  945   1HB   GLU 118          2HB       GLU 118  10.428   1.718  11.843
  946   2HB   GLU 118          1HB       GLU 118  11.184   3.272  11.522
  947   1HG   GLU 118          2HG       GLU 118  11.888   3.481  13.785
  948   2HG   GLU 118          1HG       GLU 118  10.940   2.076  14.266
  949    H    GLU 119           H        GLU 119   8.692   4.799  10.535
  950    HA   GLU 119           HA       GLU 119   9.924   7.248  11.559
  951   1HB   GLU 119          2HB       GLU 119   8.793   6.686   8.813
  952   2HB   GLU 119          1HB       GLU 119   9.733   8.094   9.286
  953   1HG   GLU 119          2HG       GLU 119  11.027   5.506   9.779
  954   2HG   GLU 119          1HG       GLU 119  10.752   5.903   8.083
  955    H    TYR 120           H        TYR 120   7.435   6.265  12.674
  956    HA   TYR 120           HA       TYR 120   5.763   8.602  12.079
  957   1HB   TYR 120          2HB       TYR 120   4.850   6.554  10.949
  958   2HB   TYR 120          1HB       TYR 120   4.649   5.829  12.541
  959    HD1  TYR 120           1HD      TYR 120   2.669   6.161  13.721
  960    HD2  TYR 120           2HD      TYR 120   3.652   8.812  10.543
  961    HE1  TYR 120           1HE      TYR 120   0.456   7.216  13.925
  962    HE2  TYR 120           2HE      TYR 120   1.443   9.876  10.738
  963    HH   TYR 120           HH       TYR 120  -0.364   9.954  13.050
  964    H    SER 121           H        SER 121   7.668   8.026  14.216
  965    HA   SER 121           HA       SER 121   5.945   8.673  16.444
  966   1HB   SER 121          2HB       SER 121   7.404   6.070  16.249
  967   2HB   SER 121          1HB       SER 121   7.281   6.857  17.823
  968    HG   SER 121           HG       SER 121   5.534   5.316  17.038
  Start of MODEL   28
    1   1H    MET   1          1HT       MET   1  -3.415   0.374  18.359
    2   2H    MET   1          2HT       MET   1  -2.863  -1.133  17.750
    3   3H    MET   1          3HT       MET   1  -4.091  -0.266  16.920
    4    HA   MET   1           HA       MET   1  -2.624   1.421  16.313
    5   1HB   MET   1          2HB       MET   1  -0.932   0.089  18.378
    6   2HB   MET   1          1HB       MET   1  -0.121   0.897  17.044
    7   1HG   MET   1          2HG       MET   1  -1.565   2.920  17.631
    8   2HG   MET   1          1HG       MET   1  -1.903   2.077  19.141
    9   1HE   MET   1          1HE       MET   1   0.565   2.135  21.300
   10   2HE   MET   1          2HE       MET   1   1.613   1.192  20.241
   11   3HE   MET   1          3HE       MET   1  -0.116   0.853  20.297
   12    H    LYS   2           H        LYS   2  -0.551   1.131  14.886
   13    HA   LYS   2           HA       LYS   2   0.388   0.148  13.064
   14   1HB   LYS   2          2HB       LYS   2  -0.214  -2.402  14.568
   15   2HB   LYS   2          1HB       LYS   2   0.852  -2.269  13.175
   16   1HG   LYS   2          2HG       LYS   2   1.408  -0.541  15.523
   17   2HG   LYS   2          1HG       LYS   2   1.777  -2.263  15.644
   18   1HD   LYS   2          2HD       LYS   2   2.904  -1.837  13.298
   19   2HD   LYS   2          1HD       LYS   2   2.976  -0.175  13.889
   20   1HE   LYS   2          2HE       LYS   2   4.445  -0.690  15.569
   21   2HE   LYS   2          1HE       LYS   2   3.886  -2.357  15.695
   22   1HZ   LYS   2          1HZ       LYS   2   5.978  -2.524  14.735
   23   2HZ   LYS   2          2HZ       LYS   2   5.750  -1.185  13.728
   24   3HZ   LYS   2          3HZ       LYS   2   4.941  -2.635  13.404
   25    H    ARG   3           H        ARG   3  -1.019   0.672  11.457
   26    HA   ARG   3           HA       ARG   3  -2.817  -1.453  10.574
   27   1HB   ARG   3          2HB       ARG   3  -3.767   1.406  10.613
   28   2HB   ARG   3          1HB       ARG   3  -4.707  -0.048  10.308
   29   1HG   ARG   3          2HG       ARG   3  -5.358   0.291  12.435
   30   2HG   ARG   3          1HG       ARG   3  -3.872  -0.591  12.789
   31   1HD   ARG   3          2HD       ARG   3  -3.084   1.164  13.898
   32   2HD   ARG   3          1HD       ARG   3  -3.210   2.151  12.442
   33    HE   ARG   3           HE       ARG   3  -5.739   2.138  13.407
   34   1HH1  ARG   3          1HH1      ARG   3  -2.640   2.896  14.822
   35   2HH1  ARG   3          2HH1      ARG   3  -3.290   4.054  15.933
   36   1HH2  ARG   3          1HH2      ARG   3  -6.595   3.661  14.868
   37   2HH2  ARG   3          2HH2      ARG   3  -5.536   4.488  15.961
   38    H    VAL   4           H        VAL   4  -2.605  -1.814   8.456
   39    HA   VAL   4           HA       VAL   4  -1.433   0.324   6.792
   40    HB   VAL   4           HB       VAL   4  -1.021  -2.641   6.396
   41   1HG1  VAL   4          1HG1      VAL   4   1.001  -1.458   5.095
   42   2HG1  VAL   4          2HG1      VAL   4  -0.224  -0.201   4.934
   43   3HG1  VAL   4          3HG1      VAL   4  -0.549  -1.828   4.338
   44   1HG2  VAL   4          1HG2      VAL   4   0.897  -0.633   7.581
   45   2HG2  VAL   4          2HG2      VAL   4   1.215  -2.343   7.286
   46   3HG2  VAL   4          3HG2      VAL   4   0.021  -1.863   8.492
   47    H    LEU   5           H        LEU   5  -2.123   0.436   4.601
   48    HA   LEU   5           HA       LEU   5  -4.783  -0.729   4.189
   49   1HB   LEU   5          2HB       LEU   5  -4.508   1.752   4.050
   50   2HB   LEU   5          1HB       LEU   5  -3.464   1.516   2.662
   51    HG   LEU   5           HG       LEU   5  -5.367   0.436   1.468
   52   1HD1  LEU   5          1HD1      LEU   5  -7.537   0.409   2.325
   53   2HD1  LEU   5          2HD1      LEU   5  -7.136   1.524   3.630
   54   3HD1  LEU   5          3HD1      LEU   5  -6.539  -0.134   3.672
   55   1HD2  LEU   5          1HD2      LEU   5  -6.296   3.129   2.355
   56   2HD2  LEU   5          2HD2      LEU   5  -6.243   2.433   0.736
   57   3HD2  LEU   5          3HD2      LEU   5  -4.756   2.977   1.511
   58    H    VAL   6           H        VAL   6  -5.233  -2.076   2.523
   59    HA   VAL   6           HA       VAL   6  -2.982  -2.765   0.742
   60    HB   VAL   6           HB       VAL   6  -5.217  -4.649   1.456
   61   1HG1  VAL   6          1HG1      VAL   6  -4.055  -5.218  -0.553
   62   2HG1  VAL   6          2HG1      VAL   6  -3.556  -6.335   0.717
   63   3HG1  VAL   6          3HG1      VAL   6  -2.491  -5.013   0.237
   64   1HG2  VAL   6          1HG2      VAL   6  -3.820  -5.658   3.120
   65   2HG2  VAL   6          2HG2      VAL   6  -3.974  -3.944   3.498
   66   3HG2  VAL   6          3HG2      VAL   6  -2.497  -4.551   2.750
   67    H    VAL   7           H        VAL   7  -3.503  -1.499  -1.002
   68    HA   VAL   7           HA       VAL   7  -6.192  -1.625  -2.060
   69    HB   VAL   7           HB       VAL   7  -3.788  -0.076  -3.036
   70   1HG1  VAL   7          1HG1      VAL   7  -6.414  -0.557  -4.225
   71   2HG1  VAL   7          2HG1      VAL   7  -4.921   0.024  -4.961
   72   3HG1  VAL   7          3HG1      VAL   7  -5.977   1.148  -4.106
   73   1HG2  VAL   7          1HG2      VAL   7  -6.178   0.681  -1.377
   74   2HG2  VAL   7          2HG2      VAL   7  -5.176   1.872  -2.206
   75   3HG2  VAL   7          3HG2      VAL   7  -4.469   0.834  -0.968
   76    H    ASP   8           H        ASP   8  -6.787  -3.165  -3.368
   77    HA   ASP   8           HA       ASP   8  -5.016  -4.035  -5.508
   78   1HB   ASP   8          2HB       ASP   8  -4.435  -5.739  -4.028
   79   2HB   ASP   8          1HB       ASP   8  -6.030  -5.789  -3.291
   80    H    ASP   9           H        ASP   9  -6.182  -3.663  -7.265
   81    HA   ASP   9           HA       ASP   9  -8.875  -3.165  -7.423
   82   1HB   ASP   9          2HB       ASP   9  -7.390  -2.583  -9.229
   83   2HB   ASP   9          1HB       ASP   9  -7.027  -4.275  -9.543
   84    H    GLU  10           H        GLU  10  -7.639  -6.084  -9.018
   85    HA   GLU  10           HA       GLU  10 -10.155  -7.417  -8.420
   86   1HB   GLU  10          2HB       GLU  10  -8.818  -7.400 -10.685
   87   2HB   GLU  10          1HB       GLU  10  -7.935  -8.725  -9.938
   88   1HG   GLU  10          2HG       GLU  10 -10.758  -9.122  -9.623
   89   2HG   GLU  10          1HG       GLU  10 -10.367  -8.835 -11.318
   90    H    GLU  11           H        GLU  11  -9.907  -9.883  -7.989
   91    HA   GLU  11           HA       GLU  11  -9.306 -11.567  -6.582
   92   1HB   GLU  11          2HB       GLU  11  -6.849 -10.319  -7.263
   93   2HB   GLU  11          1HB       GLU  11  -6.798 -10.661  -5.539
   94   1HG   GLU  11          2HG       GLU  11  -7.852 -12.939  -6.865
   95   2HG   GLU  11          1HG       GLU  11  -6.391 -12.429  -7.709
   96    H    SER  12           H        SER  12 -10.500 -11.621  -4.799
   97    HA   SER  12           HA       SER  12 -10.973  -9.536  -3.039
   98   1HB   SER  12          2HB       SER  12 -12.454 -11.417  -3.039
   99   2HB   SER  12          1HB       SER  12 -11.147 -12.526  -2.623
  100    HG   SER  12           HG       SER  12 -11.229 -11.890  -0.584
  101    H    ILE  13           H        ILE  13  -9.187  -8.478  -2.275
  102    HA   ILE  13           HA       ILE  13  -7.501  -7.966  -0.866
  103    HB   ILE  13           HB       ILE  13  -8.040 -10.663   0.287
  104   1HG1  ILE  13          2HG1      ILE  13 -10.006  -9.143   0.294
  105   2HG1  ILE  13          1HG1      ILE  13  -9.466  -9.598   1.907
  106   1HG2  ILE  13          1HG2      ILE  13  -5.924 -10.039   1.084
  107   2HG2  ILE  13          2HG2      ILE  13  -7.040  -9.607   2.380
  108   3HG2  ILE  13          3HG2      ILE  13  -6.418  -8.360   1.298
  109   1HD1  ILE  13          1HD1      ILE  13  -8.202  -7.166   0.965
  110   2HD1  ILE  13          2HD1      ILE  13  -9.069  -7.489   2.467
  111   3HD1  ILE  13          3HD1      ILE  13  -9.960  -7.049   1.009
  112    H    THR  14           H        THR  14  -5.291  -8.664  -0.280
  113    HA   THR  14           HA       THR  14  -4.110 -10.118  -2.505
  114    HB   THR  14           HB       THR  14  -2.101  -9.030  -2.008
  115    HG1  THR  14           1HG      THR  14  -1.527  -9.188   0.001
  116   1HG2  THR  14          1HG2      THR  14  -3.643  -7.326  -2.708
  117   2HG2  THR  14          2HG2      THR  14  -2.601  -6.673  -1.445
  118   3HG2  THR  14          3HG2      THR  14  -4.256  -7.149  -1.065
  119    H    SER  15           H        SER  15  -4.248 -12.257  -2.179
  120    HA   SER  15           HA       SER  15  -4.436 -13.720   0.082
  121   1HB   SER  15          2HB       SER  15  -2.612 -14.807  -2.015
  122   2HB   SER  15          1HB       SER  15  -3.964 -15.581  -1.188
  123    HG   SER  15           HG       SER  15  -3.927 -14.187  -3.522
  124    H    SER  16           H        SER  16  -3.165 -14.608   1.622
  125    HA   SER  16           HA       SER  16  -1.289 -15.177   2.810
  126   1HB   SER  16          2HB       SER  16   0.459 -13.543   0.987
  127   2HB   SER  16          1HB       SER  16   0.889 -14.942   1.973
  128    HG   SER  16           HG       SER  16   0.060 -16.261   0.501
  129    H    LEU  17           H        LEU  17  -2.204 -11.957   2.013
  130    HA   LEU  17           HA       LEU  17  -0.455 -10.629   3.818
  131   1HB   LEU  17          2HB       LEU  17  -2.336  -9.844   1.914
  132   2HB   LEU  17          1HB       LEU  17  -3.006  -9.275   3.424
  133    HG   LEU  17           HG       LEU  17  -0.984  -8.085   1.810
  134   1HD1  LEU  17          1HD1      LEU  17  -1.787  -6.264   2.757
  135   2HD1  LEU  17          2HD1      LEU  17  -1.440  -6.842   4.384
  136   3HD1  LEU  17          3HD1      LEU  17  -2.934  -7.320   3.578
  137   1HD2  LEU  17          1HD2      LEU  17   0.728  -7.604   3.506
  138   2HD2  LEU  17          2HD2      LEU  17   0.693  -9.303   3.044
  139   3HD2  LEU  17          3HD2      LEU  17  -0.016  -8.794   4.574
  140    H    SER  18           H        SER  18  -3.908 -11.469   4.062
  141    HA   SER  18           HA       SER  18  -4.504 -10.582   6.562
  142   1HB   SER  18          2HB       SER  18  -5.813 -12.108   4.754
  143   2HB   SER  18          1HB       SER  18  -5.490 -13.316   5.998
  144    HG   SER  18           HG       SER  18  -6.786 -10.818   6.375
  145    H    ALA  19           H        ALA  19  -3.573 -13.984   6.019
  146    HA   ALA  19           HA       ALA  19  -3.192 -14.740   8.625
  147   1HB   ALA  19          1HB       ALA  19  -1.945 -15.634   6.064
  148   2HB   ALA  19          2HB       ALA  19  -3.084 -16.478   7.112
  149   3HB   ALA  19          3HB       ALA  19  -1.395 -16.316   7.594
  150    H    ILE  20           H        ILE  20  -0.894 -13.105   6.508
  151    HA   ILE  20           HA       ILE  20   1.333 -13.239   8.231
  152    HB   ILE  20           HB       ILE  20   0.626 -11.431   5.935
  153   1HG1  ILE  20          2HG1      ILE  20   2.867 -13.423   6.221
  154   2HG1  ILE  20          1HG1      ILE  20   1.268 -13.859   5.628
  155   1HG2  ILE  20          1HG2      ILE  20   2.750 -11.069   7.928
  156   2HG2  ILE  20          2HG2      ILE  20   2.021  -9.908   6.820
  157   3HG2  ILE  20          3HG2      ILE  20   3.281 -11.001   6.248
  158   1HD1  ILE  20          1HD1      ILE  20   3.411 -12.285   4.333
  159   2HD1  ILE  20          2HD1      ILE  20   1.739 -11.856   3.975
  160   3HD1  ILE  20          3HD1      ILE  20   2.318 -13.491   3.655
  161    H    LEU  21           H        LEU  21  -0.605 -10.328   7.477
  162    HA   LEU  21           HA       LEU  21   0.347  -8.673   9.441
  163   1HB   LEU  21          2HB       LEU  21  -2.540  -8.844   8.605
  164   2HB   LEU  21          1HB       LEU  21  -1.718  -7.445   9.272
  165    HG   LEU  21           HG       LEU  21  -0.403  -8.447   6.880
  166   1HD1  LEU  21          1HD1      LEU  21  -3.162  -8.650   6.769
  167   2HD1  LEU  21          2HD1      LEU  21  -2.050  -8.574   5.403
  168   3HD1  LEU  21          3HD1      LEU  21  -2.806  -7.101   6.005
  169   1HD2  LEU  21          1HD2      LEU  21  -1.271  -5.891   8.084
  170   2HD2  LEU  21          2HD2      LEU  21  -1.068  -5.925   6.333
  171   3HD2  LEU  21          3HD2      LEU  21   0.281  -6.352   7.386
  172    H    GLU  22           H        GLU  22  -1.855 -11.352   9.778
  173    HA   GLU  22           HA       GLU  22  -2.807 -10.699  12.379
  174   1HB   GLU  22          2HB       GLU  22  -2.731 -13.324  10.891
  175   2HB   GLU  22          1HB       GLU  22  -3.557 -13.076  12.424
  176   1HG   GLU  22          2HG       GLU  22  -5.229 -11.836  11.486
  177   2HG   GLU  22          1HG       GLU  22  -4.220 -11.282  10.151
  178    H    GLU  23           H        GLU  23   0.066 -12.221  11.165
  179    HA   GLU  23           HA       GLU  23   0.758 -13.466  13.669
  180   1HB   GLU  23          2HB       GLU  23   1.522 -14.591  11.731
  181   2HB   GLU  23          1HB       GLU  23   2.152 -13.111  11.024
  182   1HG   GLU  23          2HG       GLU  23   4.046 -14.228  11.701
  183   2HG   GLU  23          1HG       GLU  23   3.765 -13.091  13.016
  184    H    GLU  24           H        GLU  24   1.689 -10.604  11.820
  185    HA   GLU  24           HA       GLU  24   3.678  -9.777  13.695
  186   1HB   GLU  24          2HB       GLU  24   2.608  -8.812  11.158
  187   2HB   GLU  24          1HB       GLU  24   3.060  -7.525  12.267
  188   1HG   GLU  24          2HG       GLU  24   4.899  -8.071  10.797
  189   2HG   GLU  24          1HG       GLU  24   5.297  -8.477  12.465
  190    H    GLY  25           H        GLY  25   0.278  -9.146  13.214
  191   1HA   GLY  25          2HA       GLY  25  -1.139  -8.482  15.001
  192   2HA   GLY  25          1HA       GLY  25   0.243  -7.721  15.769
  193    H    TYR  26           H        TYR  26  -0.526  -7.302  12.386
  194    HA   TYR  26           HA       TYR  26  -0.770  -4.440  12.809
  195   1HB   TYR  26          2HB       TYR  26  -0.514  -6.182  10.371
  196   2HB   TYR  26          1HB       TYR  26  -0.944  -4.483  10.233
  197    HD1  TYR  26           1HD      TYR  26   0.654  -2.764  11.225
  198    HD2  TYR  26           2HD      TYR  26   1.730  -6.831  10.589
  199    HE1  TYR  26           1HE      TYR  26   3.030  -2.143  11.319
  200    HE2  TYR  26           2HE      TYR  26   4.110  -6.221  10.683
  201    HH   TYR  26           HH       TYR  26   5.530  -4.468  11.555
  202    H    HIS  27           H        HIS  27  -2.424  -3.528  10.958
  203    HA   HIS  27           HA       HIS  27  -4.996  -4.892  11.269
  204   1HB   HIS  27          2HB       HIS  27  -4.400  -2.848  12.934
  205   2HB   HIS  27          1HB       HIS  27  -5.062  -1.944  11.576
  206    HD1  HIS  27           1HD      HIS  27  -7.289  -4.019  10.804
  207    HD2  HIS  27           2HD      HIS  27  -6.539  -2.595  14.635
  208    HE1  HIS  27           1HE      HIS  27  -9.443  -4.321  12.067
  209    HE2  HIS  27           2HE      HIS  27  -8.993  -3.361  14.353
  210    HA   PRO  28           HA       PRO  28  -4.505  -3.475   6.957
  211   1HB   PRO  28          2HB       PRO  28  -5.688  -5.604   5.808
  212   2HB   PRO  28          1HB       PRO  28  -4.005  -5.632   6.346
  213   1HG   PRO  28          2HG       PRO  28  -6.435  -6.758   7.663
  214   2HG   PRO  28          1HG       PRO  28  -4.804  -7.439   7.550
  215   1HD   PRO  28          2HD       PRO  28  -5.795  -6.141   9.765
  216   2HD   PRO  28          1HD       PRO  28  -4.070  -6.279   9.379
  217    H    ASP  29           H        ASP  29  -5.968  -2.455   5.642
  218    HA   ASP  29           HA       ASP  29  -8.769  -2.648   6.460
  219   1HB   ASP  29          2HB       ASP  29  -7.525  -0.481   7.040
  220   2HB   ASP  29          1HB       ASP  29  -7.642  -0.129   5.318
  221    H    THR  30           H        THR  30  -6.756  -3.256   4.013
  222    HA   THR  30           HA       THR  30  -6.908  -3.204   1.711
  223    HB   THR  30           HB       THR  30  -8.081  -5.128   1.052
  224    HG1  THR  30           1HG      THR  30  -9.658  -4.928   3.399
  225   1HG2  THR  30          1HG2      THR  30  -6.881  -6.492   2.304
  226   2HG2  THR  30          2HG2      THR  30  -7.954  -6.231   3.679
  227   3HG2  THR  30          3HG2      THR  30  -6.576  -5.161   3.422
  228    H    ALA  31           H        ALA  31  -7.565  -1.997   0.134
  229    HA   ALA  31           HA       ALA  31 -10.400  -1.243  -0.059
  230   1HB   ALA  31          1HB       ALA  31  -8.917   0.604   0.878
  231   2HB   ALA  31          2HB       ALA  31  -9.894   1.012  -0.532
  232   3HB   ALA  31          3HB       ALA  31  -8.174   0.669  -0.721
  233    H    LYS  32           H        LYS  32 -11.195  -1.064  -2.188
  234    HA   LYS  32           HA       LYS  32  -9.985  -2.689  -4.128
  235   1HB   LYS  32          2HB       LYS  32 -12.406  -1.243  -3.864
  236   2HB   LYS  32          1HB       LYS  32 -11.681  -0.731  -5.383
  237   1HG   LYS  32          2HG       LYS  32 -11.389  -3.273  -5.798
  238   2HG   LYS  32          1HG       LYS  32 -12.629  -3.431  -4.552
  239   1HD   LYS  32          2HD       LYS  32 -14.064  -3.224  -6.270
  240   2HD   LYS  32          1HD       LYS  32 -13.707  -1.502  -6.132
  241   1HE   LYS  32          2HE       LYS  32 -11.856  -1.841  -7.780
  242   2HE   LYS  32          1HE       LYS  32 -12.435  -3.492  -8.005
  243   1HZ   LYS  32          1HZ       LYS  32 -14.556  -2.611  -8.747
  244   2HZ   LYS  32          2HZ       LYS  32 -13.299  -2.002  -9.701
  245   3HZ   LYS  32          3HZ       LYS  32 -14.012  -1.027  -8.516
  246    H    THR  33           H        THR  33  -9.860  -1.463  -6.536
  247    HA   THR  33           HA       THR  33  -7.352  -0.422  -6.669
  248    HB   THR  33           HB       THR  33  -9.299   0.696  -8.609
  249    HG1  THR  33           1HG      THR  33 -10.278  -1.140  -8.797
  250   1HG2  THR  33          1HG2      THR  33  -6.571  -0.393  -8.639
  251   2HG2  THR  33          2HG2      THR  33  -7.291   0.912  -9.582
  252   3HG2  THR  33          3HG2      THR  33  -7.569  -0.767 -10.045
  253    H    LEU  34           H        LEU  34  -6.691   1.747  -7.440
  254    HA   LEU  34           HA       LEU  34  -6.643   3.658  -5.628
  255   1HB   LEU  34          2HB       LEU  34  -7.084   4.531  -8.465
  256   2HB   LEU  34          1HB       LEU  34  -6.030   5.237  -7.255
  257    HG   LEU  34           HG       LEU  34  -5.578   2.565  -8.591
  258   1HD1  LEU  34          1HD1      LEU  34  -3.749   3.687  -9.760
  259   2HD1  LEU  34          2HD1      LEU  34  -4.243   5.225  -9.053
  260   3HD1  LEU  34          3HD1      LEU  34  -5.315   4.384 -10.171
  261   1HD2  LEU  34          1HD2      LEU  34  -4.669   3.318  -6.158
  262   2HD2  LEU  34          2HD2      LEU  34  -3.394   3.958  -7.196
  263   3HD2  LEU  34          3HD2      LEU  34  -3.798   2.242  -7.250
  264    H    ARG  35           H        ARG  35  -9.375   3.287  -7.842
  265    HA   ARG  35           HA       ARG  35 -10.742   5.632  -7.188
  266   1HB   ARG  35          2HB       ARG  35 -11.299   3.210  -8.608
  267   2HB   ARG  35          1HB       ARG  35 -12.662   3.565  -7.555
  268   1HG   ARG  35          2HG       ARG  35 -13.113   5.583  -8.611
  269   2HG   ARG  35          1HG       ARG  35 -11.500   5.685  -9.319
  270   1HD   ARG  35          2HD       ARG  35 -12.455   4.905 -11.184
  271   2HD   ARG  35          1HD       ARG  35 -12.463   3.343 -10.368
  272    HE   ARG  35           HE       ARG  35 -14.731   3.466 -10.358
  273   1HH1  ARG  35          1HH1      ARG  35 -13.482   6.723 -10.462
  274   2HH1  ARG  35          2HH1      ARG  35 -15.050   7.454 -10.553
  275   1HH2  ARG  35          1HH2      ARG  35 -16.793   4.426 -10.478
  276   2HH2  ARG  35          2HH2      ARG  35 -16.929   6.151 -10.560
  277    H    GLU  36           H        GLU  36 -11.400   2.368  -5.913
  278    HA   GLU  36           HA       GLU  36 -13.027   3.272  -3.794
  279   1HB   GLU  36          2HB       GLU  36 -12.686   0.876  -4.876
  280   2HB   GLU  36          1HB       GLU  36 -11.534   0.699  -3.558
  281   1HG   GLU  36          2HG       GLU  36 -13.245   0.061  -2.306
  282   2HG   GLU  36          1HG       GLU  36 -13.777   1.742  -2.331
  283    H    ALA  37           H        ALA  37  -9.570   2.922  -4.136
  284    HA   ALA  37           HA       ALA  37  -8.980   2.928  -1.340
  285   1HB   ALA  37          1HB       ALA  37  -7.115   3.849  -3.514
  286   2HB   ALA  37          2HB       ALA  37  -7.460   2.143  -3.226
  287   3HB   ALA  37          3HB       ALA  37  -6.714   3.117  -1.960
  288    H    GLU  38           H        GLU  38  -8.634   5.454  -3.848
  289    HA   GLU  38           HA       GLU  38  -7.908   7.568  -2.276
  290   1HB   GLU  38          2HB       GLU  38  -9.761   7.530  -4.654
  291   2HB   GLU  38          1HB       GLU  38  -9.182   9.015  -3.913
  292   1HG   GLU  38          2HG       GLU  38  -6.984   8.631  -4.571
  293   2HG   GLU  38          1HG       GLU  38  -7.276   6.920  -4.867
  294    H    LYS  39           H        LYS  39 -11.171   6.286  -2.767
  295    HA   LYS  39           HA       LYS  39 -12.538   8.265  -1.304
  296   1HB   LYS  39          2HB       LYS  39 -13.687   6.633  -2.738
  297   2HB   LYS  39          1HB       LYS  39 -13.218   5.337  -1.647
  298   1HG   LYS  39          2HG       LYS  39 -14.718   7.592  -0.467
  299   2HG   LYS  39          1HG       LYS  39 -15.601   6.524  -1.558
  300   1HD   LYS  39          2HD       LYS  39 -14.835   4.590  -0.212
  301   2HD   LYS  39          1HD       LYS  39 -14.072   5.715   0.914
  302   1HE   LYS  39          2HE       LYS  39 -16.930   6.168   0.282
  303   2HE   LYS  39          1HE       LYS  39 -16.543   4.758   1.265
  304   1HZ   LYS  39          1HZ       LYS  39 -16.929   6.543   2.738
  305   2HZ   LYS  39          2HZ       LYS  39 -15.938   7.598   1.860
  306   3HZ   LYS  39          3HZ       LYS  39 -15.253   6.313   2.722
  307    H    LYS  40           H        LYS  40 -11.352   5.058  -0.320
  308    HA   LYS  40           HA       LYS  40 -11.994   5.258   2.393
  309   1HB   LYS  40          2HB       LYS  40  -9.837   3.692   0.985
  310   2HB   LYS  40          1HB       LYS  40 -10.208   3.507   2.694
  311   1HG   LYS  40          2HG       LYS  40 -12.668   3.214   1.573
  312   2HG   LYS  40          1HG       LYS  40 -11.625   2.507   0.338
  313   1HD   LYS  40          2HD       LYS  40 -10.725   0.938   1.877
  314   2HD   LYS  40          1HD       LYS  40 -11.450   1.771   3.253
  315   1HE   LYS  40          2HE       LYS  40 -13.003   0.430   1.043
  316   2HE   LYS  40          1HE       LYS  40 -12.644  -0.306   2.604
  317   1HZ   LYS  40          1HZ       LYS  40 -14.293   2.108   2.103
  318   2HZ   LYS  40          2HZ       LYS  40 -13.823   1.596   3.644
  319   3HZ   LYS  40          3HZ       LYS  40 -14.820   0.613   2.697
  320    H    ILE  41           H        ILE  41  -9.180   6.388   0.603
  321    HA   ILE  41           HA       ILE  41  -7.860   7.228   3.068
  322    HB   ILE  41           HB       ILE  41  -6.927   7.594   0.227
  323   1HG1  ILE  41          2HG1      ILE  41  -6.117   5.446   2.193
  324   2HG1  ILE  41          1HG1      ILE  41  -7.294   5.201   0.908
  325   1HG2  ILE  41          1HG2      ILE  41  -5.775   8.177   2.890
  326   2HG2  ILE  41          2HG2      ILE  41  -5.572   9.022   1.355
  327   3HG2  ILE  41          3HG2      ILE  41  -4.685   7.530   1.664
  328   1HD1  ILE  41          1HD1      ILE  41  -5.048   6.288  -0.336
  329   2HD1  ILE  41          2HD1      ILE  41  -5.622   4.622  -0.410
  330   3HD1  ILE  41          3HD1      ILE  41  -4.434   5.094   0.807
  331    H    LYS  42           H        LYS  42 -10.158   8.504   1.032
  332    HA   LYS  42           HA       LYS  42  -9.380  11.133   0.605
  333   1HB   LYS  42          2HB       LYS  42 -11.586   9.698   0.036
  334   2HB   LYS  42          1HB       LYS  42 -12.205  10.722   1.324
  335   1HG   LYS  42          2HG       LYS  42 -10.649  12.122  -0.732
  336   2HG   LYS  42          1HG       LYS  42 -12.161  11.402  -1.291
  337   1HD   LYS  42          2HD       LYS  42 -13.456  12.722   0.097
  338   2HD   LYS  42          1HD       LYS  42 -12.129  13.016   1.224
  339   1HE   LYS  42          2HE       LYS  42 -12.029  14.050  -1.588
  340   2HE   LYS  42          1HE       LYS  42 -12.890  14.932  -0.329
  341   1HZ   LYS  42          1HZ       LYS  42 -10.414  15.452  -0.797
  342   2HZ   LYS  42          2HZ       LYS  42 -10.115  14.074   0.137
  343   3HZ   LYS  42          3HZ       LYS  42 -10.958  15.383   0.802
  344    H    GLU  43           H        GLU  43 -10.165   9.558   3.545
  345    HA   GLU  43           HA       GLU  43  -9.909  12.104   4.959
  346   1HB   GLU  43          2HB       GLU  43 -12.020  10.043   5.610
  347   2HB   GLU  43          1HB       GLU  43 -11.730  11.541   6.484
  348   1HG   GLU  43          2HG       GLU  43 -12.538  12.856   4.720
  349   2HG   GLU  43          1HG       GLU  43 -12.454  11.518   3.575
  350    H    LEU  44           H        LEU  44 -10.055   8.570   5.255
  351    HA   LEU  44           HA       LEU  44  -8.890   8.348   7.783
  352   1HB   LEU  44          2HB       LEU  44  -9.817   6.605   5.836
  353   2HB   LEU  44          1HB       LEU  44  -8.112   6.212   5.959
  354    HG   LEU  44           HG       LEU  44  -9.432   4.785   7.419
  355   1HD1  LEU  44          1HD1      LEU  44  -7.283   5.111   8.259
  356   2HD1  LEU  44          2HD1      LEU  44  -8.331   5.468   9.632
  357   3HD1  LEU  44          3HD1      LEU  44  -7.610   6.784   8.707
  358   1HD2  LEU  44          1HD2      LEU  44 -11.339   5.795   8.106
  359   2HD2  LEU  44          2HD2      LEU  44 -10.577   7.379   8.256
  360   3HD2  LEU  44          3HD2      LEU  44 -10.344   6.166   9.515
  361    H    PHE  45           H        PHE  45  -6.934   8.863   8.483
  362    HA   PHE  45           HA       PHE  45  -4.816   9.440   6.584
  363   1HB   PHE  45          2HB       PHE  45  -5.365  10.908   8.578
  364   2HB   PHE  45          1HB       PHE  45  -4.683   9.643   9.594
  365    HD1  PHE  45           1HD      PHE  45  -3.956  12.270   7.165
  366    HD2  PHE  45           2HD      PHE  45  -2.305   9.209   9.617
  367    HE1  PHE  45           1HE      PHE  45  -1.712  13.221   6.834
  368    HE2  PHE  45           2HE      PHE  45  -0.057  10.156   9.292
  369    HZ   PHE  45           HZ       PHE  45   0.243  12.164   7.897
  370    H    PHE  46           H        PHE  46  -4.654   7.155   5.931
  371    HA   PHE  46           HA       PHE  46  -3.775   5.147   7.711
  372   1HB   PHE  46          2HB       PHE  46  -3.805   5.465   4.735
  373   2HB   PHE  46          1HB       PHE  46  -2.891   4.140   5.448
  374    HD1  PHE  46           1HD      PHE  46  -6.129   5.345   4.498
  375    HD2  PHE  46           2HD      PHE  46  -4.100   2.493   6.918
  376    HE1  PHE  46           1HE      PHE  46  -8.194   4.017   4.657
  377    HE2  PHE  46           2HE      PHE  46  -6.161   1.160   7.081
  378    HZ   PHE  46           HZ       PHE  46  -8.212   1.923   5.951
  379    HA   PRO  47           HA       PRO  47   0.466   6.462   8.145
  380   1HB   PRO  47          2HB       PRO  47   1.406   4.322   9.485
  381   2HB   PRO  47          1HB       PRO  47   0.329   5.499  10.246
  382   1HG   PRO  47          2HG       PRO  47  -0.311   2.817   9.086
  383   2HG   PRO  47          1HG       PRO  47  -0.879   3.543  10.601
  384   1HD   PRO  47          2HD       PRO  47  -2.364   3.502   8.315
  385   2HD   PRO  47          1HD       PRO  47  -2.506   4.775   9.544
  386    H    VAL  48           H        VAL  48  -0.448   3.342   6.829
  387    HA   VAL  48           HA       VAL  48   1.826   3.478   4.992
  388    HB   VAL  48           HB       VAL  48   1.086   0.834   6.193
  389   1HG1  VAL  48          1HG1      VAL  48   2.934   1.761   4.243
  390   2HG1  VAL  48          2HG1      VAL  48   2.665   0.113   4.810
  391   3HG1  VAL  48          3HG1      VAL  48   3.848   1.141   5.618
  392   1HG2  VAL  48          1HG2      VAL  48   1.592   2.043   8.143
  393   2HG2  VAL  48          2HG2      VAL  48   2.908   2.916   7.358
  394   3HG2  VAL  48          3HG2      VAL  48   3.083   1.199   7.723
  395    H    ILE  49           H        ILE  49   1.327   2.973   2.968
  396    HA   ILE  49           HA       ILE  49  -1.302   1.754   2.436
  397    HB   ILE  49           HB       ILE  49   0.195   3.549   0.533
  398   1HG1  ILE  49          2HG1      ILE  49  -0.295   4.834   2.555
  399   2HG1  ILE  49          1HG1      ILE  49  -1.329   5.358   1.229
  400   1HG2  ILE  49          1HG2      ILE  49  -2.387   2.134   0.538
  401   2HG2  ILE  49          2HG2      ILE  49  -1.341   2.591  -0.807
  402   3HG2  ILE  49          3HG2      ILE  49  -2.417   3.785  -0.082
  403   1HD1  ILE  49          1HD1      ILE  49  -2.040   3.805   3.675
  404   2HD1  ILE  49          2HD1      ILE  49  -3.046   3.718   2.230
  405   3HD1  ILE  49          3HD1      ILE  49  -2.776   5.269   3.023
  406    H    VAL  50           H        VAL  50  -1.447   0.165   0.854
  407    HA   VAL  50           HA       VAL  50   1.102  -0.770  -0.283
  408    HB   VAL  50           HB       VAL  50  -1.031  -2.577   0.855
  409   1HG1  VAL  50          1HG1      VAL  50   1.566  -3.070  -0.555
  410   2HG1  VAL  50          2HG1      VAL  50  -0.016  -3.786  -0.857
  411   3HG1  VAL  50          3HG1      VAL  50   0.905  -4.255   0.571
  412   1HG2  VAL  50          1HG2      VAL  50   0.253  -2.880   2.744
  413   2HG2  VAL  50          2HG2      VAL  50   0.485  -1.161   2.426
  414   3HG2  VAL  50          3HG2      VAL  50   1.729  -2.319   1.956
  415    H    LEU  51           H        LEU  51   0.882  -0.366  -2.368
  416    HA   LEU  51           HA       LEU  51  -1.668  -0.967  -3.694
  417   1HB   LEU  51          2HB       LEU  51  -0.693   1.277  -4.034
  418   2HB   LEU  51          1HB       LEU  51   0.738   0.540  -4.727
  419    HG   LEU  51           HG       LEU  51  -0.706  -0.416  -6.532
  420   1HD1  LEU  51          1HD1      LEU  51  -2.932   0.330  -6.838
  421   2HD1  LEU  51          2HD1      LEU  51  -2.799   1.490  -5.517
  422   3HD1  LEU  51          3HD1      LEU  51  -2.816  -0.240  -5.174
  423   1HD2  LEU  51          1HD2      LEU  51  -0.012   2.388  -6.101
  424   2HD2  LEU  51          2HD2      LEU  51  -1.292   2.151  -7.290
  425   3HD2  LEU  51          3HD2      LEU  51   0.267   1.351  -7.500
  426    H    ASP  52           H        ASP  52  -1.752  -2.309  -5.513
  427    HA   ASP  52           HA       ASP  52   0.592  -4.062  -5.857
  428   1HB   ASP  52          2HB       ASP  52  -1.681  -4.913  -4.779
  429   2HB   ASP  52          1HB       ASP  52  -2.149  -5.065  -6.470
  430    H    VAL  53           H        VAL  53  -2.012  -2.331  -7.443
  431    HA   VAL  53           HA       VAL  53  -2.355  -1.746  -9.618
  432    HB   VAL  53           HB       VAL  53   0.578  -2.447  -9.867
  433   1HG1  VAL  53          1HG1      VAL  53   0.072  -2.425 -12.073
  434   2HG1  VAL  53          2HG1      VAL  53   0.202  -0.683 -11.835
  435   3HG1  VAL  53          3HG1      VAL  53  -1.384  -1.456 -11.845
  436   1HG2  VAL  53          1HG2      VAL  53   0.130  -0.642  -8.290
  437   2HG2  VAL  53          2HG2      VAL  53  -0.802   0.212  -9.520
  438   3HG2  VAL  53          3HG2      VAL  53   0.931  -0.031  -9.738
  439    H    TRP  54           H        TRP  54  -3.597  -3.933  -9.348
  440    HA   TRP  54           HA       TRP  54  -2.649  -6.279 -10.545
  441   1HB   TRP  54          2HB       TRP  54  -4.650  -6.295  -9.172
  442   2HB   TRP  54          1HB       TRP  54  -5.482  -5.239 -10.307
  443    HD1  TRP  54           HD       TRP  54  -7.247  -6.602 -11.552
  444    HE1  TRP  54           1HE      TRP  54  -7.370  -8.948 -12.606
  445    HE3  TRP  54           3HE      TRP  54  -2.611  -8.311 -10.261
  446    HZ2  TRP  54           2HZ      TRP  54  -5.714 -11.223 -12.858
  447    HZ3  TRP  54           3HZ      TRP  54  -1.954 -10.582 -10.946
  448    HH2  TRP  54           HH       TRP  54  -3.476 -12.007 -12.218
  449    H    MET  55           H        MET  55  -5.292  -4.469 -12.054
  450    HA   MET  55           HA       MET  55  -3.798  -4.138 -14.510
  451   1HB   MET  55          2HB       MET  55  -5.102  -6.495 -14.263
  452   2HB   MET  55          1HB       MET  55  -6.386  -5.503 -14.940
  453   1HG   MET  55          2HG       MET  55  -4.905  -4.896 -16.805
  454   2HG   MET  55          1HG       MET  55  -3.663  -5.953 -16.138
  455   1HE   MET  55          1HE       MET  55  -6.358  -7.056 -19.304
  456   2HE   MET  55          2HE       MET  55  -4.652  -6.608 -19.276
  457   3HE   MET  55          3HE       MET  55  -5.873  -5.473 -18.698
  458    HA   PRO  56           HA       PRO  56  -7.352  -1.128 -13.631
  459   1HB   PRO  56          2HB       PRO  56  -5.435   0.832 -12.663
  460   2HB   PRO  56          1HB       PRO  56  -6.834   0.149 -11.832
  461   1HG   PRO  56          2HG       PRO  56  -4.278  -0.370 -11.096
  462   2HG   PRO  56          1HG       PRO  56  -5.604  -1.522 -10.867
  463   1HD   PRO  56          2HD       PRO  56  -3.526  -1.437 -13.031
  464   2HD   PRO  56          1HD       PRO  56  -4.126  -2.826 -12.102
  465    H    ASP  57           H        ASP  57  -6.510   1.627 -13.982
  466    HA   ASP  57           HA       ASP  57  -5.320   1.582 -16.664
  467   1HB   ASP  57          2HB       ASP  57  -7.036   3.269 -17.385
  468   2HB   ASP  57          1HB       ASP  57  -7.679   1.656 -17.089
  469    H    GLY  58           H        GLY  58  -4.503   2.450 -13.865
  470   1HA   GLY  58          2HA       GLY  58  -3.710   5.190 -14.626
  471   2HA   GLY  58          1HA       GLY  58  -4.234   4.812 -12.995
  472    H    ASP  59           H        ASP  59  -2.619   2.131 -13.898
  473    HA   ASP  59           HA       ASP  59  -0.626   1.245 -13.267
  474   1HB   ASP  59          2HB       ASP  59   0.207   3.863 -14.496
  475   2HB   ASP  59          1HB       ASP  59   1.397   2.720 -13.879
  476    H    GLY  60           H        GLY  60  -2.127   2.898 -11.325
  477   1HA   GLY  60          2HA       GLY  60  -1.898   3.760  -9.210
  478   2HA   GLY  60          1HA       GLY  60  -0.562   2.632  -9.090
  479    H    VAL  61           H        VAL  61  -0.248   5.110 -11.479
  480    HA   VAL  61           HA       VAL  61   1.925   6.278  -9.971
  481    HB   VAL  61           HB       VAL  61   0.935   7.008 -12.730
  482   1HG1  VAL  61          1HG1      VAL  61   3.402   7.611 -11.154
  483   2HG1  VAL  61          2HG1      VAL  61   2.328   8.718 -12.010
  484   3HG1  VAL  61          3HG1      VAL  61   3.407   7.658 -12.917
  485   1HG2  VAL  61          1HG2      VAL  61   2.917   4.918 -11.856
  486   2HG2  VAL  61          2HG2      VAL  61   2.838   5.553 -13.500
  487   3HG2  VAL  61          3HG2      VAL  61   1.456   4.694 -12.818
  488    H    ASN  62           H        ASN  62  -1.155   7.321 -11.422
  489    HA   ASN  62           HA       ASN  62  -0.983  10.008 -10.649
  490   1HB   ASN  62          2HB       ASN  62  -3.437   9.947 -11.092
  491   2HB   ASN  62          1HB       ASN  62  -2.462   9.325 -12.408
  492   1HD2  ASN  62          1HD2      ASN  62  -4.765   8.507 -12.814
  493   2HD2  ASN  62          2HD2      ASN  62  -5.111   6.925 -12.213
  494    H    PHE  63           H        PHE  63  -1.579   7.157  -8.878
  495    HA   PHE  63           HA       PHE  63  -3.151   8.416  -6.802
  496   1HB   PHE  63          2HB       PHE  63  -3.375   5.993  -7.558
  497   2HB   PHE  63          1HB       PHE  63  -1.861   5.689  -6.718
  498    HD1  PHE  63           1HD      PHE  63  -4.467   8.005  -5.511
  499    HD2  PHE  63           2HD      PHE  63  -2.704   4.151  -5.132
  500    HE1  PHE  63           1HE      PHE  63  -5.706   7.649  -3.420
  501    HE2  PHE  63           2HE      PHE  63  -3.945   3.786  -3.041
  502    HZ   PHE  63           HZ       PHE  63  -5.449   5.537  -2.183
  503    H    ILE  64           H        ILE  64   0.178   7.610  -7.430
  504    HA   ILE  64           HA       ILE  64   1.340   7.521  -4.956
  505    HB   ILE  64           HB       ILE  64   2.530   9.160  -7.190
  506   1HG1  ILE  64          2HG1      ILE  64   1.797   7.088  -8.202
  507   2HG1  ILE  64          1HG1      ILE  64   3.541   7.027  -7.994
  508   1HG2  ILE  64          1HG2      ILE  64   4.646   8.200  -6.268
  509   2HG2  ILE  64          2HG2      ILE  64   3.696   7.548  -4.934
  510   3HG2  ILE  64          3HG2      ILE  64   3.793   9.291  -5.179
  511   1HD1  ILE  64          1HD1      ILE  64   1.428   5.598  -6.429
  512   2HD1  ILE  64          2HD1      ILE  64   3.094   5.739  -5.866
  513   3HD1  ILE  64          3HD1      ILE  64   2.743   4.916  -7.385
  514    H    ASP  65           H        ASP  65   0.385  10.428  -6.744
  515    HA   ASP  65           HA       ASP  65   1.372  12.259  -4.810
  516   1HB   ASP  65          2HB       ASP  65   0.455  12.492  -7.373
  517   2HB   ASP  65          1HB       ASP  65  -0.896  13.160  -6.461
  518    H    PHE  66           H        PHE  66  -1.851  10.903  -5.445
  519    HA   PHE  66           HA       PHE  66  -3.371  12.324  -3.661
  520   1HB   PHE  66          2HB       PHE  66  -4.190  10.588  -5.255
  521   2HB   PHE  66          1HB       PHE  66  -3.589   9.352  -4.156
  522    HD1  PHE  66           1HD      PHE  66  -4.537   9.338  -1.777
  523    HD2  PHE  66           2HD      PHE  66  -6.328  11.443  -5.014
  524    HE1  PHE  66           1HE      PHE  66  -6.676   9.380  -0.563
  525    HE2  PHE  66           2HE      PHE  66  -8.470  11.487  -3.805
  526    HZ   PHE  66           HZ       PHE  66  -8.646  10.452  -1.578
  527    H    ILE  67           H        ILE  67  -1.272   9.555  -3.007
  528    HA   ILE  67           HA       ILE  67  -1.978   9.197  -0.307
  529    HB   ILE  67           HB       ILE  67   0.469   8.467  -1.897
  530   1HG1  ILE  67          2HG1      ILE  67  -0.361   6.156  -1.228
  531   2HG1  ILE  67          1HG1      ILE  67  -1.803   6.954  -0.611
  532   1HG2  ILE  67          1HG2      ILE  67   1.635   8.575   0.035
  533   2HG2  ILE  67          2HG2      ILE  67   0.835   7.036   0.355
  534   3HG2  ILE  67          3HG2      ILE  67   0.186   8.526   1.039
  535   1HD1  ILE  67          1HD1      ILE  67  -0.829   7.033  -3.455
  536   2HD1  ILE  67          2HD1      ILE  67  -2.285   7.814  -2.837
  537   3HD1  ILE  67          3HD1      ILE  67  -2.159   6.055  -2.837
  538    H    LYS  68           H        LYS  68   0.701  11.026  -1.794
  539    HA   LYS  68           HA       LYS  68   1.555  12.099   0.727
  540   1HB   LYS  68          2HB       LYS  68   2.259  12.930  -2.096
  541   2HB   LYS  68          1HB       LYS  68   3.068  13.494  -0.641
  542   1HG   LYS  68          2HG       LYS  68   2.972  10.594  -0.821
  543   2HG   LYS  68          1HG       LYS  68   3.807  11.342  -2.183
  544   1HD   LYS  68          2HD       LYS  68   4.399  12.005   0.697
  545   2HD   LYS  68          1HD       LYS  68   5.261  10.761  -0.213
  546   1HE   LYS  68          2HE       LYS  68   6.659  12.486  -0.652
  547   2HE   LYS  68          1HE       LYS  68   5.492  12.791  -1.939
  548   1HZ   LYS  68          1HZ       LYS  68   4.705  14.624  -0.915
  549   2HZ   LYS  68          2HZ       LYS  68   6.242  14.642  -0.210
  550   3HZ   LYS  68          3HZ       LYS  68   4.928  14.008   0.646
  551    H    GLU  69           H        GLU  69  -0.966  12.827  -1.391
  552    HA   GLU  69           HA       GLU  69  -1.051  15.662  -1.022
  553   1HB   GLU  69          2HB       GLU  69  -2.094  14.365  -2.935
  554   2HB   GLU  69          1HB       GLU  69  -3.345  13.876  -1.803
  555   1HG   GLU  69          2HG       GLU  69  -3.340  16.566  -1.453
  556   2HG   GLU  69          1HG       GLU  69  -2.925  16.433  -3.162
  557    H    ASN  70           H        ASN  70  -2.858  12.919   0.310
  558    HA   ASN  70           HA       ASN  70  -3.751  14.660   2.509
  559   1HB   ASN  70          2HB       ASN  70  -5.088  12.071   1.760
  560   2HB   ASN  70          1HB       ASN  70  -5.747  13.427   2.670
  561   1HD2  ASN  70          1HD2      ASN  70  -4.545  12.530  -0.531
  562   2HD2  ASN  70          2HD2      ASN  70  -5.596  13.576  -1.415
  563    H    SER  71           H        SER  71  -1.282  12.862   2.070
  564    HA   SER  71           HA       SER  71  -1.145  11.924   4.772
  565   1HB   SER  71          2HB       SER  71  -1.879  10.069   2.652
  566   2HB   SER  71          1HB       SER  71  -0.397   9.575   3.468
  567    HG   SER  71           HG       SER  71  -2.823  10.252   4.780
  568    HA   PRO  72           HA       PRO  72   2.848  13.070   2.653
  569   1HB   PRO  72          2HB       PRO  72   3.154  15.120   4.682
  570   2HB   PRO  72          1HB       PRO  72   3.064  15.305   2.930
  571   1HG   PRO  72          2HG       PRO  72   1.110  16.146   4.637
  572   2HG   PRO  72          1HG       PRO  72   0.808  15.671   2.957
  573   1HD   PRO  72          2HD       PRO  72   0.367  14.121   5.479
  574   2HD   PRO  72          1HD       PRO  72  -0.638  14.207   4.015
  575    H    ASP  73           H        ASP  73   1.815  12.290   5.799
  576    HA   ASP  73           HA       ASP  73   4.559  11.594   6.605
  577   1HB   ASP  73          2HB       ASP  73   3.364  13.229   8.068
  578   2HB   ASP  73          1HB       ASP  73   2.165  11.985   8.405
  579    H    SER  74           H        SER  74   2.895   9.994   4.872
  580    HA   SER  74           HA       SER  74   2.364   7.670   6.599
  581   1HB   SER  74          2HB       SER  74   0.401   8.515   5.347
  582   2HB   SER  74          1HB       SER  74   1.269   8.244   3.837
  583    HG   SER  74           HG       SER  74  -0.068   6.483   4.287
  584    H    VAL  75           H        VAL  75   2.266   5.794   4.463
  585    HA   VAL  75           HA       VAL  75   4.991   5.857   3.379
  586    HB   VAL  75           HB       VAL  75   3.893   3.430   4.799
  587   1HG1  VAL  75          1HG1      VAL  75   6.052   3.855   2.916
  588   2HG1  VAL  75          2HG1      VAL  75   5.400   2.347   3.558
  589   3HG1  VAL  75          3HG1      VAL  75   6.650   3.219   4.447
  590   1HG2  VAL  75          1HG2      VAL  75   4.508   4.563   6.643
  591   2HG2  VAL  75          2HG2      VAL  75   5.475   5.724   5.732
  592   3HG2  VAL  75          3HG2      VAL  75   6.146   4.145   6.142
  593    H    VAL  76           H        VAL  76   5.268   4.975   1.455
  594    HA   VAL  76           HA       VAL  76   2.903   3.771   0.162
  595    HB   VAL  76           HB       VAL  76   5.141   5.136  -1.311
  596   1HG1  VAL  76          1HG1      VAL  76   3.948   3.887  -2.841
  597   2HG1  VAL  76          2HG1      VAL  76   3.131   5.448  -2.929
  598   3HG1  VAL  76          3HG1      VAL  76   2.416   4.131  -2.001
  599   1HG2  VAL  76          1HG2      VAL  76   2.564   6.378  -0.355
  600   2HG2  VAL  76          2HG2      VAL  76   3.746   7.141  -1.419
  601   3HG2  VAL  76          3HG2      VAL  76   4.177   6.753   0.247
  602    H    ILE  77           H        ILE  77   3.250   1.617   0.351
  603    HA   ILE  77           HA       ILE  77   5.856   0.555  -0.489
  604    HB   ILE  77           HB       ILE  77   3.627  -0.944   0.888
  605   1HG1  ILE  77          2HG1      ILE  77   4.419   0.841   2.348
  606   2HG1  ILE  77          1HG1      ILE  77   4.987  -0.716   2.941
  607   1HG2  ILE  77          1HG2      ILE  77   4.879  -2.649   0.106
  608   2HG2  ILE  77          2HG2      ILE  77   5.903  -2.258   1.487
  609   3HG2  ILE  77          3HG2      ILE  77   6.308  -1.641  -0.114
  610   1HD1  ILE  77          1HD1      ILE  77   7.042   0.091   1.322
  611   2HD1  ILE  77          2HD1      ILE  77   6.978   0.266   3.075
  612   3HD1  ILE  77          3HD1      ILE  77   6.486   1.604   2.037
  613    H    VAL  78           H        VAL  78   4.253   1.525  -2.508
  614    HA   VAL  78           HA       VAL  78   2.477  -0.224  -3.736
  615    HB   VAL  78           HB       VAL  78   4.442   1.679  -5.034
  616   1HG1  VAL  78          1HG1      VAL  78   2.045   0.238  -6.160
  617   2HG1  VAL  78          2HG1      VAL  78   3.716   0.163  -6.720
  618   3HG1  VAL  78          3HG1      VAL  78   2.783   1.646  -6.925
  619   1HG2  VAL  78          1HG2      VAL  78   1.583   2.346  -4.883
  620   2HG2  VAL  78          2HG2      VAL  78   3.004   3.361  -4.635
  621   3HG2  VAL  78          3HG2      VAL  78   2.430   2.312  -3.337
  622    H    ILE  79           H        ILE  79   3.236  -2.353  -3.461
  623    HA   ILE  79           HA       ILE  79   5.751  -3.253  -4.372
  624    HB   ILE  79           HB       ILE  79   3.274  -4.934  -4.049
  625   1HG1  ILE  79          2HG1      ILE  79   5.309  -4.068  -1.986
  626   2HG1  ILE  79          1HG1      ILE  79   3.605  -3.634  -2.022
  627   1HG2  ILE  79          1HG2      ILE  79   5.543  -6.324  -3.224
  628   2HG2  ILE  79          2HG2      ILE  79   6.030  -5.491  -4.701
  629   3HG2  ILE  79          3HG2      ILE  79   4.632  -6.566  -4.714
  630   1HD1  ILE  79          1HD1      ILE  79   3.455  -5.307  -0.532
  631   2HD1  ILE  79          2HD1      ILE  79   4.912  -6.109  -1.118
  632   3HD1  ILE  79          3HD1      ILE  79   3.389  -6.304  -1.985
  633    H    THR  80           H        THR  80   3.161  -5.050  -5.727
  634    HA   THR  80           HA       THR  80   2.475  -5.477  -7.850
  635    HB   THR  80           HB       THR  80   2.316  -3.766  -9.382
  636    HG1  THR  80           1HG      THR  80   4.376  -3.414  -9.975
  637   1HG2  THR  80          1HG2      THR  80   1.999  -2.924  -6.801
  638   2HG2  THR  80          2HG2      THR  80   1.532  -2.029  -8.244
  639   3HG2  THR  80          3HG2      THR  80   3.085  -1.710  -7.477
  640    H    GLY  81           H        GLY  81   5.721  -3.996  -8.155
  641   1HA   GLY  81          2HA       GLY  81   7.649  -4.793  -9.110
  642   2HA   GLY  81          1HA       GLY  81   7.107  -6.380  -8.585
  643    H    HIS  82           H        HIS  82   5.925  -7.692 -10.025
  644    HA   HIS  82           HA       HIS  82   5.451  -8.623 -12.043
  645   1HB   HIS  82          2HB       HIS  82   4.569  -5.889 -12.205
  646   2HB   HIS  82          1HB       HIS  82   5.163  -6.409 -13.778
  647    HD1  HIS  82           1HD      HIS  82   2.100  -5.921 -12.689
  648    HD2  HIS  82           2HD      HIS  82   3.975  -9.505 -13.642
  649    HE1  HIS  82           1HE      HIS  82   0.243  -7.533 -13.217
  650    HE2  HIS  82           2HE      HIS  82   1.404  -9.669 -13.877
  651    H    GLY  83           H        GLY  83   8.223  -7.930 -11.334
  652   1HA   GLY  83          2HA       GLY  83  10.256  -8.322 -12.357
  653   2HA   GLY  83          1HA       GLY  83   9.406  -8.508 -13.883
  654    H    SER  84           H        SER  84   8.384  -6.275 -14.604
  655    HA   SER  84           HA       SER  84  10.492  -4.615 -15.339
  656   1HB   SER  84          2HB       SER  84   7.946  -4.843 -16.160
  657   2HB   SER  84          1HB       SER  84   7.790  -3.390 -15.173
  658    HG   SER  84           HG       SER  84   9.241  -2.355 -16.456
  659    H    VAL  85           H        VAL  85  11.426  -2.836 -14.492
  660    HA   VAL  85           HA       VAL  85  10.514  -2.001 -11.824
  661    HB   VAL  85           HB       VAL  85  12.799  -1.108 -11.506
  662   1HG1  VAL  85          1HG1      VAL  85  12.315  -3.997 -12.078
  663   2HG1  VAL  85          2HG1      VAL  85  12.588  -3.185 -10.536
  664   3HG1  VAL  85          3HG1      VAL  85  13.935  -3.455 -11.641
  665   1HG2  VAL  85          1HG2      VAL  85  14.549  -1.511 -13.058
  666   2HG2  VAL  85          2HG2      VAL  85  13.221  -0.796 -13.971
  667   3HG2  VAL  85          3HG2      VAL  85  13.517  -2.532 -14.060
  668    H    ASP  86           H        ASP  86  10.508  -0.988 -15.015
  669    HA   ASP  86           HA       ASP  86  11.106   1.751 -14.781
  670   1HB   ASP  86          2HB       ASP  86  10.961   0.570 -16.942
  671   2HB   ASP  86          1HB       ASP  86   9.222   0.397 -16.722
  672    H    THR  87           H        THR  87   8.272  -0.088 -13.955
  673    HA   THR  87           HA       THR  87   6.536   2.202 -13.811
  674    HB   THR  87           HB       THR  87   5.937  -0.348 -14.136
  675    HG1  THR  87           1HG      THR  87   3.900   0.216 -13.689
  676   1HG2  THR  87          1HG2      THR  87   6.871  -0.784 -11.722
  677   2HG2  THR  87          2HG2      THR  87   5.436  -1.622 -12.315
  678   3HG2  THR  87          3HG2      THR  87   5.266  -0.230 -11.246
  679    H    ALA  88           H        ALA  88   8.577   0.391 -11.634
  680    HA   ALA  88           HA       ALA  88   7.666   1.407  -9.183
  681   1HB   ALA  88          1HB       ALA  88   9.749   0.677  -8.272
  682   2HB   ALA  88          2HB       ALA  88  10.521   0.713  -9.856
  683   3HB   ALA  88          3HB       ALA  88   9.279  -0.489  -9.508
  684    H    VAL  89           H        VAL  89  10.435   2.433 -11.149
  685    HA   VAL  89           HA       VAL  89  11.087   4.721  -9.706
  686    HB   VAL  89           HB       VAL  89  12.301   5.481 -11.669
  687   1HG1  VAL  89          1HG1      VAL  89  12.408   2.553 -11.044
  688   2HG1  VAL  89          2HG1      VAL  89  13.506   3.839 -10.543
  689   3HG1  VAL  89          3HG1      VAL  89  13.511   3.276 -12.214
  690   1HG2  VAL  89          1HG2      VAL  89  11.660   5.075 -13.761
  691   2HG2  VAL  89          2HG2      VAL  89  10.235   4.268 -13.106
  692   3HG2  VAL  89          3HG2      VAL  89  11.678   3.332 -13.490
  693    H    LYS  90           H        LYS  90   8.471   4.131 -11.887
  694    HA   LYS  90           HA       LYS  90   7.948   6.907 -12.456
  695   1HB   LYS  90          2HB       LYS  90   7.346   5.209 -14.089
  696   2HB   LYS  90          1HB       LYS  90   6.299   4.418 -12.920
  697   1HG   LYS  90          2HG       LYS  90   4.744   6.192 -12.969
  698   2HG   LYS  90          1HG       LYS  90   5.862   7.245 -13.837
  699   1HD   LYS  90          2HD       LYS  90   5.027   4.653 -15.065
  700   2HD   LYS  90          1HD       LYS  90   3.925   6.031 -15.112
  701   1HE   LYS  90          2HE       LYS  90   5.024   6.577 -16.991
  702   2HE   LYS  90          1HE       LYS  90   6.265   7.181 -15.894
  703   1HZ   LYS  90          1HZ       LYS  90   6.746   5.416 -17.814
  704   2HZ   LYS  90          2HZ       LYS  90   6.402   4.351 -16.544
  705   3HZ   LYS  90          3HZ       LYS  90   7.645   5.487 -16.380
  706    H    ALA  91           H        ALA  91   7.684   5.255  -9.665
  707    HA   ALA  91           HA       ALA  91   5.461   6.934  -8.760
  708   1HB   ALA  91          1HB       ALA  91   4.957   4.791  -7.256
  709   2HB   ALA  91          2HB       ALA  91   5.607   3.979  -8.681
  710   3HB   ALA  91          3HB       ALA  91   4.210   5.045  -8.834
  711    H    ILE  92           H        ILE  92   8.218   4.894  -7.856
  712    HA   ILE  92           HA       ILE  92   8.274   5.762  -5.153
  713    HB   ILE  92           HB       ILE  92  10.151   4.461  -4.844
  714   1HG1  ILE  92          2HG1      ILE  92  10.832   4.922  -7.758
  715   2HG1  ILE  92          1HG1      ILE  92  11.689   5.556  -6.357
  716   1HG2  ILE  92          1HG2      ILE  92   9.505   2.908  -7.235
  717   2HG2  ILE  92          2HG2      ILE  92   8.092   3.403  -6.305
  718   3HG2  ILE  92          3HG2      ILE  92   9.376   2.475  -5.531
  719   1HD1  ILE  92          1HD1      ILE  92  12.874   3.692  -7.403
  720   2HD1  ILE  92          2HD1      ILE  92  11.484   2.647  -7.105
  721   3HD1  ILE  92          3HD1      ILE  92  12.391   3.317  -5.749
  722    H    LYS  93           H        LYS  93   9.511   7.102  -8.092
  723    HA   LYS  93           HA       LYS  93  11.518   8.745  -6.902
  724   1HB   LYS  93          2HB       LYS  93  10.290   8.446  -9.568
  725   2HB   LYS  93          1HB       LYS  93  10.889  10.058  -9.200
  726   1HG   LYS  93          2HG       LYS  93  12.579   7.607  -8.832
  727   2HG   LYS  93          1HG       LYS  93  12.482   8.469 -10.369
  728   1HD   LYS  93          2HD       LYS  93  13.818  10.110  -9.644
  729   2HD   LYS  93          1HD       LYS  93  12.951  10.247  -8.113
  730   1HE   LYS  93          2HE       LYS  93  15.283   9.618  -7.758
  731   2HE   LYS  93          1HE       LYS  93  14.188   8.340  -7.231
  732   1HZ   LYS  93          1HZ       LYS  93  16.311   7.995  -8.862
  733   2HZ   LYS  93          2HZ       LYS  93  15.036   8.082  -9.969
  734   3HZ   LYS  93          3HZ       LYS  93  15.004   6.928  -8.733
  735    H    LYS  94           H        LYS  94   8.104   9.123  -7.626
  736    HA   LYS  94           HA       LYS  94   7.872  11.887  -7.250
  737   1HB   LYS  94          2HB       LYS  94   5.827   9.755  -6.606
  738   2HB   LYS  94          1HB       LYS  94   5.497  11.465  -6.849
  739   1HG   LYS  94          2HG       LYS  94   6.879  10.585  -9.136
  740   2HG   LYS  94          1HG       LYS  94   5.661   9.361  -8.776
  741   1HD   LYS  94          2HD       LYS  94   4.274  10.718  -9.911
  742   2HD   LYS  94          1HD       LYS  94   4.242  11.655  -8.415
  743   1HE   LYS  94          2HE       LYS  94   6.388  12.161 -10.428
  744   2HE   LYS  94          1HE       LYS  94   4.774  12.819 -10.696
  745   1HZ   LYS  94          1HZ       LYS  94   6.562  13.343  -8.388
  746   2HZ   LYS  94          2HZ       LYS  94   4.944  13.833  -8.448
  747   3HZ   LYS  94          3HZ       LYS  94   6.055  14.449  -9.565
  748    H    GLY  95           H        GLY  95   7.127   9.290  -4.911
  749   1HA   GLY  95          2HA       GLY  95   8.464  10.461  -2.751
  750   2HA   GLY  95          1HA       GLY  95   6.802  11.025  -2.713
  751    H    ALA  96           H        ALA  96   7.732   7.829  -3.854
  752    HA   ALA  96           HA       ALA  96   6.077   6.667  -1.763
  753   1HB   ALA  96          1HB       ALA  96   5.620   5.040  -3.223
  754   2HB   ALA  96          2HB       ALA  96   7.325   4.772  -3.581
  755   3HB   ALA  96          3HB       ALA  96   6.436   6.039  -4.425
  756    H    TYR  97           H        TYR  97   7.030   4.317  -1.135
  757    HA   TYR  97           HA       TYR  97   9.596   4.919   0.149
  758   1HB   TYR  97          2HB       TYR  97   7.516   4.237   1.470
  759   2HB   TYR  97          1HB       TYR  97   7.769   2.623   0.813
  760    HD1  TYR  97           1HD      TYR  97   8.911   1.142   2.148
  761    HD2  TYR  97           2HD      TYR  97   9.779   5.291   2.499
  762    HE1  TYR  97           1HE      TYR  97  10.501   0.649   3.958
  763    HE2  TYR  97           2HE      TYR  97  11.373   4.810   4.309
  764    HH   TYR  97           HH       TYR  97  11.479   1.945   5.954
  765    H    GLU  98           H        GLU  98   9.310   4.026  -2.628
  766    HA   GLU  98           HA       GLU  98  10.594   2.778  -4.042
  767   1HB   GLU  98          2HB       GLU  98  12.533   1.908  -3.294
  768   2HB   GLU  98          1HB       GLU  98  12.086   2.672  -1.779
  769   1HG   GLU  98          2HG       GLU  98  10.881   0.352  -1.377
  770   2HG   GLU  98          1HG       GLU  98  12.088  -0.198  -2.537
  771    H    PHE  99           H        PHE  99  10.468   0.758  -5.102
  772    HA   PHE  99           HA       PHE  99   8.012  -0.617  -4.610
  773   1HB   PHE  99          2HB       PHE  99   9.987  -0.456  -6.733
  774   2HB   PHE  99          1HB       PHE  99   9.452  -2.111  -6.478
  775    HD1  PHE  99           1HD      PHE  99   8.163  -2.498  -8.385
  776    HD2  PHE  99           2HD      PHE  99   7.458   0.982  -6.038
  777    HE1  PHE  99           1HE      PHE  99   6.125  -2.040  -9.685
  778    HE2  PHE  99           2HE      PHE  99   5.417   1.445  -7.334
  779    HZ   PHE  99           HZ       PHE  99   4.748  -0.067  -9.158
  780    H    LEU 100           H        LEU 100   7.659  -2.629  -3.795
  781    HA   LEU 100           HA       LEU 100   9.765  -3.771  -2.185
  782   1HB   LEU 100          2HB       LEU 100   7.249  -3.485  -1.600
  783   2HB   LEU 100          1HB       LEU 100   7.028  -4.948  -2.538
  784    HG   LEU 100           HG       LEU 100   7.161  -5.654  -0.302
  785   1HD1  LEU 100          1HD1      LEU 100   8.529  -6.972  -1.859
  786   2HD1  LEU 100          2HD1      LEU 100   9.165  -7.002  -0.215
  787   3HD1  LEU 100          3HD1      LEU 100   9.930  -5.987  -1.437
  788   1HD2  LEU 100          1HD2      LEU 100   9.258  -3.563  -0.091
  789   2HD2  LEU 100          2HD2      LEU 100   9.381  -4.969   0.966
  790   3HD2  LEU 100          3HD2      LEU 100   7.937  -3.958   1.008
  791    H    GLU 101           H        GLU 101  11.227  -4.660  -3.626
  792    HA   GLU 101           HA       GLU 101  10.570  -6.272  -5.831
  793   1HB   GLU 101          2HB       GLU 101  13.101  -6.371  -4.183
  794   2HB   GLU 101          1HB       GLU 101  12.906  -6.932  -5.838
  795   1HG   GLU 101          2HG       GLU 101  12.592  -4.074  -4.951
  796   2HG   GLU 101          1HG       GLU 101  14.058  -4.757  -5.654
  797    H    LYS 102           H        LYS 102  10.803  -8.550  -6.115
  798    HA   LYS 102           HA       LYS 102  10.371 -10.721  -5.606
  799   1HB   LYS 102          2HB       LYS 102  12.352  -9.879  -3.838
  800   2HB   LYS 102          1HB       LYS 102  11.180 -10.694  -2.812
  801   1HG   LYS 102          2HG       LYS 102  12.064 -12.629  -3.412
  802   2HG   LYS 102          1HG       LYS 102  11.518 -12.335  -5.064
  803   1HD   LYS 102          2HD       LYS 102  13.653 -10.978  -5.358
  804   2HD   LYS 102          1HD       LYS 102  14.190 -11.698  -3.838
  805   1HE   LYS 102          2HE       LYS 102  13.288 -13.295  -6.229
  806   2HE   LYS 102          1HE       LYS 102  14.971 -12.884  -5.903
  807   1HZ   LYS 102          1HZ       LYS 102  14.833 -14.920  -4.920
  808   2HZ   LYS 102          2HZ       LYS 102  13.205 -14.749  -4.493
  809   3HZ   LYS 102          3HZ       LYS 102  14.402 -13.954  -3.600
  810    HA   PRO 103           HA       PRO 103   6.548  -9.558  -3.250
  811   1HB   PRO 103          2HB       PRO 103   4.758  -9.962  -5.206
  812   2HB   PRO 103          1HB       PRO 103   5.686  -8.460  -5.097
  813   1HG   PRO 103          2HG       PRO 103   6.128 -10.835  -6.862
  814   2HG   PRO 103          1HG       PRO 103   6.235  -9.111  -7.259
  815   1HD   PRO 103          2HD       PRO 103   8.406 -10.701  -6.708
  816   2HD   PRO 103          1HD       PRO 103   8.376  -8.942  -6.472
  817    H    PHE 104           H        PHE 104   7.785 -11.870  -2.704
  818    HA   PHE 104           HA       PHE 104   5.945 -14.039  -3.423
  819   1HB   PHE 104          2HB       PHE 104   8.759 -13.981  -2.372
  820   2HB   PHE 104          1HB       PHE 104   7.778 -15.434  -2.221
  821    HD1  PHE 104           1HD      PHE 104   8.317 -12.922  -4.931
  822    HD2  PHE 104           2HD      PHE 104   8.365 -17.015  -3.767
  823    HE1  PHE 104           1HE      PHE 104   8.922 -13.564  -7.228
  824    HE2  PHE 104           2HE      PHE 104   8.971 -17.664  -6.061
  825    HZ   PHE 104           HZ       PHE 104   9.251 -15.938  -7.796
  826    H    SER 105           H        SER 105   4.253 -14.093  -2.077
  827    HA   SER 105           HA       SER 105   3.012 -14.203  -0.173
  828   1HB   SER 105          2HB       SER 105   4.345 -16.203   0.240
  829   2HB   SER 105          1HB       SER 105   5.622 -15.230   0.967
  830    HG   SER 105           HG       SER 105   4.104 -14.626   2.587
  831    H    VAL 106           H        VAL 106   4.627 -11.760  -0.786
  832    HA   VAL 106           HA       VAL 106   5.353  -9.811   0.171
  833    HB   VAL 106           HB       VAL 106   3.664  -8.650   1.303
  834   1HG1  VAL 106          1HG1      VAL 106   2.069 -10.782  -0.083
  835   2HG1  VAL 106          2HG1      VAL 106   3.062  -9.620  -0.963
  836   3HG1  VAL 106          3HG1      VAL 106   1.725  -9.057   0.042
  837   1HG2  VAL 106          1HG2      VAL 106   1.800 -10.649   2.129
  838   2HG2  VAL 106          2HG2      VAL 106   2.632  -9.436   3.102
  839   3HG2  VAL 106          3HG2      VAL 106   3.375 -11.007   2.831
  840    H    GLU 107           H        GLU 107   6.688 -12.058   1.365
  841    HA   GLU 107           HA       GLU 107   6.707 -11.778   4.199
  842   1HB   GLU 107          2HB       GLU 107   7.582 -13.689   2.534
  843   2HB   GLU 107          1HB       GLU 107   9.094 -12.837   2.807
  844   1HG   GLU 107          2HG       GLU 107   8.761 -13.108   5.237
  845   2HG   GLU 107          1HG       GLU 107   7.312 -14.054   4.900
  846    H    ARG 108           H        ARG 108   8.900 -10.751   1.597
  847    HA   ARG 108           HA       ARG 108  10.678  -9.303   3.235
  848   1HB   ARG 108          2HB       ARG 108  11.066 -10.015   0.837
  849   2HB   ARG 108          1HB       ARG 108  10.016  -8.693   0.348
  850   1HG   ARG 108          2HG       ARG 108  12.028  -7.665   0.148
  851   2HG   ARG 108          1HG       ARG 108  11.687  -7.289   1.838
  852   1HD   ARG 108          2HD       ARG 108  13.059  -9.139   2.568
  853   2HD   ARG 108          1HD       ARG 108  13.318  -9.645   0.899
  854    HE   ARG 108           HE       ARG 108  14.256  -7.110   0.924
  855   1HH1  ARG 108          1HH1      ARG 108  14.878  -9.902   2.922
  856   2HH1  ARG 108          2HH1      ARG 108  16.506  -9.437   3.282
  857   1HH2  ARG 108          1HH2      ARG 108  16.398  -6.497   1.397
  858   2HH2  ARG 108          2HH2      ARG 108  17.369  -7.505   2.416
  859    H    PHE 109           H        PHE 109   7.576  -8.588   1.845
  860    HA   PHE 109           HA       PHE 109   7.571  -5.785   2.081
  861   1HB   PHE 109          2HB       PHE 109   5.833  -6.694   0.781
  862   2HB   PHE 109          1HB       PHE 109   5.424  -7.894   2.000
  863    HD1  PHE 109           1HD      PHE 109   5.442  -4.207   1.472
  864    HD2  PHE 109           2HD      PHE 109   3.581  -7.547   3.340
  865    HE1  PHE 109           1HE      PHE 109   3.652  -2.739   2.302
  866    HE2  PHE 109           2HE      PHE 109   1.787  -6.084   4.174
  867    HZ   PHE 109           HZ       PHE 109   1.822  -3.678   3.656
  868    H    LEU 110           H        LEU 110   6.741  -8.387   4.309
  869    HA   LEU 110           HA       LEU 110   5.642  -6.946   6.400
  870   1HB   LEU 110          2HB       LEU 110   6.724  -9.552   5.976
  871   2HB   LEU 110          1HB       LEU 110   7.217  -8.952   7.546
  872    HG   LEU 110           HG       LEU 110   4.400  -9.292   6.536
  873   1HD1  LEU 110          1HD1      LEU 110   4.484 -10.647   8.807
  874   2HD1  LEU 110          2HD1      LEU 110   6.190 -10.762   8.378
  875   3HD1  LEU 110          3HD1      LEU 110   4.958 -11.363   7.268
  876   1HD2  LEU 110          1HD2      LEU 110   4.187  -7.369   7.800
  877   2HD2  LEU 110          2HD2      LEU 110   5.488  -7.823   8.901
  878   3HD2  LEU 110          3HD2      LEU 110   3.923  -8.630   9.005
  879    H    LEU 111           H        LEU 111   9.055  -7.759   5.841
  880    HA   LEU 111           HA       LEU 111  10.105  -6.540   8.126
  881   1HB   LEU 111          2HB       LEU 111  11.317  -7.041   5.419
  882   2HB   LEU 111          1HB       LEU 111  12.232  -6.418   6.778
  883    HG   LEU 111           HG       LEU 111  11.383  -8.547   8.012
  884   1HD1  LEU 111          1HD1      LEU 111  10.565  -9.023   5.226
  885   2HD1  LEU 111          2HD1      LEU 111   9.938  -9.701   6.729
  886   3HD1  LEU 111          3HD1      LEU 111  11.411 -10.356   6.012
  887   1HD2  LEU 111          1HD2      LEU 111  13.718  -7.869   6.865
  888   2HD2  LEU 111          2HD2      LEU 111  13.328  -9.313   5.930
  889   3HD2  LEU 111          3HD2      LEU 111  13.445  -9.405   7.687
  890    H    THR 112           H        THR 112   9.771  -5.241   4.828
  891    HA   THR 112           HA       THR 112  10.825  -2.697   5.376
  892    HB   THR 112           HB       THR 112   8.807  -3.560   3.294
  893    HG1  THR 112           1HG      THR 112  11.595  -3.128   3.050
  894   1HG2  THR 112          1HG2      THR 112   9.233  -1.617   2.066
  895   2HG2  THR 112          2HG2      THR 112  10.576  -1.150   3.109
  896   3HG2  THR 112          3HG2      THR 112   8.920  -1.065   3.711
  897    H    ILE 113           H        ILE 113   7.579  -4.008   5.644
  898    HA   ILE 113           HA       ILE 113   6.127  -1.673   6.026
  899    HB   ILE 113           HB       ILE 113   5.747  -4.519   6.769
  900   1HG1  ILE 113          2HG1      ILE 113   5.012  -3.644   4.608
  901   2HG1  ILE 113          1HG1      ILE 113   3.633  -4.180   5.563
  902   1HG2  ILE 113          1HG2      ILE 113   4.314  -2.271   8.138
  903   2HG2  ILE 113          2HG2      ILE 113   5.034  -3.720   8.838
  904   3HG2  ILE 113          3HG2      ILE 113   3.547  -3.841   7.897
  905   1HD1  ILE 113          1HD1      ILE 113   4.489  -1.395   4.900
  906   2HD1  ILE 113          2HD1      ILE 113   3.422  -1.725   6.264
  907   3HD1  ILE 113          3HD1      ILE 113   2.932  -2.177   4.631
  908    H    LYS 114           H        LYS 114   7.597  -3.751   8.531
  909    HA   LYS 114           HA       LYS 114   6.887  -2.324  10.767
  910   1HB   LYS 114          2HB       LYS 114   8.200  -4.513  10.602
  911   2HB   LYS 114          1HB       LYS 114   9.632  -3.506  10.437
  912   1HG   LYS 114          2HG       LYS 114   7.764  -3.117  12.737
  913   2HG   LYS 114          1HG       LYS 114   8.972  -4.402  12.766
  914   1HD   LYS 114          2HD       LYS 114  10.584  -2.954  13.275
  915   2HD   LYS 114          1HD       LYS 114  10.168  -1.935  11.896
  916   1HE   LYS 114          2HE       LYS 114   9.998  -0.684  13.976
  917   2HE   LYS 114          1HE       LYS 114   8.415  -0.860  13.221
  918   1HZ   LYS 114          1HZ       LYS 114   7.846  -1.479  15.295
  919   2HZ   LYS 114          2HZ       LYS 114   9.412  -1.958  15.720
  920   3HZ   LYS 114          3HZ       LYS 114   8.431  -2.987  14.805
  921    H    HIS 115           H        HIS 115   9.958  -1.991   9.004
  922    HA   HIS 115           HA       HIS 115  10.843   0.304  10.312
  923   1HB   HIS 115          2HB       HIS 115  12.233  -1.163   8.856
  924   2HB   HIS 115          1HB       HIS 115  11.421  -0.478   7.452
  925    HD1  HIS 115           1HD      HIS 115  12.819   1.361  10.467
  926    HD2  HIS 115           2HD      HIS 115  13.373   1.065   6.359
  927    HE1  HIS 115           1HE      HIS 115  14.517   3.123   9.889
  928    HE2  HIS 115           2HE      HIS 115  14.912   2.856   7.416
  929    H    ALA 116           H        ALA 116   8.492  -0.087   7.781
  930    HA   ALA 116           HA       ALA 116   8.537   2.551   6.761
  931   1HB   ALA 116          1HB       ALA 116   5.920   1.586   6.492
  932   2HB   ALA 116          2HB       ALA 116   6.968   0.171   6.397
  933   3HB   ALA 116          3HB       ALA 116   7.216   1.527   5.298
  934    H    PHE 117           H        PHE 117   6.794   1.028   9.419
  935    HA   PHE 117           HA       PHE 117   5.094   3.223   9.980
  936   1HB   PHE 117          2HB       PHE 117   5.880   0.716  11.392
  937   2HB   PHE 117          1HB       PHE 117   5.077   1.980  12.318
  938    HD1  PHE 117           1HD      PHE 117   2.798   2.657  11.774
  939    HD2  PHE 117           2HD      PHE 117   4.703  -0.560   9.743
  940    HE1  PHE 117           1HE      PHE 117   0.613   1.900  10.936
  941    HE2  PHE 117           2HE      PHE 117   2.520  -1.324   8.902
  942    HZ   PHE 117           HZ       PHE 117   0.471  -0.087   9.496
  943    H    GLU 118           H        GLU 118   8.413   2.626  10.660
  944    HA   GLU 118           HA       GLU 118   8.783   4.029  13.036
  945   1HB   GLU 118          2HB       GLU 118  10.590   3.653  10.660
  946   2HB   GLU 118          1HB       GLU 118  11.110   4.468  12.127
  947   1HG   GLU 118          2HG       GLU 118   9.880   1.924  12.715
  948   2HG   GLU 118          1HG       GLU 118  11.226   1.751  11.590
  949    H    GLU 119           H        GLU 119   7.992   5.198   9.894
  950    HA   GLU 119           HA       GLU 119   8.800   7.926  10.553
  951   1HB   GLU 119          2HB       GLU 119   7.445   7.016   8.020
  952   2HB   GLU 119          1HB       GLU 119   8.400   8.469   8.275
  953   1HG   GLU 119          2HG       GLU 119  10.418   7.231   8.385
  954   2HG   GLU 119          1HG       GLU 119   9.548   5.699   8.462
  955    H    TYR 120           H        TYR 120   6.603   6.569  11.972
  956    HA   TYR 120           HA       TYR 120   4.377   8.334  11.190
  957   1HB   TYR 120          2HB       TYR 120   3.925   5.876  11.022
  958   2HB   TYR 120          1HB       TYR 120   4.189   5.756  12.759
  959    HD1  TYR 120           1HD      TYR 120   2.259   5.601  13.999
  960    HD2  TYR 120           2HD      TYR 120   2.220   7.962  10.460
  961    HE1  TYR 120           1HE      TYR 120  -0.105   6.146  14.397
  962    HE2  TYR 120           2HE      TYR 120  -0.145   8.515  10.848
  963    HH   TYR 120           HH       TYR 120  -1.739   8.602  12.686
  964    H    SER 121           H        SER 121   6.683   8.954  12.924
  965    HA   SER 121           HA       SER 121   5.493   9.135  15.579
  966   1HB   SER 121          2HB       SER 121   8.055   8.681  14.823
  967   2HB   SER 121          1HB       SER 121   8.104  10.428  15.062
  968    HG   SER 121           HG       SER 121   7.506   8.398  16.921
  Start of MODEL   29
    1   1H    MET   1          1HT       MET   1   0.078  -2.677  16.613
    2   2H    MET   1          2HT       MET   1  -0.228  -2.062  18.186
    3   3H    MET   1          3HT       MET   1   0.896  -1.272  17.157
    4    HA   MET   1           HA       MET   1  -1.959  -1.589  16.536
    5   1HB   MET   1          2HB       MET   1  -2.125   0.795  17.247
    6   2HB   MET   1          1HB       MET   1  -1.768  -0.306  18.571
    7   1HG   MET   1          2HG       MET   1   0.516   0.361  18.612
    8   2HG   MET   1          1HG       MET   1   0.331   1.283  17.121
    9   1HE   MET   1          1HE       MET   1  -1.620   1.282  20.796
   10   2HE   MET   1          2HE       MET   1  -0.523   2.538  21.368
   11   3HE   MET   1          3HE       MET   1   0.123   1.013  20.762
   12    H    LYS   2           H        LYS   2  -0.487  -2.206  14.524
   13    HA   LYS   2           HA       LYS   2   0.083   0.266  13.032
   14   1HB   LYS   2          2HB       LYS   2   1.267  -2.478  12.893
   15   2HB   LYS   2          1HB       LYS   2   1.347  -1.401  11.504
   16   1HG   LYS   2          2HG       LYS   2   3.349  -0.982  12.551
   17   2HG   LYS   2          1HG       LYS   2   2.324   0.298  13.203
   18   1HD   LYS   2          2HD       LYS   2   2.476  -0.497  15.286
   19   2HD   LYS   2          1HD       LYS   2   2.203  -2.159  14.761
   20   1HE   LYS   2          2HE       LYS   2   4.479  -2.508  14.311
   21   2HE   LYS   2          1HE       LYS   2   4.833  -0.780  14.327
   22   1HZ   LYS   2          1HZ       LYS   2   3.998  -2.348  16.706
   23   2HZ   LYS   2          2HZ       LYS   2   4.479  -0.726  16.685
   24   3HZ   LYS   2          3HZ       LYS   2   5.598  -1.945  16.336
   25    H    ARG   3           H        ARG   3  -1.355   0.806  11.548
   26    HA   ARG   3           HA       ARG   3  -3.022  -1.312  10.357
   27   1HB   ARG   3          2HB       ARG   3  -3.641   1.640  10.587
   28   2HB   ARG   3          1HB       ARG   3  -4.717   0.393   9.973
   29   1HG   ARG   3          2HG       ARG   3  -5.529   0.584  12.083
   30   2HG   ARG   3          1HG       ARG   3  -4.297  -0.648  12.364
   31   1HD   ARG   3          2HD       ARG   3  -2.731   1.305  12.890
   32   2HD   ARG   3          1HD       ARG   3  -4.191   2.289  12.983
   33    HE   ARG   3           HE       ARG   3  -3.273   0.360  14.904
   34   1HH1  ARG   3          1HH1      ARG   3  -6.068   2.030  13.647
   35   2HH1  ARG   3          2HH1      ARG   3  -6.988   1.846  15.103
   36   1HH2  ARG   3          1HH2      ARG   3  -4.482   0.116  16.818
   37   2HH2  ARG   3          2HH2      ARG   3  -6.088   0.759  16.903
   38    H    VAL   4           H        VAL   4  -2.731  -1.726   8.259
   39    HA   VAL   4           HA       VAL   4  -1.495   0.360   6.579
   40    HB   VAL   4           HB       VAL   4  -1.046  -2.611   6.291
   41   1HG1  VAL   4          1HG1      VAL   4   0.955  -1.550   4.936
   42   2HG1  VAL   4          2HG1      VAL   4  -0.171  -0.202   4.785
   43   3HG1  VAL   4          3HG1      VAL   4  -0.626  -1.800   4.197
   44   1HG2  VAL   4          1HG2      VAL   4   0.823  -0.530   7.424
   45   2HG2  VAL   4          2HG2      VAL   4   1.176  -2.242   7.196
   46   3HG2  VAL   4          3HG2      VAL   4  -0.044  -1.742   8.367
   47    H    LEU   5           H        LEU   5  -2.249   0.582   4.486
   48    HA   LEU   5           HA       LEU   5  -4.834  -0.677   3.970
   49   1HB   LEU   5          2HB       LEU   5  -4.642   1.787   3.821
   50   2HB   LEU   5          1HB       LEU   5  -3.473   1.602   2.528
   51    HG   LEU   5           HG       LEU   5  -5.200   0.541   1.124
   52   1HD1  LEU   5          1HD1      LEU   5  -7.348   0.137   1.789
   53   2HD1  LEU   5          2HD1      LEU   5  -7.320   1.390   3.028
   54   3HD1  LEU   5          3HD1      LEU   5  -6.501  -0.145   3.309
   55   1HD2  LEU   5          1HD2      LEU   5  -6.776   2.700   1.220
   56   2HD2  LEU   5          2HD2      LEU   5  -5.152   2.727   0.533
   57   3HD2  LEU   5          3HD2      LEU   5  -5.422   3.295   2.180
   58    H    VAL   6           H        VAL   6  -5.111  -2.215   2.482
   59    HA   VAL   6           HA       VAL   6  -2.844  -2.803   0.689
   60    HB   VAL   6           HB       VAL   6  -4.981  -4.750   1.547
   61   1HG1  VAL   6          1HG1      VAL   6  -3.927  -5.385  -0.502
   62   2HG1  VAL   6          2HG1      VAL   6  -3.292  -6.413   0.782
   63   3HG1  VAL   6          3HG1      VAL   6  -2.325  -5.074   0.165
   64   1HG2  VAL   6          1HG2      VAL   6  -3.705  -5.487   3.308
   65   2HG2  VAL   6          2HG2      VAL   6  -3.380  -3.755   3.366
   66   3HG2  VAL   6          3HG2      VAL   6  -2.207  -4.848   2.632
   67    H    VAL   7           H        VAL   7  -3.481  -1.553  -1.070
   68    HA   VAL   7           HA       VAL   7  -6.135  -1.979  -2.158
   69    HB   VAL   7           HB       VAL   7  -3.914  -0.202  -3.185
   70   1HG1  VAL   7          1HG1      VAL   7  -6.414  -1.015  -4.346
   71   2HG1  VAL   7          2HG1      VAL   7  -5.132  -0.016  -5.030
   72   3HG1  VAL   7          3HG1      VAL   7  -6.403   0.725  -4.058
   73   1HG2  VAL   7          1HG2      VAL   7  -6.392   0.568  -1.651
   74   2HG2  VAL   7          2HG2      VAL   7  -5.088   1.634  -2.174
   75   3HG2  VAL   7          3HG2      VAL   7  -4.785   0.411  -0.940
   76    H    ASP   8           H        ASP   8  -6.551  -3.541  -3.528
   77    HA   ASP   8           HA       ASP   8  -4.700  -4.187  -5.654
   78   1HB   ASP   8          2HB       ASP   8  -3.820  -5.654  -3.975
   79   2HB   ASP   8          1HB       ASP   8  -5.430  -6.186  -3.505
   80    H    ASP   9           H        ASP   9  -5.835  -4.487  -7.445
   81    HA   ASP   9           HA       ASP   9  -8.709  -4.786  -7.301
   82   1HB   ASP   9          2HB       ASP   9  -7.426  -3.217  -8.881
   83   2HB   ASP   9          1HB       ASP   9  -7.075  -4.659  -9.829
   84    H    GLU  10           H        GLU  10  -7.605  -7.063  -6.327
   85    HA   GLU  10           HA       GLU  10  -8.049  -9.011  -8.493
   86   1HB   GLU  10          2HB       GLU  10  -5.700  -8.801  -7.320
   87   2HB   GLU  10          1HB       GLU  10  -6.483  -9.729  -6.048
   88   1HG   GLU  10          2HG       GLU  10  -6.891 -10.817  -8.728
   89   2HG   GLU  10          1HG       GLU  10  -5.204 -10.775  -8.214
   90    H    GLU  11           H        GLU  11  -8.470  -8.287  -5.068
   91    HA   GLU  11           HA       GLU  11 -11.067  -9.314  -4.917
   92   1HB   GLU  11          2HB       GLU  11  -9.327 -11.399  -5.031
   93   2HB   GLU  11          1HB       GLU  11  -9.401 -11.138  -3.295
   94   1HG   GLU  11          2HG       GLU  11 -11.444 -12.006  -3.138
   95   2HG   GLU  11          1HG       GLU  11 -12.023 -11.125  -4.552
   96    H    SER  12           H        SER  12 -11.193 -10.114  -2.250
   97    HA   SER  12           HA       SER  12 -11.158  -7.674  -0.903
   98   1HB   SER  12          2HB       SER  12 -11.378  -9.104   1.187
   99   2HB   SER  12          1HB       SER  12 -12.579  -9.399  -0.069
  100    HG   SER  12           HG       SER  12 -11.765 -11.329  -0.412
  101    H    ILE  13           H        ILE  13  -9.337 -10.219   0.684
  102    HA   ILE  13           HA       ILE  13  -7.184  -8.331   1.174
  103    HB   ILE  13           HB       ILE  13  -7.204 -11.174   2.126
  104   1HG1  ILE  13          2HG1      ILE  13  -9.399 -10.116   2.677
  105   2HG1  ILE  13          1HG1      ILE  13  -8.446 -10.529   4.097
  106   1HG2  ILE  13          1HG2      ILE  13  -5.197 -10.352   2.760
  107   2HG2  ILE  13          2HG2      ILE  13  -6.147  -9.756   4.121
  108   3HG2  ILE  13          3HG2      ILE  13  -5.761  -8.680   2.778
  109   1HD1  ILE  13          1HD1      ILE  13  -7.659  -8.100   4.043
  110   2HD1  ILE  13          2HD1      ILE  13  -9.313  -8.424   4.565
  111   3HD1  ILE  13          3HD1      ILE  13  -9.003  -7.831   2.933
  112    H    THR  14           H        THR  14  -4.933  -9.012   0.957
  113    HA   THR  14           HA       THR  14  -4.520 -10.317  -1.608
  114    HB   THR  14           HB       THR  14  -2.226  -9.440  -1.452
  115    HG1  THR  14           1HG      THR  14  -3.059  -8.375   1.040
  116   1HG2  THR  14          1HG2      THR  14  -2.696  -7.028  -1.403
  117   2HG2  THR  14          2HG2      THR  14  -4.310  -7.374  -0.784
  118   3HG2  THR  14          3HG2      THR  14  -3.847  -7.923  -2.394
  119    H    SER  15           H        SER  15  -3.662 -12.292  -1.858
  120    HA   SER  15           HA       SER  15  -3.615 -14.159   0.161
  121   1HB   SER  15          2HB       SER  15  -2.361 -14.063  -2.558
  122   2HB   SER  15          1HB       SER  15  -2.028 -15.426  -1.489
  123    HG   SER  15           HG       SER  15  -3.997 -15.351  -3.035
  124    H    SER  16           H        SER  16  -2.155 -15.010   1.532
  125    HA   SER  16           HA       SER  16  -0.249 -15.313   2.731
  126   1HB   SER  16          2HB       SER  16   0.853 -15.362   0.465
  127   2HB   SER  16          1HB       SER  16   1.216 -13.651   0.688
  128    HG   SER  16           HG       SER  16   2.239 -14.363   2.722
  129    H    LEU  17           H        LEU  17  -1.778 -12.442   2.330
  130    HA   LEU  17           HA       LEU  17   0.089 -10.844   3.888
  131   1HB   LEU  17          2HB       LEU  17  -1.613 -10.149   1.931
  132   2HB   LEU  17          1HB       LEU  17  -2.664  -9.885   3.303
  133    HG   LEU  17           HG       LEU  17  -0.675  -8.155   2.223
  134   1HD1  LEU  17          1HD1      LEU  17  -2.498  -7.007   2.839
  135   2HD1  LEU  17          2HD1      LEU  17  -1.640  -6.850   4.371
  136   3HD1  LEU  17          3HD1      LEU  17  -2.871  -8.098   4.172
  137   1HD2  LEU  17          1HD2      LEU  17   0.378  -7.525   4.462
  138   2HD2  LEU  17          2HD2      LEU  17   1.030  -8.936   3.630
  139   3HD2  LEU  17          3HD2      LEU  17  -0.068  -9.146   4.994
  140    H    SER  18           H        SER  18  -3.359 -11.736   4.184
  141    HA   SER  18           HA       SER  18  -3.860 -10.876   6.721
  142   1HB   SER  18          2HB       SER  18  -5.471 -11.993   5.090
  143   2HB   SER  18          1HB       SER  18  -4.890 -13.533   5.723
  144    HG   SER  18           HG       SER  18  -6.830 -12.283   6.708
  145    H    ALA  19           H        ALA  19  -2.429 -14.009   5.839
  146    HA   ALA  19           HA       ALA  19  -2.252 -15.063   8.432
  147   1HB   ALA  19          1HB       ALA  19  -1.891 -16.364   6.361
  148   2HB   ALA  19          2HB       ALA  19  -0.587 -16.574   7.529
  149   3HB   ALA  19          3HB       ALA  19  -0.356 -15.527   6.130
  150    H    ILE  20           H        ILE  20  -0.225 -12.875   6.634
  151    HA   ILE  20           HA       ILE  20   1.934 -12.858   8.512
  152    HB   ILE  20           HB       ILE  20   1.246 -11.199   6.106
  153   1HG1  ILE  20          2HG1      ILE  20   3.734 -12.788   6.674
  154   2HG1  ILE  20          1HG1      ILE  20   2.279 -13.532   6.017
  155   1HG2  ILE  20          1HG2      ILE  20   3.115 -10.515   8.282
  156   2HG2  ILE  20          2HG2      ILE  20   2.283  -9.474   7.127
  157   3HG2  ILE  20          3HG2      ILE  20   3.735 -10.347   6.640
  158   1HD1  ILE  20          1HD1      ILE  20   4.277 -11.849   4.723
  159   2HD1  ILE  20          2HD1      ILE  20   2.609 -11.410   4.362
  160   3HD1  ILE  20          3HD1      ILE  20   3.178 -13.047   4.039
  161    H    LEU  21           H        LEU  21  -0.285 -10.196   7.548
  162    HA   LEU  21           HA       LEU  21   0.392  -8.590   9.687
  163   1HB   LEU  21          2HB       LEU  21  -1.395  -7.159   9.150
  164   2HB   LEU  21          1HB       LEU  21  -0.746  -7.786   7.658
  165    HG   LEU  21           HG       LEU  21  -3.410  -7.699   8.465
  166   1HD1  LEU  21          1HD1      LEU  21  -2.010  -9.122   6.218
  167   2HD1  LEU  21          2HD1      LEU  21  -2.756  -7.524   6.191
  168   3HD1  LEU  21          3HD1      LEU  21  -3.763  -8.965   6.332
  169   1HD2  LEU  21          1HD2      LEU  21  -3.990 -10.118   8.313
  170   2HD2  LEU  21          2HD2      LEU  21  -3.217  -9.612   9.809
  171   3HD2  LEU  21          3HD2      LEU  21  -2.284 -10.459   8.577
  172    H    GLU  22           H        GLU  22  -1.250 -11.464   9.858
  173    HA   GLU  22           HA       GLU  22  -2.789 -10.767  12.219
  174   1HB   GLU  22          2HB       GLU  22  -2.557 -13.161  10.465
  175   2HB   GLU  22          1HB       GLU  22  -3.108 -13.388  12.118
  176   1HG   GLU  22          2HG       GLU  22  -4.837 -11.605  11.643
  177   2HG   GLU  22          1HG       GLU  22  -4.389 -11.765   9.946
  178    H    GLU  23           H        GLU  23   0.222 -12.269  11.324
  179    HA   GLU  23           HA       GLU  23   0.692 -13.424  13.921
  180   1HB   GLU  23          2HB       GLU  23   1.682 -14.598  12.123
  181   2HB   GLU  23          1HB       GLU  23   2.326 -13.128  11.409
  182   1HG   GLU  23          2HG       GLU  23   4.206 -13.266  12.573
  183   2HG   GLU  23          1HG       GLU  23   3.345 -13.577  14.079
  184    H    GLU  24           H        GLU  24   1.590 -10.540  12.136
  185    HA   GLU  24           HA       GLU  24   3.460  -9.614  14.102
  186   1HB   GLU  24          2HB       GLU  24   2.291  -8.527  11.591
  187   2HB   GLU  24          1HB       GLU  24   3.042  -7.409  12.721
  188   1HG   GLU  24          2HG       GLU  24   4.407  -9.839  11.595
  189   2HG   GLU  24          1HG       GLU  24   4.540  -8.218  10.916
  190    H    GLY  25           H        GLY  25   0.060  -9.180  13.442
  191   1HA   GLY  25          2HA       GLY  25  -1.521  -8.526  15.068
  192   2HA   GLY  25          1HA       GLY  25  -0.223  -7.772  15.984
  193    H    TYR  26           H        TYR  26  -1.042  -7.421  12.575
  194    HA   TYR  26           HA       TYR  26  -1.112  -4.525  12.917
  195   1HB   TYR  26          2HB       TYR  26  -0.705  -6.387  10.623
  196   2HB   TYR  26          1HB       TYR  26  -1.267  -4.756  10.292
  197    HD1  TYR  26           1HD      TYR  26   0.403  -3.329   9.633
  198    HD2  TYR  26           2HD      TYR  26   1.298  -6.306  12.535
  199    HE1  TYR  26           1HE      TYR  26   2.713  -2.505   9.756
  200    HE2  TYR  26           2HE      TYR  26   3.613  -5.489  12.666
  201    HH   TYR  26           HH       TYR  26   4.635  -2.714  11.858
  202    H    HIS  27           H        HIS  27  -2.643  -3.693  10.868
  203    HA   HIS  27           HA       HIS  27  -5.279  -4.915  11.114
  204   1HB   HIS  27          2HB       HIS  27  -4.596  -2.770  12.722
  205   2HB   HIS  27          1HB       HIS  27  -5.419  -2.005  11.367
  206    HD1  HIS  27           1HD      HIS  27  -7.418  -1.388  12.908
  207    HD2  HIS  27           2HD      HIS  27  -6.738  -5.470  12.527
  208    HE1  HIS  27           1HE      HIS  27  -9.477  -2.502  13.829
  209    HE2  HIS  27           2HE      HIS  27  -9.079  -4.969  13.506
  210    HA   PRO  28           HA       PRO  28  -4.577  -3.469   6.842
  211   1HB   PRO  28          2HB       PRO  28  -5.715  -5.563   5.600
  212   2HB   PRO  28          1HB       PRO  28  -4.074  -5.639   6.250
  213   1HG   PRO  28          2HG       PRO  28  -6.609  -6.736   7.372
  214   2HG   PRO  28          1HG       PRO  28  -4.983  -7.434   7.384
  215   1HD   PRO  28          2HD       PRO  28  -6.154  -6.106   9.515
  216   2HD   PRO  28          1HD       PRO  28  -4.409  -6.335   9.299
  217    H    ASP  29           H        ASP  29  -5.975  -2.442   5.444
  218    HA   ASP  29           HA       ASP  29  -8.791  -2.520   6.217
  219   1HB   ASP  29          2HB       ASP  29  -7.305  -0.356   6.511
  220   2HB   ASP  29          1HB       ASP  29  -7.767  -0.124   4.827
  221    H    THR  30           H        THR  30  -6.771  -3.302   3.808
  222    HA   THR  30           HA       THR  30  -6.927  -3.426   1.508
  223    HB   THR  30           HB       THR  30  -8.175  -5.353   0.978
  224    HG1  THR  30           1HG      THR  30  -9.972  -5.973   2.047
  225   1HG2  THR  30          1HG2      THR  30  -7.266  -6.818   2.408
  226   2HG2  THR  30          2HG2      THR  30  -7.949  -6.025   3.825
  227   3HG2  THR  30          3HG2      THR  30  -6.487  -5.385   3.077
  228    H    ALA  31           H        ALA  31  -7.590  -2.308  -0.173
  229    HA   ALA  31           HA       ALA  31 -10.417  -1.612  -0.454
  230   1HB   ALA  31          1HB       ALA  31  -9.266   0.298   0.661
  231   2HB   ALA  31          2HB       ALA  31  -9.982   0.703  -0.899
  232   3HB   ALA  31          3HB       ALA  31  -8.242   0.452  -0.766
  233    H    LYS  32           H        LYS  32 -11.113  -1.502  -2.583
  234    HA   LYS  32           HA       LYS  32  -9.643  -2.878  -4.533
  235   1HB   LYS  32          2HB       LYS  32 -11.909  -0.926  -5.006
  236   2HB   LYS  32          1HB       LYS  32 -11.376  -2.194  -6.101
  237   1HG   LYS  32          2HG       LYS  32 -11.967  -3.842  -4.285
  238   2HG   LYS  32          1HG       LYS  32 -12.751  -2.499  -3.451
  239   1HD   LYS  32          2HD       LYS  32 -13.411  -3.111  -6.309
  240   2HD   LYS  32          1HD       LYS  32 -14.161  -4.029  -5.001
  241   1HE   LYS  32          2HE       LYS  32 -14.748  -1.731  -4.008
  242   2HE   LYS  32          1HE       LYS  32 -14.379  -1.101  -5.613
  243   1HZ   LYS  32          1HZ       LYS  32 -16.655  -1.505  -5.651
  244   2HZ   LYS  32          2HZ       LYS  32 -16.523  -2.973  -4.822
  245   3HZ   LYS  32          3HZ       LYS  32 -16.008  -2.858  -6.431
  246    H    THR  33           H        THR  33  -9.815  -1.400  -6.889
  247    HA   THR  33           HA       THR  33  -7.390  -0.206  -7.070
  248    HB   THR  33           HB       THR  33  -8.051   0.684  -9.168
  249    HG1  THR  33           1HG      THR  33 -10.752   0.470  -8.345
  250   1HG2  THR  33          1HG2      THR  33  -8.804  -1.929  -8.480
  251   2HG2  THR  33          2HG2      THR  33  -8.450  -1.283 -10.082
  252   3HG2  THR  33          3HG2      THR  33 -10.104  -1.269  -9.471
  253    H    LEU  34           H        LEU  34  -6.904   2.069  -7.676
  254    HA   LEU  34           HA       LEU  34  -6.925   3.764  -5.591
  255   1HB   LEU  34          2HB       LEU  34  -7.155   4.793  -8.409
  256   2HB   LEU  34          1HB       LEU  34  -6.304   5.526  -7.062
  257    HG   LEU  34           HG       LEU  34  -5.507   2.946  -8.416
  258   1HD1  LEU  34          1HD1      LEU  34  -3.479   4.652  -8.874
  259   2HD1  LEU  34          2HD1      LEU  34  -4.846   5.764  -8.933
  260   3HD1  LEU  34          3HD1      LEU  34  -4.801   4.364 -10.005
  261   1HD2  LEU  34          1HD2      LEU  34  -4.671   2.733  -6.277
  262   2HD2  LEU  34          2HD2      LEU  34  -4.440   4.470  -6.079
  263   3HD2  LEU  34          3HD2      LEU  34  -3.342   3.545  -7.102
  264    H    ARG  35           H        ARG  35  -9.568   3.348  -7.853
  265    HA   ARG  35           HA       ARG  35 -11.032   5.659  -7.277
  266   1HB   ARG  35          2HB       ARG  35 -11.435   3.613  -8.948
  267   2HB   ARG  35          1HB       ARG  35 -12.507   3.098  -7.653
  268   1HG   ARG  35          2HG       ARG  35 -14.020   4.331  -8.753
  269   2HG   ARG  35          1HG       ARG  35 -13.254   5.679  -7.911
  270   1HD   ARG  35          2HD       ARG  35 -11.677   5.275 -10.164
  271   2HD   ARG  35          1HD       ARG  35 -13.330   5.064 -10.739
  272    HE   ARG  35           HE       ARG  35 -12.094   7.505  -9.881
  273   1HH1  ARG  35          1HH1      ARG  35 -15.133   5.829 -10.245
  274   2HH1  ARG  35          2HH1      ARG  35 -16.066   7.284 -10.343
  275   1HH2  ARG  35          1HH2      ARG  35 -13.320   9.420 -10.009
  276   2HH2  ARG  35          2HH2      ARG  35 -15.038   9.323 -10.208
  277    H    GLU  36           H        GLU  36 -11.605   2.406  -5.945
  278    HA   GLU  36           HA       GLU  36 -13.245   3.298  -3.831
  279   1HB   GLU  36          2HB       GLU  36 -12.720   0.877  -4.902
  280   2HB   GLU  36          1HB       GLU  36 -11.723   0.784  -3.457
  281   1HG   GLU  36          2HG       GLU  36 -13.806  -0.156  -2.894
  282   2HG   GLU  36          1HG       GLU  36 -13.761   1.436  -2.139
  283    H    ALA  37           H        ALA  37  -9.778   2.810  -4.143
  284    HA   ALA  37           HA       ALA  37  -9.142   2.940  -1.390
  285   1HB   ALA  37          1HB       ALA  37  -6.926   3.959  -2.649
  286   2HB   ALA  37          2HB       ALA  37  -7.681   2.998  -3.920
  287   3HB   ALA  37          3HB       ALA  37  -7.255   2.248  -2.382
  288    H    GLU  38           H        GLU  38  -8.733   5.463  -3.893
  289    HA   GLU  38           HA       GLU  38  -8.054   7.580  -2.330
  290   1HB   GLU  38          2HB       GLU  38  -9.582   7.333  -4.856
  291   2HB   GLU  38          1HB       GLU  38  -9.649   8.884  -4.030
  292   1HG   GLU  38          2HG       GLU  38  -7.062   8.652  -3.964
  293   2HG   GLU  38          1HG       GLU  38  -7.321   7.501  -5.274
  294    H    LYS  39           H        LYS  39 -11.317   6.327  -2.866
  295    HA   LYS  39           HA       LYS  39 -12.683   8.316  -1.415
  296   1HB   LYS  39          2HB       LYS  39 -13.762   6.638  -2.912
  297   2HB   LYS  39          1HB       LYS  39 -13.445   5.406  -1.699
  298   1HG   LYS  39          2HG       LYS  39 -14.906   7.815  -0.804
  299   2HG   LYS  39          1HG       LYS  39 -15.762   6.705  -1.876
  300   1HD   LYS  39          2HD       LYS  39 -15.254   4.853  -0.344
  301   2HD   LYS  39          1HD       LYS  39 -14.430   5.983   0.734
  302   1HE   LYS  39          2HE       LYS  39 -16.367   6.872   1.507
  303   2HE   LYS  39          1HE       LYS  39 -17.196   6.677  -0.037
  304   1HZ   LYS  39          1HZ       LYS  39 -16.755   4.647   2.068
  305   2HZ   LYS  39          2HZ       LYS  39 -17.185   4.217   0.490
  306   3HZ   LYS  39          3HZ       LYS  39 -18.222   5.181   1.415
  307    H    LYS  40           H        LYS  40 -11.516   5.104  -0.442
  308    HA   LYS  40           HA       LYS  40 -12.220   5.316   2.271
  309   1HB   LYS  40          2HB       LYS  40 -10.121   3.653   0.888
  310   2HB   LYS  40          1HB       LYS  40 -10.528   3.483   2.590
  311   1HG   LYS  40          2HG       LYS  40 -12.376   3.040   0.256
  312   2HG   LYS  40          1HG       LYS  40 -11.665   1.800   1.290
  313   1HD   LYS  40          2HD       LYS  40 -12.841   3.302   3.166
  314   2HD   LYS  40          1HD       LYS  40 -13.914   3.653   1.810
  315   1HE   LYS  40          2HE       LYS  40 -14.764   1.563   1.772
  316   2HE   LYS  40          1HE       LYS  40 -13.219   0.816   2.177
  317   1HZ   LYS  40          1HZ       LYS  40 -15.054   2.176   4.078
  318   2HZ   LYS  40          2HZ       LYS  40 -13.551   1.511   4.482
  319   3HZ   LYS  40          3HZ       LYS  40 -14.805   0.506   3.954
  320    H    ILE  41           H        ILE  41  -9.350   6.340   0.508
  321    HA   ILE  41           HA       ILE  41  -7.960   7.043   2.964
  322    HB   ILE  41           HB       ILE  41  -7.102   7.607   0.133
  323   1HG1  ILE  41          2HG1      ILE  41  -5.988   5.330   1.706
  324   2HG1  ILE  41          1HG1      ILE  41  -7.562   5.117   0.948
  325   1HG2  ILE  41          1HG2      ILE  41  -5.700   7.632   2.786
  326   2HG2  ILE  41          2HG2      ILE  41  -5.827   8.926   1.595
  327   3HG2  ILE  41          3HG2      ILE  41  -4.821   7.516   1.262
  328   1HD1  ILE  41          1HD1      ILE  41  -6.027   4.284  -0.594
  329   2HD1  ILE  41          2HD1      ILE  41  -4.916   5.631  -0.354
  330   3HD1  ILE  41          3HD1      ILE  41  -6.441   5.887  -1.202
  331    H    LYS  42           H        LYS  42 -10.224   8.508   0.950
  332    HA   LYS  42           HA       LYS  42  -9.363  11.144   0.775
  333   1HB   LYS  42          2HB       LYS  42 -11.514   9.866  -0.113
  334   2HB   LYS  42          1HB       LYS  42 -12.238  10.647   1.286
  335   1HG   LYS  42          2HG       LYS  42 -11.146  12.796   0.338
  336   2HG   LYS  42          1HG       LYS  42 -11.057  11.876  -1.165
  337   1HD   LYS  42          2HD       LYS  42 -13.141  12.602  -1.540
  338   2HD   LYS  42          1HD       LYS  42 -13.634  11.419  -0.326
  339   1HE   LYS  42          2HE       LYS  42 -13.278  13.210   1.406
  340   2HE   LYS  42          1HE       LYS  42 -13.077  14.351   0.076
  341   1HZ   LYS  42          1HZ       LYS  42 -15.495  12.890   0.910
  342   2HZ   LYS  42          2HZ       LYS  42 -15.342  13.433  -0.685
  343   3HZ   LYS  42          3HZ       LYS  42 -15.303  14.540   0.591
  344    H    GLU  43           H        GLU  43 -10.345   9.366   3.538
  345    HA   GLU  43           HA       GLU  43 -10.216  11.823   5.129
  346   1HB   GLU  43          2HB       GLU  43 -12.205   9.600   5.611
  347   2HB   GLU  43          1HB       GLU  43 -12.049  11.086   6.539
  348   1HG   GLU  43          2HG       GLU  43 -12.699  12.380   4.568
  349   2HG   GLU  43          1HG       GLU  43 -12.868  10.886   3.648
  350    H    LEU  44           H        LEU  44 -10.172   8.273   5.221
  351    HA   LEU  44           HA       LEU  44  -9.063   7.971   7.763
  352   1HB   LEU  44          2HB       LEU  44  -9.828   6.293   5.694
  353   2HB   LEU  44          1HB       LEU  44  -8.109   5.988   5.854
  354    HG   LEU  44           HG       LEU  44  -9.392   4.411   7.189
  355   1HD1  LEU  44          1HD1      LEU  44  -8.291   4.756   9.341
  356   2HD1  LEU  44          2HD1      LEU  44  -7.926   6.422   8.891
  357   3HD1  LEU  44          3HD1      LEU  44  -7.195   5.087   7.999
  358   1HD2  LEU  44          1HD2      LEU  44 -10.898   5.010   8.867
  359   2HD2  LEU  44          2HD2      LEU  44 -11.287   6.104   7.539
  360   3HD2  LEU  44          3HD2      LEU  44 -10.334   6.681   8.906
  361    H    PHE  45           H        PHE  45  -7.132   8.428   8.575
  362    HA   PHE  45           HA       PHE  45  -5.023   9.363   6.824
  363   1HB   PHE  45          2HB       PHE  45  -5.624  10.510   8.978
  364   2HB   PHE  45          1HB       PHE  45  -4.984   9.113   9.837
  365    HD1  PHE  45           1HD      PHE  45  -3.906  11.428   7.112
  366    HD2  PHE  45           2HD      PHE  45  -2.859   9.314  10.653
  367    HE1  PHE  45           1HE      PHE  45  -1.655  12.417   7.032
  368    HE2  PHE  45           2HE      PHE  45  -0.605  10.299  10.581
  369    HZ   PHE  45           HZ       PHE  45  -0.001  11.853   8.768
  370    H    PHE  46           H        PHE  46  -4.835   7.157   5.860
  371    HA   PHE  46           HA       PHE  46  -3.811   4.981   7.335
  372   1HB   PHE  46          2HB       PHE  46  -3.923   5.682   4.425
  373   2HB   PHE  46          1HB       PHE  46  -2.976   4.295   4.950
  374    HD1  PHE  46           1HD      PHE  46  -6.033   5.229   3.690
  375    HD2  PHE  46           2HD      PHE  46  -4.347   2.774   6.730
  376    HE1  PHE  46           1HE      PHE  46  -8.071   3.851   3.701
  377    HE2  PHE  46           2HE      PHE  46  -6.383   1.390   6.746
  378    HZ   PHE  46           HZ       PHE  46  -8.248   1.931   5.232
  379    HA   PRO  47           HA       PRO  47   0.379   6.513   7.735
  380   1HB   PRO  47          2HB       PRO  47   1.380   4.492   9.181
  381   2HB   PRO  47          1HB       PRO  47   0.226   5.638   9.876
  382   1HG   PRO  47          2HG       PRO  47  -0.242   2.872   8.840
  383   2HG   PRO  47          1HG       PRO  47  -0.895   3.648  10.293
  384   1HD   PRO  47          2HD       PRO  47  -2.267   3.405   7.921
  385   2HD   PRO  47          1HD       PRO  47  -2.588   4.659   9.134
  386    H    VAL  48           H        VAL  48  -0.489   3.363   6.485
  387    HA   VAL  48           HA       VAL  48   1.818   3.456   4.689
  388    HB   VAL  48           HB       VAL  48   1.038   0.851   5.958
  389   1HG1  VAL  48          1HG1      VAL  48   2.691   1.480   3.862
  390   2HG1  VAL  48          2HG1      VAL  48   2.761  -0.003   4.814
  391   3HG1  VAL  48          3HG1      VAL  48   3.816   1.352   5.214
  392   1HG2  VAL  48          1HG2      VAL  48   1.593   2.040   7.872
  393   2HG2  VAL  48          2HG2      VAL  48   2.833   2.982   7.046
  394   3HG2  VAL  48          3HG2      VAL  48   3.117   1.281   7.411
  395    H    ILE  49           H        ILE  49   1.338   2.924   2.661
  396    HA   ILE  49           HA       ILE  49  -1.270   1.660   2.132
  397    HB   ILE  49           HB       ILE  49   0.135   3.534   0.238
  398   1HG1  ILE  49          2HG1      ILE  49  -0.352   4.762   2.303
  399   2HG1  ILE  49          1HG1      ILE  49  -1.412   5.290   1.001
  400   1HG2  ILE  49          1HG2      ILE  49  -2.760   2.716   0.401
  401   2HG2  ILE  49          2HG2      ILE  49  -1.567   1.946  -0.644
  402   3HG2  ILE  49          3HG2      ILE  49  -1.979   3.644  -0.880
  403   1HD1  ILE  49          1HD1      ILE  49  -2.090   3.536   3.337
  404   2HD1  ILE  49          2HD1      ILE  49  -3.147   3.730   1.938
  405   3HD1  ILE  49          3HD1      ILE  49  -2.740   5.126   2.938
  406    H    VAL  50           H        VAL  50  -1.411   0.179   0.439
  407    HA   VAL  50           HA       VAL  50   1.102  -0.657  -0.818
  408    HB   VAL  50           HB       VAL  50  -0.831  -2.580   0.486
  409   1HG1  VAL  50          1HG1      VAL  50   1.807  -3.552  -0.300
  410   2HG1  VAL  50          2HG1      VAL  50   0.818  -3.034  -1.665
  411   3HG1  VAL  50          3HG1      VAL  50   0.214  -4.264  -0.556
  412   1HG2  VAL  50          1HG2      VAL  50   1.035  -3.039   2.029
  413   2HG2  VAL  50          2HG2      VAL  50   0.450  -1.380   2.150
  414   3HG2  VAL  50          3HG2      VAL  50   1.947  -1.725   1.286
  415    H    LEU  51           H        LEU  51   0.656  -0.196  -2.866
  416    HA   LEU  51           HA       LEU  51  -1.979  -0.862  -3.949
  417   1HB   LEU  51          2HB       LEU  51  -1.266   1.388  -4.387
  418   2HB   LEU  51          1HB       LEU  51   0.269   0.831  -5.026
  419    HG   LEU  51           HG       LEU  51  -1.068  -0.319  -6.863
  420   1HD1  LEU  51          1HD1      LEU  51  -3.271  -0.391  -6.510
  421   2HD1  LEU  51          2HD1      LEU  51  -3.277   1.290  -7.044
  422   3HD1  LEU  51          3HD1      LEU  51  -3.216   0.910  -5.322
  423   1HD2  LEU  51          1HD2      LEU  51  -0.624   2.587  -6.501
  424   2HD2  LEU  51          2HD2      LEU  51  -1.612   2.084  -7.873
  425   3HD2  LEU  51          3HD2      LEU  51   0.035   1.477  -7.703
  426    H    ASP  52           H        ASP  52  -1.954  -3.003  -4.385
  427    HA   ASP  52           HA       ASP  52   0.260  -4.238  -5.785
  428   1HB   ASP  52          2HB       ASP  52  -1.920  -5.141  -4.173
  429   2HB   ASP  52          1HB       ASP  52  -2.032  -5.939  -5.737
  430    H    VAL  53           H        VAL  53   0.347  -3.255  -7.784
  431    HA   VAL  53           HA       VAL  53  -1.864  -2.738  -9.441
  432    HB   VAL  53           HB       VAL  53  -0.218  -2.485 -11.264
  433   1HG1  VAL  53          1HG1      VAL  53  -0.331  -0.487 -10.209
  434   2HG1  VAL  53          2HG1      VAL  53   1.336  -0.881  -9.792
  435   3HG1  VAL  53          3HG1      VAL  53   0.043  -1.175  -8.629
  436   1HG2  VAL  53          1HG2      VAL  53   1.867  -3.315 -11.221
  437   2HG2  VAL  53          2HG2      VAL  53   1.254  -4.364  -9.943
  438   3HG2  VAL  53          3HG2      VAL  53   2.109  -2.879  -9.529
  439    H    TRP  54           H        TRP  54  -2.989  -4.841  -9.128
  440    HA   TRP  54           HA       TRP  54  -1.915  -7.129 -10.528
  441   1HB   TRP  54          2HB       TRP  54  -3.241  -7.536  -8.544
  442   2HB   TRP  54          1HB       TRP  54  -4.597  -6.639  -9.216
  443    HD1  TRP  54           HD       TRP  54  -6.442  -8.315  -9.778
  444    HE1  TRP  54           1HE      TRP  54  -6.560 -10.619 -10.915
  445    HE3  TRP  54           3HE      TRP  54  -1.447  -9.109 -10.527
  446    HZ2  TRP  54           2HZ      TRP  54  -4.773 -12.524 -11.989
  447    HZ3  TRP  54           3HZ      TRP  54  -0.735 -11.198 -11.617
  448    HH2  TRP  54           HH       TRP  54  -2.366 -12.869 -12.331
  449    H    MET  55           H        MET  55  -5.187  -5.808 -10.875
  450    HA   MET  55           HA       MET  55  -4.751  -5.368 -13.722
  451   1HB   MET  55          2HB       MET  55  -6.966  -7.167 -12.723
  452   2HB   MET  55          1HB       MET  55  -6.637  -6.739 -14.397
  453   1HG   MET  55          2HG       MET  55  -4.717  -8.251 -12.646
  454   2HG   MET  55          1HG       MET  55  -5.882  -9.014 -13.725
  455   1HE   MET  55          1HE       MET  55  -3.082  -9.668 -13.599
  456   2HE   MET  55          2HE       MET  55  -2.054  -9.183 -14.947
  457   3HE   MET  55          3HE       MET  55  -3.433 -10.245 -15.229
  458    HA   PRO  56           HA       PRO  56  -7.780  -2.427 -11.784
  459   1HB   PRO  56          2HB       PRO  56  -6.018  -0.283 -11.529
  460   2HB   PRO  56          1HB       PRO  56  -6.483  -1.389 -10.239
  461   1HG   PRO  56          2HG       PRO  56  -3.927  -1.107 -11.447
  462   2HG   PRO  56          1HG       PRO  56  -4.418  -2.284 -10.223
  463   1HD   PRO  56          2HD       PRO  56  -4.133  -2.610 -13.151
  464   2HD   PRO  56          1HD       PRO  56  -4.022  -3.822 -11.860
  465    H    ASP  57           H        ASP  57  -7.548   0.268 -12.454
  466    HA   ASP  57           HA       ASP  57  -7.015   0.480 -15.290
  467   1HB   ASP  57          2HB       ASP  57  -9.330   1.248 -15.813
  468   2HB   ASP  57          1HB       ASP  57  -9.239  -0.455 -15.378
  469    H    GLY  58           H        GLY  58  -6.203   1.738 -12.699
  470   1HA   GLY  58          2HA       GLY  58  -6.744   4.521 -13.508
  471   2HA   GLY  58          1HA       GLY  58  -6.854   4.043 -11.821
  472    H    ASP  59           H        ASP  59  -4.408   2.356 -13.439
  473    HA   ASP  59           HA       ASP  59  -2.140   2.392 -13.246
  474   1HB   ASP  59          2HB       ASP  59  -2.375   5.404 -13.325
  475   2HB   ASP  59          1HB       ASP  59  -1.034   4.408 -13.885
  476    H    GLY  60           H        GLY  60  -0.483   4.414 -11.987
  477   1HA   GLY  60          2HA       GLY  60  -1.436   4.831  -9.316
  478   2HA   GLY  60          1HA       GLY  60  -0.305   3.494  -9.413
  479    H    VAL  61           H        VAL  61   0.094   6.141 -11.612
  480    HA   VAL  61           HA       VAL  61   2.630   6.788 -10.390
  481    HB   VAL  61           HB       VAL  61   1.380   8.009 -12.848
  482   1HG1  VAL  61          1HG1      VAL  61   4.026   8.117 -11.535
  483   2HG1  VAL  61          2HG1      VAL  61   3.145   9.360 -12.423
  484   3HG1  VAL  61          3HG1      VAL  61   3.992   8.086 -13.299
  485   1HG2  VAL  61          1HG2      VAL  61   3.128   5.561 -12.610
  486   2HG2  VAL  61          2HG2      VAL  61   2.741   6.378 -14.125
  487   3HG2  VAL  61          3HG2      VAL  61   1.459   5.620 -13.178
  488    H    ASN  62           H        ASN  62  -0.412   8.419 -11.201
  489    HA   ASN  62           HA       ASN  62   0.416  10.873  -9.927
  490   1HB   ASN  62          2HB       ASN  62  -1.532  10.142 -11.833
  491   2HB   ASN  62          1HB       ASN  62  -2.415  10.764 -10.442
  492   1HD2  ASN  62          1HD2      ASN  62   0.418  11.521 -12.434
  493   2HD2  ASN  62          2HD2      ASN  62   0.153  13.228 -12.465
  494    H    PHE  63           H        PHE  63  -0.569   7.980  -8.717
  495    HA   PHE  63           HA       PHE  63  -2.443   8.865  -6.737
  496   1HB   PHE  63          2HB       PHE  63  -2.218   6.498  -7.671
  497   2HB   PHE  63          1HB       PHE  63  -0.813   6.329  -6.624
  498    HD1  PHE  63           1HD      PHE  63  -4.071   8.006  -5.977
  499    HD2  PHE  63           2HD      PHE  63  -1.442   4.806  -4.994
  500    HE1  PHE  63           1HE      PHE  63  -5.551   7.364  -4.122
  501    HE2  PHE  63           2HE      PHE  63  -2.921   4.158  -3.138
  502    HZ   PHE  63           HZ       PHE  63  -4.980   5.438  -2.701
  503    H    ILE  64           H        ILE  64   1.024   8.165  -6.800
  504    HA   ILE  64           HA       ILE  64   1.731   8.209  -4.176
  505    HB   ILE  64           HB       ILE  64   3.242   9.776  -6.263
  506   1HG1  ILE  64          2HG1      ILE  64   4.217   7.091  -5.853
  507   2HG1  ILE  64          1HG1      ILE  64   2.532   7.049  -6.357
  508   1HG2  ILE  64          1HG2      ILE  64   4.963   9.843  -4.829
  509   2HG2  ILE  64          2HG2      ILE  64   4.689   8.195  -4.268
  510   3HG2  ILE  64          3HG2      ILE  64   3.741   9.524  -3.598
  511   1HD1  ILE  64          1HD1      ILE  64   4.901   7.618  -7.892
  512   2HD1  ILE  64          2HD1      ILE  64   3.712   8.910  -8.037
  513   3HD1  ILE  64          3HD1      ILE  64   3.265   7.251  -8.436
  514    H    ASP  65           H        ASP  65   0.879  11.000  -6.157
  515    HA   ASP  65           HA       ASP  65   1.576  12.967  -4.245
  516   1HB   ASP  65          2HB       ASP  65   1.181  13.377  -6.704
  517   2HB   ASP  65          1HB       ASP  65  -0.544  13.208  -6.391
  518    H    PHE  66           H        PHE  66  -1.573  11.506  -5.090
  519    HA   PHE  66           HA       PHE  66  -3.139  12.835  -3.235
  520   1HB   PHE  66          2HB       PHE  66  -4.265  11.522  -4.841
  521   2HB   PHE  66          1HB       PHE  66  -3.319  10.089  -4.460
  522    HD1  PHE  66           1HD      PHE  66  -3.978   8.599  -2.745
  523    HD2  PHE  66           2HD      PHE  66  -6.045  12.276  -3.296
  524    HE1  PHE  66           1HE      PHE  66  -5.757   7.818  -1.239
  525    HE2  PHE  66           2HE      PHE  66  -7.831  11.504  -1.790
  526    HZ   PHE  66           HZ       PHE  66  -7.688   9.271  -0.758
  527    H    ILE  67           H        ILE  67  -0.842  10.261  -2.806
  528    HA   ILE  67           HA       ILE  67  -1.693   9.402  -0.237
  529    HB   ILE  67           HB       ILE  67   1.176   9.266  -1.091
  530   1HG1  ILE  67          2HG1      ILE  67   0.157   8.582  -3.109
  531   2HG1  ILE  67          1HG1      ILE  67   0.550   7.092  -2.267
  532   1HG2  ILE  67          1HG2      ILE  67   1.105   8.189   0.878
  533   2HG2  ILE  67          2HG2      ILE  67   0.537   6.844  -0.113
  534   3HG2  ILE  67          3HG2      ILE  67  -0.622   7.851   0.756
  535   1HD1  ILE  67          1HD1      ILE  67  -1.742   7.348  -3.433
  536   2HD1  ILE  67          2HD1      ILE  67  -2.176   8.276  -1.998
  537   3HD1  ILE  67          3HD1      ILE  67  -1.659   6.598  -1.839
  538    H    LYS  68           H        LYS  68   0.985  11.520  -1.274
  539    HA   LYS  68           HA       LYS  68   1.602  12.355   1.385
  540   1HB   LYS  68          2HB       LYS  68   2.328  13.770  -1.184
  541   2HB   LYS  68          1HB       LYS  68   3.149  13.888   0.368
  542   1HG   LYS  68          2HG       LYS  68   3.490  11.316   0.047
  543   2HG   LYS  68          1HG       LYS  68   3.215  11.702  -1.653
  544   1HD   LYS  68          2HD       LYS  68   5.080  13.513  -0.305
  545   2HD   LYS  68          1HD       LYS  68   5.628  11.837  -0.369
  546   1HE   LYS  68          2HE       LYS  68   6.442  12.960  -2.318
  547   2HE   LYS  68          1HE       LYS  68   5.165  11.851  -2.818
  548   1HZ   LYS  68          1HZ       LYS  68   3.822  13.534  -3.431
  549   2HZ   LYS  68          2HZ       LYS  68   5.273  14.390  -3.578
  550   3HZ   LYS  68          3HZ       LYS  68   4.328  14.562  -2.186
  551    H    GLU  69           H        GLU  69  -0.688  13.329  -0.977
  552    HA   GLU  69           HA       GLU  69  -1.100  16.010  -0.246
  553   1HB   GLU  69          2HB       GLU  69  -1.981  14.856  -2.304
  554   2HB   GLU  69          1HB       GLU  69  -3.196  14.106  -1.279
  555   1HG   GLU  69          2HG       GLU  69  -4.104  16.269  -0.707
  556   2HG   GLU  69          1HG       GLU  69  -2.835  17.073  -1.631
  557    H    ASN  70           H        ASN  70  -2.842  13.069   0.730
  558    HA   ASN  70           HA       ASN  70  -3.871  14.547   3.059
  559   1HB   ASN  70          2HB       ASN  70  -5.062  11.994   1.996
  560   2HB   ASN  70          1HB       ASN  70  -5.811  13.209   3.026
  561   1HD2  ASN  70          1HD2      ASN  70  -4.482  12.714  -0.210
  562   2HD2  ASN  70          2HD2      ASN  70  -5.546  13.814  -1.010
  563    H    SER  71           H        SER  71  -1.302  12.915   2.591
  564    HA   SER  71           HA       SER  71  -1.246  11.739   5.195
  565   1HB   SER  71          2HB       SER  71  -1.861  10.046   2.921
  566   2HB   SER  71          1HB       SER  71  -0.364   9.539   3.701
  567    HG   SER  71           HG       SER  71  -2.516   8.725   4.518
  568    HA   PRO  72           HA       PRO  72   2.769  13.272   3.368
  569   1HB   PRO  72          2HB       PRO  72   2.899  14.952   5.751
  570   2HB   PRO  72          1HB       PRO  72   2.972  15.424   4.053
  571   1HG   PRO  72          2HG       PRO  72   0.852  15.990   5.638
  572   2HG   PRO  72          1HG       PRO  72   0.699  15.701   3.895
  573   1HD   PRO  72          2HD       PRO  72   0.121  13.858   6.182
  574   2HD   PRO  72          1HD       PRO  72  -0.784  14.100   4.673
  575    H    ASP  73           H        ASP  73   1.706  12.053   6.377
  576    HA   ASP  73           HA       ASP  73   4.444  11.216   7.062
  577   1HB   ASP  73          2HB       ASP  73   3.165  12.694   8.697
  578   2HB   ASP  73          1HB       ASP  73   2.127  11.300   8.980
  579    H    SER  74           H        SER  74   2.834   9.854   5.150
  580    HA   SER  74           HA       SER  74   2.196   7.360   6.578
  581   1HB   SER  74          2HB       SER  74   0.282   8.368   5.392
  582   2HB   SER  74          1HB       SER  74   1.192   8.306   3.883
  583    HG   SER  74           HG       SER  74  -0.273   6.521   4.208
  584    H    VAL  75           H        VAL  75   2.116   5.805   4.149
  585    HA   VAL  75           HA       VAL  75   4.835   5.947   3.109
  586    HB   VAL  75           HB       VAL  75   3.833   3.429   4.442
  587   1HG1  VAL  75          1HG1      VAL  75   5.988   4.015   2.546
  588   2HG1  VAL  75          2HG1      VAL  75   5.240   2.476   2.971
  589   3HG1  VAL  75          3HG1      VAL  75   6.520   3.143   3.984
  590   1HG2  VAL  75          1HG2      VAL  75   4.447   4.797   6.217
  591   2HG2  VAL  75          2HG2      VAL  75   5.740   5.574   5.303
  592   3HG2  VAL  75          3HG2      VAL  75   5.936   3.917   5.875
  593    H    VAL  76           H        VAL  76   5.086   5.195   1.122
  594    HA   VAL  76           HA       VAL  76   2.748   3.926  -0.160
  595    HB   VAL  76           HB       VAL  76   4.750   5.548  -1.699
  596   1HG1  VAL  76          1HG1      VAL  76   3.474   4.625  -3.300
  597   2HG1  VAL  76          2HG1      VAL  76   2.334   5.898  -2.868
  598   3HG1  VAL  76          3HG1      VAL  76   2.148   4.282  -2.191
  599   1HG2  VAL  76          1HG2      VAL  76   2.507   6.542   0.004
  600   2HG2  VAL  76          2HG2      VAL  76   2.892   7.374  -1.503
  601   3HG2  VAL  76          3HG2      VAL  76   4.116   7.221  -0.242
  602    H    ILE  77           H        ILE  77   3.675   1.856   0.395
  603    HA   ILE  77           HA       ILE  77   6.220   1.019  -0.502
  604    HB   ILE  77           HB       ILE  77   3.804  -0.729  -0.027
  605   1HG1  ILE  77          2HG1      ILE  77   4.216   0.697   1.919
  606   2HG1  ILE  77          1HG1      ILE  77   4.654  -0.971   2.275
  607   1HG2  ILE  77          1HG2      ILE  77   5.796  -1.715  -1.206
  608   2HG2  ILE  77          2HG2      ILE  77   5.332  -2.513   0.296
  609   3HG2  ILE  77          3HG2      ILE  77   6.717  -1.421   0.270
  610   1HD1  ILE  77          1HD1      ILE  77   7.036  -0.277   1.672
  611   2HD1  ILE  77          2HD1      ILE  77   6.369   0.300   3.199
  612   3HD1  ILE  77          3HD1      ILE  77   6.446   1.380   1.807
  613    H    VAL  78           H        VAL  78   2.968   0.376  -1.821
  614    HA   VAL  78           HA       VAL  78   2.274  -0.319  -3.883
  615    HB   VAL  78           HB       VAL  78   4.541   1.430  -4.857
  616   1HG1  VAL  78          1HG1      VAL  78   1.904   0.736  -6.150
  617   2HG1  VAL  78          2HG1      VAL  78   3.455   0.007  -6.564
  618   3HG1  VAL  78          3HG1      VAL  78   3.188   1.728  -6.838
  619   1HG2  VAL  78          1HG2      VAL  78   1.704   2.251  -4.253
  620   2HG2  VAL  78          2HG2      VAL  78   3.038   3.288  -4.759
  621   3HG2  VAL  78          3HG2      VAL  78   3.066   2.530  -3.167
  622    H    ILE  79           H        ILE  79   2.799  -2.497  -3.756
  623    HA   ILE  79           HA       ILE  79   5.384  -3.340  -4.850
  624    HB   ILE  79           HB       ILE  79   3.396  -5.322  -3.841
  625   1HG1  ILE  79          2HG1      ILE  79   5.135  -3.683  -1.991
  626   2HG1  ILE  79          1HG1      ILE  79   3.402  -3.449  -2.181
  627   1HG2  ILE  79          1HG2      ILE  79   5.217  -6.541  -4.321
  628   2HG2  ILE  79          2HG2      ILE  79   5.837  -5.932  -2.788
  629   3HG2  ILE  79          3HG2      ILE  79   6.282  -5.135  -4.298
  630   1HD1  ILE  79          1HD1      ILE  79   2.898  -5.221  -0.908
  631   2HD1  ILE  79          2HD1      ILE  79   4.537  -4.999  -0.292
  632   3HD1  ILE  79          3HD1      ILE  79   4.222  -6.193  -1.552
  633    H    THR  80           H        THR  80   4.874  -5.718  -6.010
  634    HA   THR  80           HA       THR  80   3.929  -6.835  -7.769
  635    HB   THR  80           HB       THR  80   1.924  -4.620  -8.144
  636    HG1  THR  80           1HG      THR  80   1.676  -6.795  -6.345
  637   1HG2  THR  80          1HG2      THR  80   0.460  -6.372  -8.895
  638   2HG2  THR  80          2HG2      THR  80   1.679  -7.592  -8.528
  639   3HG2  THR  80          3HG2      THR  80   1.964  -6.421  -9.814
  640    H    GLY  81           H        GLY  81   5.512  -6.713  -9.241
  641   1HA   GLY  81          2HA       GLY  81   5.377  -5.441 -11.605
  642   2HA   GLY  81          1HA       GLY  81   6.120  -4.218 -10.585
  643    H    HIS  82           H        HIS  82   6.489  -7.726 -11.127
  644    HA   HIS  82           HA       HIS  82   9.311  -7.609 -10.641
  645   1HB   HIS  82          2HB       HIS  82   7.381  -9.614 -10.651
  646   2HB   HIS  82          1HB       HIS  82   8.407 -10.005 -12.027
  647    HD1  HIS  82           1HD      HIS  82   9.747  -8.449  -8.876
  648    HD2  HIS  82           2HD      HIS  82   9.692 -12.129 -10.803
  649    HE1  HIS  82           1HE      HIS  82  11.378  -9.890  -7.617
  650    HE2  HIS  82           2HE      HIS  82  11.257 -12.141  -8.744
  651    H    GLY  83           H        GLY  83   7.361  -8.360 -13.536
  652   1HA   GLY  83          2HA       GLY  83   9.476  -8.548 -15.347
  653   2HA   GLY  83          1HA       GLY  83   7.826  -8.118 -15.771
  654    H    SER  84           H        SER  84   7.255  -5.949 -15.987
  655    HA   SER  84           HA       SER  84   9.281  -4.236 -16.934
  656   1HB   SER  84          2HB       SER  84   7.131  -3.894 -17.845
  657   2HB   SER  84          1HB       SER  84   6.377  -3.808 -16.252
  658    HG   SER  84           HG       SER  84   8.240  -1.913 -17.246
  659    H    VAL  85           H        VAL  85  10.797  -3.357 -15.688
  660    HA   VAL  85           HA       VAL  85  10.187  -2.622 -12.934
  661    HB   VAL  85           HB       VAL  85  12.848  -2.392 -14.335
  662   1HG1  VAL  85          1HG1      VAL  85  13.230  -1.268 -12.414
  663   2HG1  VAL  85          2HG1      VAL  85  13.400  -2.893 -11.751
  664   3HG1  VAL  85          3HG1      VAL  85  11.875  -2.024 -11.575
  665   1HG2  VAL  85          1HG2      VAL  85  11.784  -4.719 -12.735
  666   2HG2  VAL  85          2HG2      VAL  85  13.411  -4.569 -13.399
  667   3HG2  VAL  85          3HG2      VAL  85  12.026  -4.698 -14.483
  668    H    ASP  86           H        ASP  86   9.434  -1.111 -15.566
  669    HA   ASP  86           HA       ASP  86  10.699   1.462 -15.043
  670   1HB   ASP  86          2HB       ASP  86  10.435   0.707 -17.376
  671   2HB   ASP  86          1HB       ASP  86   8.687   0.677 -17.163
  672    H    THR  87           H        THR  87   7.877  -0.231 -14.167
  673    HA   THR  87           HA       THR  87   6.230   2.110 -13.775
  674    HB   THR  87           HB       THR  87   5.506  -0.401 -14.200
  675    HG1  THR  87           1HG      THR  87   3.772   0.759 -14.042
  676   1HG2  THR  87          1HG2      THR  87   6.552  -1.281 -12.126
  677   2HG2  THR  87          2HG2      THR  87   4.820  -1.596 -12.249
  678   3HG2  THR  87          3HG2      THR  87   5.411  -0.312 -11.194
  679    H    ALA  88           H        ALA  88   8.394   0.093 -11.947
  680    HA   ALA  88           HA       ALA  88   7.771   0.925  -9.344
  681   1HB   ALA  88          1HB       ALA  88  10.298   0.371  -8.999
  682   2HB   ALA  88          2HB       ALA  88  10.206  -0.205 -10.662
  683   3HB   ALA  88          3HB       ALA  88   9.174  -0.918  -9.424
  684    H    VAL  89           H        VAL  89  10.372   2.008 -11.492
  685    HA   VAL  89           HA       VAL  89  11.209   4.173  -9.923
  686    HB   VAL  89           HB       VAL  89  12.427   4.936 -11.868
  687   1HG1  VAL  89          1HG1      VAL  89  12.359   1.922 -11.795
  688   2HG1  VAL  89          2HG1      VAL  89  13.261   2.954 -10.684
  689   3HG1  VAL  89          3HG1      VAL  89  13.682   2.923 -12.397
  690   1HG2  VAL  89          1HG2      VAL  89  12.001   3.353 -13.984
  691   2HG2  VAL  89          2HG2      VAL  89  11.168   4.891 -13.755
  692   3HG2  VAL  89          3HG2      VAL  89  10.368   3.381 -13.318
  693    H    LYS  90           H        LYS  90   8.586   3.834 -12.186
  694    HA   LYS  90           HA       LYS  90   8.181   6.664 -12.525
  695   1HB   LYS  90          2HB       LYS  90   7.583   5.078 -14.297
  696   2HB   LYS  90          1HB       LYS  90   6.400   4.330 -13.233
  697   1HG   LYS  90          2HG       LYS  90   5.087   6.352 -13.199
  698   2HG   LYS  90          1HG       LYS  90   6.309   7.194 -14.155
  699   1HD   LYS  90          2HD       LYS  90   4.830   4.743 -15.099
  700   2HD   LYS  90          1HD       LYS  90   4.325   6.395 -15.459
  701   1HE   LYS  90          2HE       LYS  90   5.865   6.622 -17.061
  702   2HE   LYS  90          1HE       LYS  90   7.134   5.930 -16.052
  703   1HZ   LYS  90          1HZ       LYS  90   6.923   4.452 -17.816
  704   2HZ   LYS  90          2HZ       LYS  90   5.233   4.534 -17.831
  705   3HZ   LYS  90          3HZ       LYS  90   6.030   3.712 -16.585
  706    H    ALA  91           H        ALA  91   7.398   4.428 -10.099
  707    HA   ALA  91           HA       ALA  91   5.205   6.147  -9.144
  708   1HB   ALA  91          1HB       ALA  91   4.852   3.960  -7.661
  709   2HB   ALA  91          2HB       ALA  91   5.626   3.220  -9.062
  710   3HB   ALA  91          3HB       ALA  91   4.141   4.150  -9.264
  711    H    ILE  92           H        ILE  92   8.330   4.836  -8.395
  712    HA   ILE  92           HA       ILE  92   8.139   5.603  -5.598
  713    HB   ILE  92           HB       ILE  92  10.191   4.531  -5.223
  714   1HG1  ILE  92          2HG1      ILE  92  10.637   4.669  -8.216
  715   2HG1  ILE  92          1HG1      ILE  92  11.535   5.533  -6.975
  716   1HG2  ILE  92          1HG2      ILE  92   9.853   2.431  -6.941
  717   2HG2  ILE  92          2HG2      ILE  92   8.264   3.191  -6.970
  718   3HG2  ILE  92          3HG2      ILE  92   8.963   2.672  -5.438
  719   1HD1  ILE  92          1HD1      ILE  92  12.252   3.267  -6.110
  720   2HD1  ILE  92          2HD1      ILE  92  12.915   3.766  -7.666
  721   3HD1  ILE  92          3HD1      ILE  92  11.592   2.601  -7.605
  722    H    LYS  93           H        LYS  93   9.079   7.032  -8.534
  723    HA   LYS  93           HA       LYS  93  11.130   8.745  -7.551
  724   1HB   LYS  93          2HB       LYS  93   9.731   8.311 -10.058
  725   2HB   LYS  93          1HB       LYS  93   9.985  10.022  -9.748
  726   1HG   LYS  93          2HG       LYS  93  12.330   9.754  -9.638
  727   2HG   LYS  93          1HG       LYS  93  12.195   7.996  -9.576
  728   1HD   LYS  93          2HD       LYS  93  10.916   9.167 -11.923
  729   2HD   LYS  93          1HD       LYS  93  12.646   9.501 -11.835
  730   1HE   LYS  93          2HE       LYS  93  12.187   6.767 -11.146
  731   2HE   LYS  93          1HE       LYS  93  11.359   7.124 -12.661
  732   1HZ   LYS  93          1HZ       LYS  93  14.228   7.201 -12.049
  733   2HZ   LYS  93          2HZ       LYS  93  13.625   8.246 -13.235
  734   3HZ   LYS  93          3HZ       LYS  93  13.434   6.573 -13.404
  735    H    LYS  94           H        LYS  94   7.642   9.121  -8.048
  736    HA   LYS  94           HA       LYS  94   7.400  11.827  -7.494
  737   1HB   LYS  94          2HB       LYS  94   5.570  10.385  -8.332
  738   2HB   LYS  94          1HB       LYS  94   5.442   9.657  -6.736
  739   1HG   LYS  94          2HG       LYS  94   4.335  11.415  -5.875
  740   2HG   LYS  94          1HG       LYS  94   5.269  12.592  -6.799
  741   1HD   LYS  94          2HD       LYS  94   3.303  10.819  -8.190
  742   2HD   LYS  94          1HD       LYS  94   2.740  12.248  -7.320
  743   1HE   LYS  94          2HE       LYS  94   4.284  13.633  -8.650
  744   2HE   LYS  94          1HE       LYS  94   4.776  12.196  -9.546
  745   1HZ   LYS  94          1HZ       LYS  94   3.070  13.564 -10.677
  746   2HZ   LYS  94          2HZ       LYS  94   1.986  13.197  -9.433
  747   3HZ   LYS  94          3HZ       LYS  94   2.586  11.963 -10.420
  748    H    GLY  95           H        GLY  95   7.735   9.109  -5.290
  749   1HA   GLY  95          2HA       GLY  95   8.981  10.110  -3.218
  750   2HA   GLY  95          1HA       GLY  95   7.431  10.904  -2.993
  751    H    ALA  96           H        ALA  96   7.986   7.590  -4.127
  752    HA   ALA  96           HA       ALA  96   6.264   6.634  -1.985
  753   1HB   ALA  96          1HB       ALA  96   5.810   4.816  -3.276
  754   2HB   ALA  96          2HB       ALA  96   7.442   4.742  -3.942
  755   3HB   ALA  96          3HB       ALA  96   6.294   5.934  -4.550
  756    H    TYR  97           H        TYR  97   7.175   4.072  -1.606
  757    HA   TYR  97           HA       TYR  97   9.717   4.555  -0.212
  758   1HB   TYR  97          2HB       TYR  97   7.551   3.912   1.048
  759   2HB   TYR  97          1HB       TYR  97   7.841   2.297   0.411
  760    HD1  TYR  97           1HD      TYR  97   8.837   0.862   1.900
  761    HD2  TYR  97           2HD      TYR  97   9.898   4.979   2.017
  762    HE1  TYR  97           1HE      TYR  97  10.383   0.404   3.758
  763    HE2  TYR  97           2HE      TYR  97  11.448   4.533   3.875
  764    HH   TYR  97           HH       TYR  97  12.347   1.369   4.800
  765    H    GLU  98           H        GLU  98   9.372   3.748  -3.010
  766    HA   GLU  98           HA       GLU  98  10.630   2.506  -4.456
  767   1HB   GLU  98          2HB       GLU  98  12.467   1.400  -3.738
  768   2HB   GLU  98          1HB       GLU  98  12.090   2.193  -2.218
  769   1HG   GLU  98          2HG       GLU  98  10.654  -0.033  -1.886
  770   2HG   GLU  98          1HG       GLU  98  11.884  -0.657  -2.982
  771    H    PHE  99           H        PHE  99  10.563   0.394  -5.497
  772    HA   PHE  99           HA       PHE  99   7.979  -0.874  -5.041
  773   1HB   PHE  99          2HB       PHE  99   9.610  -0.308  -7.323
  774   2HB   PHE  99          1HB       PHE  99   9.325  -2.040  -7.253
  775    HD1  PHE  99           1HD      PHE  99   7.660  -2.665  -8.687
  776    HD2  PHE  99           2HD      PHE  99   7.236   0.967  -6.510
  777    HE1  PHE  99           1HE      PHE  99   5.437  -2.330  -9.690
  778    HE2  PHE  99           2HE      PHE  99   5.014   1.309  -7.509
  779    HZ   PHE  99           HZ       PHE  99   4.110  -0.340  -9.098
  780    H    LEU 100           H        LEU 100   8.068  -2.404  -3.498
  781    HA   LEU 100           HA       LEU 100  10.284  -3.939  -2.790
  782   1HB   LEU 100          2HB       LEU 100   7.907  -3.567  -1.691
  783   2HB   LEU 100          1HB       LEU 100   7.544  -5.071  -2.514
  784    HG   LEU 100           HG       LEU 100   9.269  -6.229  -1.293
  785   1HD1  LEU 100          1HD1      LEU 100  11.061  -4.903  -0.879
  786   2HD1  LEU 100          2HD1      LEU 100  10.252  -4.724   0.678
  787   3HD1  LEU 100          3HD1      LEU 100  10.073  -3.478  -0.556
  788   1HD2  LEU 100          1HD2      LEU 100   8.016  -4.691   0.898
  789   2HD2  LEU 100          2HD2      LEU 100   8.091  -6.432   0.628
  790   3HD2  LEU 100          3HD2      LEU 100   6.933  -5.450  -0.269
  791    H    GLU 101           H        GLU 101  10.906  -6.058  -3.260
  792    HA   GLU 101           HA       GLU 101   9.977  -7.024  -5.871
  793   1HB   GLU 101          2HB       GLU 101  12.549  -7.195  -4.381
  794   2HB   GLU 101          1HB       GLU 101  12.138  -8.528  -5.451
  795   1HG   GLU 101          2HG       GLU 101  11.766  -5.897  -6.656
  796   2HG   GLU 101          1HG       GLU 101  13.428  -6.239  -6.184
  797    H    LYS 102           H        LYS 102  10.045  -9.453  -6.139
  798    HA   LYS 102           HA       LYS 102   9.218 -11.507  -5.628
  799   1HB   LYS 102          2HB       LYS 102  10.499 -10.629  -3.102
  800   2HB   LYS 102          1HB       LYS 102   9.375 -11.975  -2.981
  801   1HG   LYS 102          2HG       LYS 102  10.771 -12.881  -5.024
  802   2HG   LYS 102          1HG       LYS 102  12.003 -11.813  -4.350
  803   1HD   LYS 102          2HD       LYS 102  11.455 -12.959  -2.106
  804   2HD   LYS 102          1HD       LYS 102  10.683 -14.198  -3.098
  805   1HE   LYS 102          2HE       LYS 102  13.392 -13.393  -3.933
  806   2HE   LYS 102          1HE       LYS 102  13.289 -14.232  -2.385
  807   1HZ   LYS 102          1HZ       LYS 102  12.808 -15.228  -5.070
  808   2HZ   LYS 102          2HZ       LYS 102  11.732 -15.777  -3.886
  809   3HZ   LYS 102          3HZ       LYS 102  13.395 -16.034  -3.705
  810    HA   PRO 103           HA       PRO 103   5.333  -9.420  -3.954
  811   1HB   PRO 103          2HB       PRO 103   3.965  -9.193  -6.267
  812   2HB   PRO 103          1HB       PRO 103   5.107  -7.958  -5.725
  813   1HG   PRO 103          2HG       PRO 103   5.495 -10.145  -7.732
  814   2HG   PRO 103          1HG       PRO 103   5.996  -8.446  -7.819
  815   1HD   PRO 103          2HD       PRO 103   7.692 -10.465  -7.140
  816   2HD   PRO 103          1HD       PRO 103   7.871  -8.804  -6.541
  817    H    PHE 104           H        PHE 104   5.277 -11.646  -3.068
  818    HA   PHE 104           HA       PHE 104   3.139 -13.158  -4.336
  819   1HB   PHE 104          2HB       PHE 104   5.638 -13.977  -4.896
  820   2HB   PHE 104          1HB       PHE 104   5.393 -14.828  -3.375
  821    HD1  PHE 104           1HD      PHE 104   4.695 -14.763  -6.885
  822    HD2  PHE 104           2HD      PHE 104   3.393 -16.352  -3.158
  823    HE1  PHE 104           1HE      PHE 104   3.439 -16.513  -8.074
  824    HE2  PHE 104           2HE      PHE 104   2.136 -18.106  -4.340
  825    HZ   PHE 104           HZ       PHE 104   2.158 -18.188  -6.801
  826    H    SER 105           H        SER 105   5.495 -13.661  -1.701
  827    HA   SER 105           HA       SER 105   3.251 -14.277   0.082
  828   1HB   SER 105          2HB       SER 105   4.927 -16.007   0.010
  829   2HB   SER 105          1HB       SER 105   6.211 -14.841   0.323
  830    HG   SER 105           HG       SER 105   4.112 -15.563   2.093
  831    H    VAL 106           H        VAL 106   4.676 -11.565  -0.756
  832    HA   VAL 106           HA       VAL 106   5.452  -9.649   0.278
  833    HB   VAL 106           HB       VAL 106   3.724  -8.541   1.434
  834   1HG1  VAL 106          1HG1      VAL 106   2.192 -10.558  -0.175
  835   2HG1  VAL 106          2HG1      VAL 106   3.264  -9.377  -0.931
  836   3HG1  VAL 106          3HG1      VAL 106   1.882  -8.833   0.021
  837   1HG2  VAL 106          1HG2      VAL 106   1.707 -10.088   2.201
  838   2HG2  VAL 106          2HG2      VAL 106   3.058  -9.711   3.269
  839   3HG2  VAL 106          3HG2      VAL 106   3.014 -11.249   2.411
  840    H    GLU 107           H        GLU 107   6.788 -11.885   1.445
  841    HA   GLU 107           HA       GLU 107   6.709 -11.709   4.286
  842   1HB   GLU 107          2HB       GLU 107   7.696 -13.537   2.598
  843   2HB   GLU 107          1HB       GLU 107   9.172 -12.641   2.928
  844   1HG   GLU 107          2HG       GLU 107   8.659 -12.956   5.379
  845   2HG   GLU 107          1HG       GLU 107   7.417 -14.100   4.872
  846    H    ARG 108           H        ARG 108   8.976 -10.535   1.805
  847    HA   ARG 108           HA       ARG 108  10.659  -9.092   3.525
  848   1HB   ARG 108          2HB       ARG 108   9.995  -8.870   0.602
  849   2HB   ARG 108          1HB       ARG 108  11.029  -7.671   1.368
  850   1HG   ARG 108          2HG       ARG 108  11.539 -10.636   1.240
  851   2HG   ARG 108          1HG       ARG 108  12.353  -9.389   0.293
  852   1HD   ARG 108          2HD       ARG 108  13.059  -8.370   2.502
  853   2HD   ARG 108          1HD       ARG 108  12.495  -9.858   3.261
  854    HE   ARG 108           HE       ARG 108  14.356 -10.932   2.466
  855   1HH1  ARG 108          1HH1      ARG 108  14.015  -7.876   0.814
  856   2HH1  ARG 108          2HH1      ARG 108  15.561  -7.981   0.039
  857   1HH2  ARG 108          1HH2      ARG 108  16.389 -11.071   1.450
  858   2HH2  ARG 108          2HH2      ARG 108  16.908  -9.796   0.398
  859    H    PHE 109           H        PHE 109   7.569  -8.399   2.083
  860    HA   PHE 109           HA       PHE 109   7.430  -5.629   2.546
  861   1HB   PHE 109          2HB       PHE 109   5.788  -6.531   1.104
  862   2HB   PHE 109          1HB       PHE 109   5.375  -7.813   2.233
  863    HD1  PHE 109           1HD      PHE 109   5.045  -4.201   1.563
  864    HD2  PHE 109           2HD      PHE 109   3.701  -7.511   3.875
  865    HE1  PHE 109           1HE      PHE 109   3.169  -2.849   2.399
  866    HE2  PHE 109           2HE      PHE 109   1.822  -6.165   4.717
  867    HZ   PHE 109           HZ       PHE 109   1.553  -3.830   3.979
  868    H    LEU 110           H        LEU 110   6.779  -8.445   4.524
  869    HA   LEU 110           HA       LEU 110   5.501  -7.292   6.702
  870   1HB   LEU 110          2HB       LEU 110   6.155  -9.758   6.126
  871   2HB   LEU 110          1HB       LEU 110   7.553  -9.400   7.118
  872    HG   LEU 110           HG       LEU 110   4.732  -9.014   8.089
  873   1HD1  LEU 110          1HD1      LEU 110   4.812 -11.144   9.116
  874   2HD1  LEU 110          2HD1      LEU 110   6.497 -11.379   8.652
  875   3HD1  LEU 110          3HD1      LEU 110   5.236 -11.382   7.420
  876   1HD2  LEU 110          1HD2      LEU 110   7.448  -8.761   9.235
  877   2HD2  LEU 110          2HD2      LEU 110   6.207  -9.470  10.268
  878   3HD2  LEU 110          3HD2      LEU 110   5.977  -7.857   9.592
  879    H    LEU 111           H        LEU 111   8.971  -8.023   6.431
  880    HA   LEU 111           HA       LEU 111   9.761  -6.680   8.754
  881   1HB   LEU 111          2HB       LEU 111  11.382  -7.185   6.260
  882   2HB   LEU 111          1HB       LEU 111  12.029  -6.785   7.839
  883    HG   LEU 111           HG       LEU 111  10.524  -9.008   8.397
  884   1HD1  LEU 111          1HD1      LEU 111  11.497  -9.159   5.580
  885   2HD1  LEU 111          2HD1      LEU 111   9.986  -9.736   6.281
  886   3HD1  LEU 111          3HD1      LEU 111  11.488 -10.609   6.583
  887   1HD2  LEU 111          1HD2      LEU 111  12.822  -8.470   9.142
  888   2HD2  LEU 111          2HD2      LEU 111  13.422  -8.986   7.566
  889   3HD2  LEU 111          3HD2      LEU 111  12.634 -10.148   8.633
  890    H    THR 112           H        THR 112   9.747  -5.556   5.375
  891    HA   THR 112           HA       THR 112  10.874  -3.033   5.855
  892    HB   THR 112           HB       THR 112   8.920  -3.874   3.703
  893    HG1  THR 112           1HG      THR 112  10.793  -5.095   3.626
  894   1HG2  THR 112          1HG2      THR 112   9.600  -2.049   2.404
  895   2HG2  THR 112          2HG2      THR 112  10.911  -1.642   3.512
  896   3HG2  THR 112          3HG2      THR 112   9.235  -1.382   3.995
  897    H    ILE 113           H        ILE 113   7.534  -4.151   5.917
  898    HA   ILE 113           HA       ILE 113   6.152  -1.783   6.081
  899    HB   ILE 113           HB       ILE 113   5.674  -4.530   7.084
  900   1HG1  ILE 113          2HG1      ILE 113   5.050  -3.811   4.813
  901   2HG1  ILE 113          1HG1      ILE 113   3.641  -4.296   5.751
  902   1HG2  ILE 113          1HG2      ILE 113   4.175  -2.141   8.121
  903   2HG2  ILE 113          2HG2      ILE 113   4.945  -3.434   9.040
  904   3HG2  ILE 113          3HG2      ILE 113   3.489  -3.766   8.101
  905   1HD1  ILE 113          1HD1      ILE 113   3.755  -1.617   6.242
  906   2HD1  ILE 113          2HD1      ILE 113   2.752  -2.392   5.016
  907   3HD1  ILE 113          3HD1      ILE 113   4.322  -1.718   4.574
  908    H    LYS 114           H        LYS 114   7.486  -3.619   8.833
  909    HA   LYS 114           HA       LYS 114   6.712  -2.044  10.919
  910   1HB   LYS 114          2HB       LYS 114   8.149  -4.189  10.893
  911   2HB   LYS 114          1HB       LYS 114   9.518  -3.091  10.791
  912   1HG   LYS 114          2HG       LYS 114   7.479  -2.710  12.934
  913   2HG   LYS 114          1HG       LYS 114   8.707  -3.967  13.101
  914   1HD   LYS 114          2HD       LYS 114   9.280  -1.051  12.577
  915   2HD   LYS 114          1HD       LYS 114   9.358  -1.827  14.160
  916   1HE   LYS 114          2HE       LYS 114  10.883  -3.319  12.228
  917   2HE   LYS 114          1HE       LYS 114  11.396  -1.632  12.247
  918   1HZ   LYS 114          1HZ       LYS 114  11.260  -2.111  14.849
  919   2HZ   LYS 114          2HZ       LYS 114  12.662  -2.377  13.938
  920   3HZ   LYS 114          3HZ       LYS 114  11.636  -3.670  14.309
  921    H    HIS 115           H        HIS 115   9.732  -1.677   9.084
  922    HA   HIS 115           HA       HIS 115  10.621   0.667  10.279
  923   1HB   HIS 115          2HB       HIS 115  11.156  -0.746   7.754
  924   2HB   HIS 115          1HB       HIS 115  11.565   0.966   7.767
  925    HD1  HIS 115           1HD      HIS 115  13.904  -0.796   7.476
  926    HD2  HIS 115           2HD      HIS 115  12.349   0.145  11.213
  927    HE1  HIS 115           1HE      HIS 115  15.784  -1.179   9.102
  928    HE2  HIS 115           2HE      HIS 115  14.847  -0.513  11.344
  929    H    ALA 116           H        ALA 116   8.131   0.171   7.905
  930    HA   ALA 116           HA       ALA 116   7.996   2.805   6.887
  931   1HB   ALA 116          1HB       ALA 116   5.445   1.392   6.992
  932   2HB   ALA 116          2HB       ALA 116   6.757   0.427   6.316
  933   3HB   ALA 116          3HB       ALA 116   6.355   1.990   5.605
  934    H    PHE 117           H        PHE 117   6.553   1.234   9.683
  935    HA   PHE 117           HA       PHE 117   4.888   3.491  10.339
  936   1HB   PHE 117          2HB       PHE 117   5.507   0.867  11.670
  937   2HB   PHE 117          1HB       PHE 117   4.624   2.126  12.528
  938    HD1  PHE 117           1HD      PHE 117   2.352   2.584  12.043
  939    HD2  PHE 117           2HD      PHE 117   4.544  -0.154   9.634
  940    HE1  PHE 117           1HE      PHE 117   0.257   1.837  10.996
  941    HE2  PHE 117           2HE      PHE 117   2.454  -0.904   8.582
  942    HZ   PHE 117           HZ       PHE 117   0.304   0.093   9.262
  943    H    GLU 118           H        GLU 118   7.998   2.203  11.346
  944    HA   GLU 118           HA       GLU 118   8.277   4.068  13.523
  945   1HB   GLU 118          2HB       GLU 118   9.673   1.734  12.550
  946   2HB   GLU 118          1HB       GLU 118  10.789   3.022  12.983
  947   1HG   GLU 118          2HG       GLU 118   8.601   2.153  14.833
  948   2HG   GLU 118          1HG       GLU 118  10.156   1.324  14.779
  949    H    GLU 119           H        GLU 119   9.969   3.579  10.425
  950    HA   GLU 119           HA       GLU 119  11.410   6.030  10.633
  951   1HB   GLU 119          2HB       GLU 119  10.931   4.323   8.188
  952   2HB   GLU 119          1HB       GLU 119  12.163   5.564   8.363
  953   1HG   GLU 119          2HG       GLU 119  12.480   3.756  10.510
  954   2HG   GLU 119          1HG       GLU 119  12.290   2.804   9.038
  955    H    TYR 120           H        TYR 120   8.210   5.427   9.929
  956    HA   TYR 120           HA       TYR 120   7.925   8.087   8.757
  957   1HB   TYR 120          2HB       TYR 120   7.703   5.799   7.198
  958   2HB   TYR 120          1HB       TYR 120   6.033   6.207   7.580
  959    HD1  TYR 120           1HD      TYR 120   5.920   9.065   7.558
  960    HD2  TYR 120           2HD      TYR 120   8.191   6.484   5.051
  961    HE1  TYR 120           1HE      TYR 120   5.941  10.793   5.808
  962    HE2  TYR 120           2HE      TYR 120   8.219   8.206   3.294
  963    HH   TYR 120           HH       TYR 120   6.242  11.007   3.433
  964    H    SER 121           H        SER 121   7.480   7.327  11.400
  965    HA   SER 121           HA       SER 121   4.756   6.683  11.898
  966   1HB   SER 121          2HB       SER 121   6.675   6.366  13.516
  967   2HB   SER 121          1HB       SER 121   6.642   8.109  13.782
  968    HG   SER 121           HG       SER 121   5.345   7.285  15.332
  Start of MODEL   30
    1   1H    MET   1          1HT       MET   1  -0.030   1.686  17.841
    2   2H    MET   1          2HT       MET   1  -1.139   0.376  17.846
    3   3H    MET   1          3HT       MET   1  -1.423   1.748  18.838
    4    HA   MET   1           HA       MET   1  -2.756   1.571  16.764
    5   1HB   MET   1          2HB       MET   1  -2.341   3.611  18.186
    6   2HB   MET   1          1HB       MET   1  -1.027   4.029  17.095
    7   1HG   MET   1          2HG       MET   1  -2.590   5.226  16.041
    8   2HG   MET   1          1HG       MET   1  -3.048   3.677  15.336
    9   1HE   MET   1          1HE       MET   1  -4.530   2.077  17.534
   10   2HE   MET   1          2HE       MET   1  -5.132   2.342  15.898
   11   3HE   MET   1          3HE       MET   1  -6.184   2.634  17.283
   12    H    LYS   2           H        LYS   2  -1.878   0.095  15.224
   13    HA   LYS   2           HA       LYS   2  -0.251   1.436  13.180
   14   1HB   LYS   2          2HB       LYS   2   0.112  -1.482  13.823
   15   2HB   LYS   2          1HB       LYS   2   1.145  -0.443  12.852
   16   1HG   LYS   2          2HG       LYS   2   0.776   0.232  15.722
   17   2HG   LYS   2          1HG       LYS   2   1.798  -1.143  15.302
   18   1HD   LYS   2          2HD       LYS   2   3.019   0.395  13.720
   19   2HD   LYS   2          1HD       LYS   2   2.121   1.728  14.451
   20   1HE   LYS   2          2HE       LYS   2   3.402   1.726  16.288
   21   2HE   LYS   2          1HE       LYS   2   3.380  -0.033  16.408
   22   1HZ   LYS   2          1HZ       LYS   2   5.540   0.210  15.889
   23   2HZ   LYS   2          2HZ       LYS   2   5.325   1.714  15.146
   24   3HZ   LYS   2          3HZ       LYS   2   4.965   0.295  14.301
   25    H    ARG   3           H        ARG   3  -1.186   1.391  11.246
   26    HA   ARG   3           HA       ARG   3  -2.846  -0.879  10.468
   27   1HB   ARG   3          2HB       ARG   3  -3.939   1.887  10.055
   28   2HB   ARG   3          1HB       ARG   3  -4.784   0.347   9.995
   29   1HG   ARG   3          2HG       ARG   3  -5.533   1.180  11.988
   30   2HG   ARG   3          1HG       ARG   3  -4.143   0.237  12.530
   31   1HD   ARG   3          2HD       ARG   3  -3.742   2.202  13.627
   32   2HD   ARG   3          1HD       ARG   3  -2.873   2.510  12.124
   33    HE   ARG   3           HE       ARG   3  -4.350   4.188  11.677
   34   1HH1  ARG   3          1HH1      ARG   3  -5.792   2.056  14.034
   35   2HH1  ARG   3          2HH1      ARG   3  -7.177   3.064  14.284
   36   1HH2  ARG   3          1HH2      ARG   3  -6.172   5.516  12.003
   37   2HH2  ARG   3          2HH2      ARG   3  -7.394   5.028  13.130
   38    H    VAL   4           H        VAL   4  -2.649  -1.375   8.345
   39    HA   VAL   4           HA       VAL   4  -1.353   0.628   6.609
   40    HB   VAL   4           HB       VAL   4  -0.913  -2.339   6.324
   41   1HG1  VAL   4          1HG1      VAL   4   1.252  -1.223   5.271
   42   2HG1  VAL   4          2HG1      VAL   4   0.141   0.128   5.057
   43   3HG1  VAL   4          3HG1      VAL   4  -0.232  -1.439   4.343
   44   1HG2  VAL   4          1HG2      VAL   4   0.968  -0.419   7.692
   45   2HG2  VAL   4          2HG2      VAL   4   1.141  -2.167   7.530
   46   3HG2  VAL   4          3HG2      VAL   4  -0.125  -1.498   8.559
   47    H    LEU   5           H        LEU   5  -1.900   0.540   4.373
   48    HA   LEU   5           HA       LEU   5  -4.550  -0.641   3.904
   49   1HB   LEU   5          2HB       LEU   5  -4.361   1.806   3.679
   50   2HB   LEU   5          1HB       LEU   5  -3.146   1.592   2.434
   51    HG   LEU   5           HG       LEU   5  -4.821   0.471   1.009
   52   1HD1  LEU   5          1HD1      LEU   5  -7.260   1.006   1.866
   53   2HD1  LEU   5          2HD1      LEU   5  -6.477   0.857   3.439
   54   3HD1  LEU   5          3HD1      LEU   5  -6.433  -0.489   2.302
   55   1HD2  LEU   5          1HD2      LEU   5  -5.172   3.260   1.987
   56   2HD2  LEU   5          2HD2      LEU   5  -6.363   2.599   0.867
   57   3HD2  LEU   5          3HD2      LEU   5  -4.664   2.673   0.404
   58    H    VAL   6           H        VAL   6  -4.795  -2.244   2.483
   59    HA   VAL   6           HA       VAL   6  -2.529  -2.816   0.672
   60    HB   VAL   6           HB       VAL   6  -4.577  -4.812   1.620
   61   1HG1  VAL   6          1HG1      VAL   6  -3.277  -5.139  -0.564
   62   2HG1  VAL   6          2HG1      VAL   6  -3.271  -6.458   0.607
   63   3HG1  VAL   6          3HG1      VAL   6  -1.872  -5.393   0.470
   64   1HG2  VAL   6          1HG2      VAL   6  -3.376  -5.275   3.459
   65   2HG2  VAL   6          2HG2      VAL   6  -2.696  -3.663   3.232
   66   3HG2  VAL   6          3HG2      VAL   6  -1.838  -5.077   2.618
   67    H    VAL   7           H        VAL   7  -3.212  -1.629  -1.098
   68    HA   VAL   7           HA       VAL   7  -5.872  -1.924  -2.159
   69    HB   VAL   7           HB       VAL   7  -3.452  -0.665  -3.461
   70   1HG1  VAL   7          1HG1      VAL   7  -5.436  -1.298  -4.910
   71   2HG1  VAL   7          2HG1      VAL   7  -4.925   0.389  -4.962
   72   3HG1  VAL   7          3HG1      VAL   7  -6.344  -0.074  -4.021
   73   1HG2  VAL   7          1HG2      VAL   7  -5.556   0.507  -1.656
   74   2HG2  VAL   7          2HG2      VAL   7  -4.504   1.481  -2.683
   75   3HG2  VAL   7          3HG2      VAL   7  -3.810   0.478  -1.409
   76    H    ASP   8           H        ASP   8  -6.502  -3.674  -3.233
   77    HA   ASP   8           HA       ASP   8  -4.886  -4.734  -5.376
   78   1HB   ASP   8          2HB       ASP   8  -3.976  -5.929  -3.417
   79   2HB   ASP   8          1HB       ASP   8  -5.591  -6.501  -3.020
   80    H    ASP   9           H        ASP   9  -6.054  -6.228  -6.722
   81    HA   ASP   9           HA       ASP   9  -8.911  -5.710  -6.672
   82   1HB   ASP   9          2HB       ASP   9  -7.653  -5.451  -8.778
   83   2HB   ASP   9          1HB       ASP   9  -7.228  -7.159  -8.727
   84    H    GLU  10           H        GLU  10  -8.348  -7.258  -4.553
   85    HA   GLU  10           HA       GLU  10  -9.386  -9.895  -5.351
   86   1HB   GLU  10          2HB       GLU  10  -7.158  -9.200  -3.490
   87   2HB   GLU  10          1HB       GLU  10  -8.159 -10.596  -3.113
   88   1HG   GLU  10          2HG       GLU  10  -7.673 -11.347  -5.513
   89   2HG   GLU  10          1HG       GLU  10  -6.386 -10.144  -5.480
   90    H    GLU  11           H        GLU  11 -10.470 -11.040  -3.492
   91    HA   GLU  11           HA       GLU  11 -12.518  -9.375  -2.443
   92   1HB   GLU  11          2HB       GLU  11 -12.359 -12.005  -3.013
   93   2HB   GLU  11          1HB       GLU  11 -12.113 -12.070  -1.273
   94   1HG   GLU  11          2HG       GLU  11 -14.255 -11.659  -0.846
   95   2HG   GLU  11          1HG       GLU  11 -14.327 -10.348  -2.023
   96    H    SER  12           H        SER  12 -12.696 -10.820   0.170
   97    HA   SER  12           HA       SER  12 -11.771  -8.948   1.907
   98   1HB   SER  12          2HB       SER  12 -11.589 -10.970   3.567
   99   2HB   SER  12          1HB       SER  12 -13.156 -10.530   2.890
  100    HG   SER  12           HG       SER  12 -13.182 -12.322   1.755
  101    H    ILE  13           H        ILE  13  -9.791  -8.109   1.918
  102    HA   ILE  13           HA       ILE  13  -7.536  -7.869   2.072
  103    HB   ILE  13           HB       ILE  13  -7.694 -10.590   3.292
  104   1HG1  ILE  13          2HG1      ILE  13  -9.258  -8.957   4.330
  105   2HG1  ILE  13          1HG1      ILE  13  -8.029  -9.559   5.436
  106   1HG2  ILE  13          1HG2      ILE  13  -5.426 -10.179   2.962
  107   2HG2  ILE  13          2HG2      ILE  13  -5.700  -9.678   4.631
  108   3HG2  ILE  13          3HG2      ILE  13  -5.591  -8.467   3.354
  109   1HD1  ILE  13          1HD1      ILE  13  -6.741  -7.414   4.729
  110   2HD1  ILE  13          2HD1      ILE  13  -8.044  -7.321   5.914
  111   3HD1  ILE  13          3HD1      ILE  13  -8.339  -6.853   4.239
  112    H    THR  14           H        THR  14  -5.410  -8.902   1.427
  113    HA   THR  14           HA       THR  14  -5.752 -10.186  -1.143
  114    HB   THR  14           HB       THR  14  -3.248  -9.913  -1.276
  115    HG1  THR  14           1HG      THR  14  -2.322  -8.579   0.345
  116   1HG2  THR  14          1HG2      THR  14  -3.236  -7.439  -1.350
  117   2HG2  THR  14          2HG2      THR  14  -4.852  -7.447  -0.644
  118   3HG2  THR  14          3HG2      THR  14  -4.580  -8.166  -2.231
  119    H    SER  15           H        SER  15  -4.186 -12.073  -1.665
  120    HA   SER  15           HA       SER  15  -4.792 -14.177   0.147
  121   1HB   SER  15          2HB       SER  15  -4.321 -14.090  -2.507
  122   2HB   SER  15          1HB       SER  15  -2.747 -14.650  -1.941
  123    HG   SER  15           HG       SER  15  -3.856 -16.489  -2.134
  124    H    SER  16           H        SER  16  -3.677 -14.967   1.787
  125    HA   SER  16           HA       SER  16  -1.925 -15.619   3.099
  126   1HB   SER  16          2HB       SER  16  -0.647 -15.795   0.904
  127   2HB   SER  16          1HB       SER  16  -0.005 -14.194   1.275
  128    HG   SER  16           HG       SER  16   0.314 -16.593   2.739
  129    H    LEU  17           H        LEU  17  -1.830 -12.291   1.901
  130    HA   LEU  17           HA       LEU  17  -0.282 -11.036   3.748
  131   1HB   LEU  17          2HB       LEU  17  -1.718 -10.124   1.782
  132   2HB   LEU  17          1HB       LEU  17  -2.905  -9.820   3.032
  133    HG   LEU  17           HG       LEU  17  -0.484  -8.338   2.366
  134   1HD1  LEU  17          1HD1      LEU  17  -2.467  -7.159   2.295
  135   2HD1  LEU  17          2HD1      LEU  17  -1.773  -6.672   3.840
  136   3HD1  LEU  17          3HD1      LEU  17  -3.063  -7.874   3.794
  137   1HD2  LEU  17          1HD2      LEU  17   0.047  -7.724   4.707
  138   2HD2  LEU  17          2HD2      LEU  17   0.457  -9.395   4.325
  139   3HD2  LEU  17          3HD2      LEU  17  -0.994  -9.033   5.254
  140    H    SER  18           H        SER  18  -3.817 -11.361   4.143
  141    HA   SER  18           HA       SER  18  -4.172 -10.298   6.580
  142   1HB   SER  18          2HB       SER  18  -5.739 -11.814   4.969
  143   2HB   SER  18          1HB       SER  18  -5.505 -12.929   6.316
  144    HG   SER  18           HG       SER  18  -6.320 -11.355   7.707
  145    H    ALA  19           H        ALA  19  -3.451 -13.789   6.221
  146    HA   ALA  19           HA       ALA  19  -3.114 -14.437   8.870
  147   1HB   ALA  19          1HB       ALA  19  -2.963 -15.916   6.772
  148   2HB   ALA  19          2HB       ALA  19  -1.969 -16.342   8.165
  149   3HB   ALA  19          3HB       ALA  19  -1.246 -15.512   6.787
  150    H    ILE  20           H        ILE  20  -0.887 -12.827   6.716
  151    HA   ILE  20           HA       ILE  20   1.348 -12.861   8.505
  152    HB   ILE  20           HB       ILE  20   0.811 -11.246   6.015
  153   1HG1  ILE  20          2HG1      ILE  20   2.895 -13.333   6.127
  154   2HG1  ILE  20          1HG1      ILE  20   1.223 -13.886   6.158
  155   1HG2  ILE  20          1HG2      ILE  20   3.482 -11.195   6.241
  156   2HG2  ILE  20          2HG2      ILE  20   3.029 -11.157   7.946
  157   3HG2  ILE  20          3HG2      ILE  20   2.426  -9.918   6.845
  158   1HD1  ILE  20          1HD1      ILE  20   2.475 -12.134   4.065
  159   2HD1  ILE  20          2HD1      ILE  20   0.790 -12.645   4.097
  160   3HD1  ILE  20          3HD1      ILE  20   2.070 -13.840   3.895
  161    H    LEU  21           H        LEU  21  -0.315 -10.020   7.151
  162    HA   LEU  21           HA       LEU  21   0.589  -8.175   8.983
  163   1HB   LEU  21          2HB       LEU  21  -0.590  -6.783   7.719
  164   2HB   LEU  21          1HB       LEU  21  -1.050  -8.173   6.784
  165    HG   LEU  21           HG       LEU  21  -2.952  -6.786   7.318
  166   1HD1  LEU  21          1HD1      LEU  21  -2.685  -9.528   7.649
  167   2HD1  LEU  21          2HD1      LEU  21  -4.169  -8.622   7.359
  168   3HD1  LEU  21          3HD1      LEU  21  -3.671  -8.992   9.009
  169   1HD2  LEU  21          1HD2      LEU  21  -3.125  -7.435  10.126
  170   2HD2  LEU  21          2HD2      LEU  21  -3.264  -5.872   9.318
  171   3HD2  LEU  21          3HD2      LEU  21  -1.680  -6.494   9.765
  172    H    GLU  22           H        GLU  22  -1.970 -10.509   9.338
  173    HA   GLU  22           HA       GLU  22  -3.080  -9.340  11.690
  174   1HB   GLU  22          2HB       GLU  22  -4.143 -11.019  10.022
  175   2HB   GLU  22          1HB       GLU  22  -3.336 -12.239  10.999
  176   1HG   GLU  22          2HG       GLU  22  -4.567 -10.659  12.867
  177   2HG   GLU  22          1HG       GLU  22  -5.721 -10.680  11.534
  178    H    GLU  23           H        GLU  23  -0.425 -11.469  10.988
  179    HA   GLU  23           HA       GLU  23  -0.179 -12.446  13.687
  180   1HB   GLU  23          2HB       GLU  23   0.580 -13.942  12.019
  181   2HB   GLU  23          1HB       GLU  23   1.490 -12.688  11.191
  182   1HG   GLU  23          2HG       GLU  23   3.306 -13.061  12.407
  183   2HG   GLU  23          1HG       GLU  23   2.391 -13.078  13.915
  184    H    GLU  24           H        GLU  24   1.275  -9.960  11.662
  185    HA   GLU  24           HA       GLU  24   3.351  -9.240  13.440
  186   1HB   GLU  24          2HB       GLU  24   2.017  -7.867  11.138
  187   2HB   GLU  24          1HB       GLU  24   3.186  -7.010  12.133
  188   1HG   GLU  24          2HG       GLU  24   3.755  -9.611  10.736
  189   2HG   GLU  24          1HG       GLU  24   4.123  -8.023  10.064
  190    H    GLY  25           H        GLY  25  -0.024  -8.414  13.262
  191   1HA   GLY  25          2HA       GLY  25  -1.240  -7.616  15.128
  192   2HA   GLY  25          1HA       GLY  25   0.250  -6.951  15.776
  193    H    TYR  26           H        TYR  26  -1.150  -6.560  12.547
  194    HA   TYR  26           HA       TYR  26  -1.245  -3.657  13.042
  195   1HB   TYR  26          2HB       TYR  26  -0.696  -5.214  10.520
  196   2HB   TYR  26          1HB       TYR  26  -1.094  -3.504  10.501
  197    HD1  TYR  26           1HD      TYR  26   0.433  -1.906  11.734
  198    HD2  TYR  26           2HD      TYR  26   1.494  -5.944  10.932
  199    HE1  TYR  26           1HE      TYR  26   2.799  -1.347  12.088
  200    HE2  TYR  26           2HE      TYR  26   3.866  -5.398  11.282
  201    HH   TYR  26           HH       TYR  26   5.064  -2.332  11.297
  202    H    HIS  27           H        HIS  27  -2.733  -2.679  11.154
  203    HA   HIS  27           HA       HIS  27  -5.293  -4.136  11.206
  204   1HB   HIS  27          2HB       HIS  27  -4.922  -1.940  12.685
  205   2HB   HIS  27          1HB       HIS  27  -5.310  -1.157  11.157
  206    HD1  HIS  27           1HD      HIS  27  -6.826  -2.974  13.986
  207    HD2  HIS  27           2HD      HIS  27  -7.953  -1.701  10.195
  208    HE1  HIS  27           1HE      HIS  27  -9.334  -3.148  13.937
  209    HE2  HIS  27           2HE      HIS  27  -9.987  -2.440  11.609
  210    HA   PRO  28           HA       PRO  28  -4.605  -3.200   6.850
  211   1HB   PRO  28          2HB       PRO  28  -5.613  -5.460   5.859
  212   2HB   PRO  28          1HB       PRO  28  -4.038  -5.409   6.653
  213   1HG   PRO  28          2HG       PRO  28  -6.598  -6.518   7.625
  214   2HG   PRO  28          1HG       PRO  28  -4.944  -6.966   8.054
  215   1HD   PRO  28          2HD       PRO  28  -6.733  -5.264   9.500
  216   2HD   PRO  28          1HD       PRO  28  -5.056  -5.674   9.906
  217    H    ASP  29           H        ASP  29  -5.871  -1.949   5.678
  218    HA   ASP  29           HA       ASP  29  -8.778  -2.272   5.935
  219   1HB   ASP  29          2HB       ASP  29  -7.558  -0.041   6.517
  220   2HB   ASP  29          1HB       ASP  29  -7.598   0.201   4.775
  221    H    THR  30           H        THR  30  -6.549  -3.281   4.018
  222    HA   THR  30           HA       THR  30  -6.332  -3.072   1.590
  223    HB   THR  30           HB       THR  30  -6.757  -5.281   1.059
  224    HG1  THR  30           1HG      THR  30  -8.858  -5.629   1.173
  225   1HG2  THR  30          1HG2      THR  30  -6.247  -6.624   2.929
  226   2HG2  THR  30          2HG2      THR  30  -6.934  -5.446   4.047
  227   3HG2  THR  30          3HG2      THR  30  -5.444  -5.076   3.185
  228    H    ALA  31           H        ALA  31  -7.132  -2.210  -0.139
  229    HA   ALA  31           HA       ALA  31 -10.033  -1.765  -0.323
  230   1HB   ALA  31          1HB       ALA  31  -9.632   0.236  -1.284
  231   2HB   ALA  31          2HB       ALA  31  -8.256  -0.365  -2.209
  232   3HB   ALA  31          3HB       ALA  31  -8.057   0.064  -0.510
  233    H    LYS  32           H        LYS  32 -10.119  -1.221  -3.095
  234    HA   LYS  32           HA       LYS  32  -9.699  -3.931  -4.159
  235   1HB   LYS  32          2HB       LYS  32 -11.593  -1.911  -5.333
  236   2HB   LYS  32          1HB       LYS  32 -11.590  -3.657  -5.536
  237   1HG   LYS  32          2HG       LYS  32 -12.269  -3.931  -3.206
  238   2HG   LYS  32          1HG       LYS  32 -12.271  -2.179  -3.004
  239   1HD   LYS  32          2HD       LYS  32 -14.417  -2.228  -3.618
  240   2HD   LYS  32          1HD       LYS  32 -13.847  -2.597  -5.246
  241   1HE   LYS  32          2HE       LYS  32 -13.785  -5.040  -3.936
  242   2HE   LYS  32          1HE       LYS  32 -15.260  -4.274  -3.347
  243   1HZ   LYS  32          1HZ       LYS  32 -16.206  -4.302  -5.398
  244   2HZ   LYS  32          2HZ       LYS  32 -15.222  -5.669  -5.556
  245   3HZ   LYS  32          3HZ       LYS  32 -14.732  -4.194  -6.224
  246    H    THR  33           H        THR  33  -9.430  -0.495  -4.923
  247    HA   THR  33           HA       THR  33  -7.208  -1.038  -6.681
  248    HB   THR  33           HB       THR  33  -8.525   0.561  -8.407
  249    HG1  THR  33           1HG      THR  33 -10.662  -0.053  -8.517
  250   1HG2  THR  33          1HG2      THR  33  -7.540  -1.884  -8.618
  251   2HG2  THR  33          2HG2      THR  33  -8.602  -1.187  -9.842
  252   3HG2  THR  33          3HG2      THR  33  -9.255  -2.297  -8.638
  253    H    LEU  34           H        LEU  34  -6.755   1.291  -7.859
  254    HA   LEU  34           HA       LEU  34  -5.909   2.966  -5.771
  255   1HB   LEU  34          2HB       LEU  34  -6.150   3.383  -8.742
  256   2HB   LEU  34          1HB       LEU  34  -5.536   4.635  -7.677
  257    HG   LEU  34           HG       LEU  34  -4.326   1.887  -7.996
  258   1HD1  LEU  34          1HD1      LEU  34  -2.895   2.696  -9.537
  259   2HD1  LEU  34          2HD1      LEU  34  -2.857   4.307  -8.818
  260   3HD1  LEU  34          3HD1      LEU  34  -4.209   3.831  -9.847
  261   1HD2  LEU  34          1HD2      LEU  34  -3.540   2.407  -5.948
  262   2HD2  LEU  34          2HD2      LEU  34  -3.860   4.130  -6.144
  263   3HD2  LEU  34          3HD2      LEU  34  -2.418   3.413  -6.864
  264    H    ARG  35           H        ARG  35  -8.632   3.261  -8.033
  265    HA   ARG  35           HA       ARG  35  -9.566   5.746  -7.113
  266   1HB   ARG  35          2HB       ARG  35 -10.265   4.475  -9.216
  267   2HB   ARG  35          1HB       ARG  35 -11.326   3.538  -8.175
  268   1HG   ARG  35          2HG       ARG  35 -12.701   5.348  -7.728
  269   2HG   ARG  35          1HG       ARG  35 -11.468   6.524  -8.189
  270   1HD   ARG  35          2HD       ARG  35 -13.240   6.382  -9.867
  271   2HD   ARG  35          1HD       ARG  35 -11.690   5.861 -10.521
  272    HE   ARG  35           HE       ARG  35 -12.841   3.549  -9.697
  273   1HH1  ARG  35          1HH1      ARG  35 -13.889   6.153 -11.771
  274   2HH1  ARG  35          2HH1      ARG  35 -14.890   5.136 -12.750
  275   1HH2  ARG  35          1HH2      ARG  35 -14.159   2.210 -10.986
  276   2HH2  ARG  35          2HH2      ARG  35 -15.044   2.899 -12.306
  277    H    GLU  36           H        GLU  36 -10.420   2.430  -6.195
  278    HA   GLU  36           HA       GLU  36 -12.320   3.169  -4.221
  279   1HB   GLU  36          2HB       GLU  36 -11.718   0.840  -5.432
  280   2HB   GLU  36          1HB       GLU  36 -10.856   0.606  -3.917
  281   1HG   GLU  36          2HG       GLU  36 -13.042  -0.348  -3.735
  282   2HG   GLU  36          1HG       GLU  36 -12.948   1.073  -2.695
  283    H    ALA  37           H        ALA  37  -8.851   2.755  -4.232
  284    HA   ALA  37           HA       ALA  37  -8.529   2.642  -1.402
  285   1HB   ALA  37          1HB       ALA  37  -6.188   2.869  -1.810
  286   2HB   ALA  37          2HB       ALA  37  -6.474   3.529  -3.420
  287   3HB   ALA  37          3HB       ALA  37  -6.848   1.839  -3.081
  288    H    GLU  38           H        GLU  38  -8.762   5.215  -3.755
  289    HA   GLU  38           HA       GLU  38  -7.810   7.288  -2.049
  290   1HB   GLU  38          2HB       GLU  38  -9.517   7.348  -4.538
  291   2HB   GLU  38          1HB       GLU  38  -8.963   8.794  -3.706
  292   1HG   GLU  38          2HG       GLU  38  -6.725   8.387  -4.242
  293   2HG   GLU  38          1HG       GLU  38  -7.044   6.707  -4.672
  294    H    LYS  39           H        LYS  39 -10.972   5.941  -2.819
  295    HA   LYS  39           HA       LYS  39 -12.511   7.819  -1.375
  296   1HB   LYS  39          2HB       LYS  39 -13.585   6.417  -3.007
  297   2HB   LYS  39          1HB       LYS  39 -13.056   4.958  -2.182
  298   1HG   LYS  39          2HG       LYS  39 -14.804   6.899  -0.745
  299   2HG   LYS  39          1HG       LYS  39 -15.507   5.802  -1.935
  300   1HD   LYS  39          2HD       LYS  39 -14.029   4.049  -0.557
  301   2HD   LYS  39          1HD       LYS  39 -14.327   5.230   0.720
  302   1HE   LYS  39          2HE       LYS  39 -16.806   5.003  -0.326
  303   2HE   LYS  39          1HE       LYS  39 -16.184   3.382  -0.632
  304   1HZ   LYS  39          1HZ       LYS  39 -17.323   3.611   1.527
  305   2HZ   LYS  39          2HZ       LYS  39 -16.141   4.718   2.019
  306   3HZ   LYS  39          3HZ       LYS  39 -15.713   3.115   1.685
  307    H    LYS  40           H        LYS  40 -10.822   4.880  -0.474
  308    HA   LYS  40           HA       LYS  40 -11.979   4.695   2.137
  309   1HB   LYS  40          2HB       LYS  40  -9.577   3.403   0.863
  310   2HB   LYS  40          1HB       LYS  40 -10.057   3.090   2.524
  311   1HG   LYS  40          2HG       LYS  40 -12.374   2.548   1.409
  312   2HG   LYS  40          1HG       LYS  40 -11.368   2.278  -0.015
  313   1HD   LYS  40          2HD       LYS  40 -10.036   0.654   1.200
  314   2HD   LYS  40          1HD       LYS  40 -10.954   0.971   2.673
  315   1HE   LYS  40          2HE       LYS  40 -12.933   0.365   0.894
  316   2HE   LYS  40          1HE       LYS  40 -11.624  -0.681   0.347
  317   1HZ   LYS  40          1HZ       LYS  40 -12.866  -0.597   3.036
  318   2HZ   LYS  40          2HZ       LYS  40 -11.424  -1.421   2.715
  319   3HZ   LYS  40          3HZ       LYS  40 -12.855  -1.886   1.940
  320    H    ILE  41           H        ILE  41  -9.053   6.089   0.770
  321    HA   ILE  41           HA       ILE  41  -7.892   6.758   3.303
  322    HB   ILE  41           HB       ILE  41  -7.242   7.836   0.557
  323   1HG1  ILE  41          2HG1      ILE  41  -5.536   5.838   1.961
  324   2HG1  ILE  41          1HG1      ILE  41  -7.026   5.262   1.222
  325   1HG2  ILE  41          1HG2      ILE  41  -6.109   8.303   3.237
  326   2HG2  ILE  41          2HG2      ILE  41  -6.109   9.334   1.805
  327   3HG2  ILE  41          3HG2      ILE  41  -4.944   8.018   1.943
  328   1HD1  ILE  41          1HD1      ILE  41  -6.260   6.318  -0.913
  329   2HD1  ILE  41          2HD1      ILE  41  -5.281   4.964  -0.350
  330   3HD1  ILE  41          3HD1      ILE  41  -4.710   6.618  -0.126
  331    H    LYS  42           H        LYS  42 -10.130   8.274   1.126
  332    HA   LYS  42           HA       LYS  42  -9.793  10.939   2.057
  333   1HB   LYS  42          2HB       LYS  42 -11.033   9.844  -0.069
  334   2HB   LYS  42          1HB       LYS  42 -12.415  10.173   0.965
  335   1HG   LYS  42          2HG       LYS  42 -10.671  12.445   0.921
  336   2HG   LYS  42          1HG       LYS  42 -11.064  11.953  -0.726
  337   1HD   LYS  42          2HD       LYS  42 -13.494  11.778   0.512
  338   2HD   LYS  42          1HD       LYS  42 -12.760  13.154   1.340
  339   1HE   LYS  42          2HE       LYS  42 -13.412  14.396  -0.391
  340   2HE   LYS  42          1HE       LYS  42 -12.162  13.582  -1.331
  341   1HZ   LYS  42          1HZ       LYS  42 -14.149  11.812  -1.484
  342   2HZ   LYS  42          2HZ       LYS  42 -13.900  13.038  -2.623
  343   3HZ   LYS  42          3HZ       LYS  42 -15.042  13.245  -1.394
  344    H    GLU  43           H        GLU  43 -11.078   8.255   3.587
  345    HA   GLU  43           HA       GLU  43 -12.852   9.914   5.238
  346   1HB   GLU  43          2HB       GLU  43 -12.884   6.929   4.799
  347   2HB   GLU  43          1HB       GLU  43 -13.946   7.793   5.901
  348   1HG   GLU  43          2HG       GLU  43 -14.898   9.026   4.024
  349   2HG   GLU  43          1HG       GLU  43 -13.829   8.168   2.916
  350    H    LEU  44           H        LEU  44 -10.155   7.699   5.247
  351    HA   LEU  44           HA       LEU  44  -9.773   8.271   8.107
  352   1HB   LEU  44          2HB       LEU  44 -10.338   6.060   8.280
  353   2HB   LEU  44          1HB       LEU  44  -9.774   5.674   6.668
  354    HG   LEU  44           HG       LEU  44  -7.779   6.316   8.805
  355   1HD1  LEU  44          1HD1      LEU  44  -8.684   3.507   8.385
  356   2HD1  LEU  44          2HD1      LEU  44  -9.543   4.546   9.523
  357   3HD1  LEU  44          3HD1      LEU  44  -7.824   4.222   9.749
  358   1HD2  LEU  44          1HD2      LEU  44  -7.359   4.155   6.865
  359   2HD2  LEU  44          2HD2      LEU  44  -6.286   5.464   7.358
  360   3HD2  LEU  44          3HD2      LEU  44  -7.546   5.760   6.159
  361    H    PHE  45           H        PHE  45  -7.558   8.247   8.829
  362    HA   PHE  45           HA       PHE  45  -5.744   9.201   6.748
  363   1HB   PHE  45          2HB       PHE  45  -6.048  10.591   8.759
  364   2HB   PHE  45          1HB       PHE  45  -5.468   9.264   9.762
  365    HD1  PHE  45           1HD      PHE  45  -4.545  11.988   7.564
  366    HD2  PHE  45           2HD      PHE  45  -3.107   8.567   9.645
  367    HE1  PHE  45           1HE      PHE  45  -2.238  12.793   7.284
  368    HE2  PHE  45           2HE      PHE  45  -0.796   9.366   9.371
  369    HZ   PHE  45           HZ       PHE  45  -0.360  11.482   8.188
  370    H    PHE  46           H        PHE  46  -4.884   7.442   5.751
  371    HA   PHE  46           HA       PHE  46  -3.967   5.151   7.228
  372   1HB   PHE  46          2HB       PHE  46  -3.956   5.954   4.337
  373   2HB   PHE  46          1HB       PHE  46  -3.011   4.572   4.881
  374    HD1  PHE  46           1HD      PHE  46  -6.195   5.702   3.812
  375    HD2  PHE  46           2HD      PHE  46  -4.258   2.750   6.184
  376    HE1  PHE  46           1HE      PHE  46  -8.194   4.273   3.659
  377    HE2  PHE  46           2HE      PHE  46  -6.250   1.316   6.036
  378    HZ   PHE  46           HZ       PHE  46  -8.223   2.080   4.774
  379    HA   PRO  47           HA       PRO  47   0.122   6.928   7.791
  380   1HB   PRO  47          2HB       PRO  47   1.098   5.069   9.444
  381   2HB   PRO  47          1HB       PRO  47  -0.156   6.195   9.978
  382   1HG   PRO  47          2HG       PRO  47  -0.408   3.343   9.128
  383   2HG   PRO  47          1HG       PRO  47  -1.220   4.190  10.454
  384   1HD   PRO  47          2HD       PRO  47  -2.344   3.690   7.974
  385   2HD   PRO  47          1HD       PRO  47  -2.879   4.959   9.092
  386    H    VAL  48           H        VAL  48  -0.646   3.773   6.564
  387    HA   VAL  48           HA       VAL  48   1.748   3.788   4.929
  388    HB   VAL  48           HB       VAL  48   1.060   1.264   6.399
  389   1HG1  VAL  48          1HG1      VAL  48   2.702   1.718   4.293
  390   2HG1  VAL  48          2HG1      VAL  48   2.915   0.411   5.457
  391   3HG1  VAL  48          3HG1      VAL  48   3.824   1.911   5.639
  392   1HG2  VAL  48          1HG2      VAL  48   1.463   2.931   8.097
  393   2HG2  VAL  48          2HG2      VAL  48   2.956   3.419   7.296
  394   3HG2  VAL  48          3HG2      VAL  48   2.823   1.810   8.010
  395    H    ILE  49           H        ILE  49   1.350   3.035   2.950
  396    HA   ILE  49           HA       ILE  49  -1.153   1.571   2.466
  397    HB   ILE  49           HB       ILE  49   0.195   3.363   0.450
  398   1HG1  ILE  49          2HG1      ILE  49  -0.475   4.689   2.439
  399   2HG1  ILE  49          1HG1      ILE  49  -1.401   5.108   1.001
  400   1HG2  ILE  49          1HG2      ILE  49  -2.282   1.755   0.564
  401   2HG2  ILE  49          2HG2      ILE  49  -1.223   2.117  -0.799
  402   3HG2  ILE  49          3HG2      ILE  49  -2.385   3.321  -0.242
  403   1HD1  ILE  49          1HD1      ILE  49  -2.292   3.499   3.371
  404   2HD1  ILE  49          2HD1      ILE  49  -3.197   3.568   1.859
  405   3HD1  ILE  49          3HD1      ILE  49  -2.926   5.040   2.791
  406    H    VAL  50           H        VAL  50  -1.078   0.151   0.537
  407    HA   VAL  50           HA       VAL  50   1.539  -0.604  -0.432
  408    HB   VAL  50           HB       VAL  50  -0.134  -2.568   1.142
  409   1HG1  VAL  50          1HG1      VAL  50   2.173  -3.864   0.662
  410   2HG1  VAL  50          2HG1      VAL  50   2.050  -2.910  -0.816
  411   3HG1  VAL  50          3HG1      VAL  50   0.747  -4.009  -0.365
  412   1HG2  VAL  50          1HG2      VAL  50   2.115  -2.698   2.415
  413   2HG2  VAL  50          2HG2      VAL  50   1.021  -1.352   2.735
  414   3HG2  VAL  50          3HG2      VAL  50   2.421  -1.121   1.690
  415    H    LEU  51           H        LEU  51   0.951  -0.290  -2.493
  416    HA   LEU  51           HA       LEU  51  -1.560  -1.067  -3.559
  417   1HB   LEU  51          2HB       LEU  51   0.049   0.715  -4.448
  418   2HB   LEU  51          1HB       LEU  51   0.926  -0.612  -5.186
  419    HG   LEU  51           HG       LEU  51  -0.946  -1.179  -6.577
  420   1HD1  LEU  51          1HD1      LEU  51  -2.904  -0.924  -5.444
  421   2HD1  LEU  51          2HD1      LEU  51  -2.940   0.553  -6.407
  422   3HD1  LEU  51          3HD1      LEU  51  -2.418   0.611  -4.723
  423   1HD2  LEU  51          1HD2      LEU  51  -0.147   1.696  -6.488
  424   2HD2  LEU  51          2HD2      LEU  51  -1.360   1.156  -7.649
  425   3HD2  LEU  51          3HD2      LEU  51   0.257   0.453  -7.671
  426    H    ASP  52           H        ASP  52  -1.737  -2.551  -5.443
  427    HA   ASP  52           HA       ASP  52   0.076  -4.761  -5.638
  428   1HB   ASP  52          2HB       ASP  52  -1.572  -5.017  -3.529
  429   2HB   ASP  52          1HB       ASP  52  -2.619  -5.667  -4.787
  430    H    VAL  53           H        VAL  53  -0.114  -3.778  -7.770
  431    HA   VAL  53           HA       VAL  53  -2.491  -3.765  -9.266
  432    HB   VAL  53           HB       VAL  53   0.336  -4.028 -10.298
  433   1HG1  VAL  53          1HG1      VAL  53  -0.484  -3.142 -12.360
  434   2HG1  VAL  53          2HG1      VAL  53  -2.086  -2.879 -11.670
  435   3HG1  VAL  53          3HG1      VAL  53  -1.493  -4.520 -11.923
  436   1HG2  VAL  53          1HG2      VAL  53   0.298  -2.109  -8.922
  437   2HG2  VAL  53          2HG2      VAL  53  -1.292  -1.625  -9.512
  438   3HG2  VAL  53          3HG2      VAL  53   0.110  -1.522 -10.575
  439    H    TRP  54           H        TRP  54  -3.338  -5.909  -8.592
  440    HA   TRP  54           HA       TRP  54  -2.119  -8.311  -9.484
  441   1HB   TRP  54          2HB       TRP  54  -3.767  -8.378  -7.708
  442   2HB   TRP  54          1HB       TRP  54  -4.992  -7.682  -8.762
  443    HD1  TRP  54           HD       TRP  54  -6.704  -9.502  -9.289
  444    HE1  TRP  54           1HE      TRP  54  -6.619 -11.990  -9.938
  445    HE3  TRP  54           3HE      TRP  54  -1.657 -10.244  -8.990
  446    HZ2  TRP  54           2HZ      TRP  54  -4.668 -14.003 -10.278
  447    HZ3  TRP  54           3HZ      TRP  54  -0.761 -12.481  -9.492
  448    HH2  TRP  54           HH       TRP  54  -2.237 -14.320 -10.122
  449    H    MET  55           H        MET  55  -5.294  -7.214 -10.618
  450    HA   MET  55           HA       MET  55  -4.397  -7.143 -13.365
  451   1HB   MET  55          2HB       MET  55  -6.119  -9.331 -12.274
  452   2HB   MET  55          1HB       MET  55  -6.393  -8.764 -13.915
  453   1HG   MET  55          2HG       MET  55  -3.644  -9.133 -13.748
  454   2HG   MET  55          1HG       MET  55  -4.337 -10.502 -12.880
  455   1HE   MET  55          1HE       MET  55  -3.803  -8.802 -16.379
  456   2HE   MET  55          2HE       MET  55  -3.642 -10.354 -17.198
  457   3HE   MET  55          3HE       MET  55  -2.664 -10.003 -15.773
  458    HA   PRO  56           HA       PRO  56  -8.251  -4.651 -12.506
  459   1HB   PRO  56          2HB       PRO  56  -7.357  -2.502 -11.088
  460   2HB   PRO  56          1HB       PRO  56  -7.903  -4.001 -10.335
  461   1HG   PRO  56          2HG       PRO  56  -5.229  -2.901 -10.427
  462   2HG   PRO  56          1HG       PRO  56  -5.805  -4.327  -9.552
  463   1HD   PRO  56          2HD       PRO  56  -4.435  -4.149 -12.160
  464   2HD   PRO  56          1HD       PRO  56  -4.566  -5.519 -11.044
  465    H    ASP  57           H        ASP  57  -5.639  -2.271 -12.352
  466    HA   ASP  57           HA       ASP  57  -5.511  -1.713 -15.123
  467   1HB   ASP  57          2HB       ASP  57  -7.480  -0.218 -13.485
  468   2HB   ASP  57          1HB       ASP  57  -6.519   0.704 -14.638
  469    H    GLY  58           H        GLY  58  -5.359  -0.138 -11.938
  470   1HA   GLY  58          2HA       GLY  58  -3.735   1.149 -10.952
  471   2HA   GLY  58          1HA       GLY  58  -2.605   0.103 -11.794
  472    H    ASP  59           H        ASP  59  -1.102   1.378 -12.650
  473    HA   ASP  59           HA       ASP  59  -0.104   2.972 -13.925
  474   1HB   ASP  59          2HB       ASP  59  -2.782   2.689 -15.201
  475   2HB   ASP  59          1HB       ASP  59  -1.797   4.072 -15.668
  476    H    GLY  60           H        GLY  60  -0.906   3.765 -11.418
  477   1HA   GLY  60          2HA       GLY  60  -1.925   6.503 -11.853
  478   2HA   GLY  60          1HA       GLY  60  -2.105   5.607 -10.353
  479    H    VAL  61           H        VAL  61   0.451   6.804 -12.531
  480    HA   VAL  61           HA       VAL  61   2.532   6.757 -10.677
  481    HB   VAL  61           HB       VAL  61   2.106   8.557 -13.065
  482   1HG1  VAL  61          1HG1      VAL  61   4.606   8.047 -11.466
  483   2HG1  VAL  61          2HG1      VAL  61   3.716   9.566 -11.574
  484   3HG1  VAL  61          3HG1      VAL  61   4.533   8.921 -12.997
  485   1HG2  VAL  61          1HG2      VAL  61   3.923   6.177 -12.889
  486   2HG2  VAL  61          2HG2      VAL  61   3.309   6.997 -14.324
  487   3HG2  VAL  61          3HG2      VAL  61   2.227   6.014 -13.339
  488    H    ASN  62           H        ASN  62   0.030   9.134 -11.286
  489    HA   ASN  62           HA       ASN  62   1.235  11.106  -9.549
  490   1HB   ASN  62          2HB       ASN  62  -0.784  11.095 -11.572
  491   2HB   ASN  62          1HB       ASN  62  -1.478  11.761 -10.097
  492   1HD2  ASN  62          1HD2      ASN  62   0.700  12.245 -12.695
  493   2HD2  ASN  62          2HD2      ASN  62   1.192  13.848 -12.278
  494    H    PHE  63           H        PHE  63  -0.153   8.294  -8.805
  495    HA   PHE  63           HA       PHE  63  -2.125   9.060  -6.895
  496   1HB   PHE  63          2HB       PHE  63  -2.067   6.814  -7.946
  497   2HB   PHE  63          1HB       PHE  63  -0.577   6.467  -7.074
  498    HD1  PHE  63           1HD      PHE  63  -3.746   8.094  -5.993
  499    HD2  PHE  63           2HD      PHE  63  -1.045   4.843  -5.501
  500    HE1  PHE  63           1HE      PHE  63  -5.059   7.301  -4.072
  501    HE2  PHE  63           2HE      PHE  63  -2.355   4.042  -3.578
  502    HZ   PHE  63           HZ       PHE  63  -4.366   5.273  -2.862
  503    H    ILE  64           H        ILE  64   1.332   8.442  -6.765
  504    HA   ILE  64           HA       ILE  64   1.751   8.172  -4.054
  505    HB   ILE  64           HB       ILE  64   3.524   9.772  -5.900
  506   1HG1  ILE  64          2HG1      ILE  64   4.427   7.087  -5.560
  507   2HG1  ILE  64          1HG1      ILE  64   2.741   7.032  -6.064
  508   1HG2  ILE  64          1HG2      ILE  64   5.128   9.679  -4.327
  509   2HG2  ILE  64          2HG2      ILE  64   4.674   8.056  -3.810
  510   3HG2  ILE  64          3HG2      ILE  64   3.769   9.451  -3.225
  511   1HD1  ILE  64          1HD1      ILE  64   5.100   7.652  -7.591
  512   2HD1  ILE  64          2HD1      ILE  64   3.894   8.930  -7.719
  513   3HD1  ILE  64          3HD1      ILE  64   3.469   7.271  -8.138
  514    H    ASP  65           H        ASP  65   1.038  11.073  -5.886
  515    HA   ASP  65           HA       ASP  65   1.647  12.892  -3.764
  516   1HB   ASP  65          2HB       ASP  65   1.415  13.296  -6.365
  517   2HB   ASP  65          1HB       ASP  65  -0.270  13.599  -5.950
  518    H    PHE  66           H        PHE  66  -1.191  11.149  -4.835
  519    HA   PHE  66           HA       PHE  66  -3.148  12.551  -3.395
  520   1HB   PHE  66          2HB       PHE  66  -3.791  10.955  -5.092
  521   2HB   PHE  66          1HB       PHE  66  -3.004   9.642  -4.224
  522    HD1  PHE  66           1HD      PHE  66  -3.979   8.796  -2.119
  523    HD2  PHE  66           2HD      PHE  66  -5.983  11.669  -4.536
  524    HE1  PHE  66           1HE      PHE  66  -6.089   8.299  -0.955
  525    HE2  PHE  66           2HE      PHE  66  -8.096  11.178  -3.376
  526    HZ   PHE  66           HZ       PHE  66  -8.151   9.491  -1.583
  527    H    ILE  67           H        ILE  67  -1.072   9.830  -2.490
  528    HA   ILE  67           HA       ILE  67  -2.176   9.355   0.051
  529    HB   ILE  67           HB       ILE  67   0.597   8.859  -1.036
  530   1HG1  ILE  67          2HG1      ILE  67  -0.290   6.445  -0.764
  531   2HG1  ILE  67          1HG1      ILE  67  -1.875   7.194  -0.624
  532   1HG2  ILE  67          1HG2      ILE  67   1.037   8.988   1.248
  533   2HG2  ILE  67          2HG2      ILE  67   0.737   7.270   0.988
  534   3HG2  ILE  67          3HG2      ILE  67  -0.522   8.290   1.685
  535   1HD1  ILE  67          1HD1      ILE  67  -0.160   7.910  -2.942
  536   2HD1  ILE  67          2HD1      ILE  67  -1.917   7.832  -2.816
  537   3HD1  ILE  67          3HD1      ILE  67  -0.975   6.345  -2.927
  538    H    LYS  68           H        LYS  68   0.481  11.456  -1.008
  539    HA   LYS  68           HA       LYS  68   1.021  12.438   1.630
  540   1HB   LYS  68          2HB       LYS  68   1.839  13.495  -1.083
  541   2HB   LYS  68          1HB       LYS  68   2.451  14.094   0.452
  542   1HG   LYS  68          2HG       LYS  68   2.724  11.206   0.133
  543   2HG   LYS  68          1HG       LYS  68   3.606  12.144  -1.072
  544   1HD   LYS  68          2HD       LYS  68   4.306  13.527   1.089
  545   2HD   LYS  68          1HD       LYS  68   3.990  11.974   1.867
  546   1HE   LYS  68          2HE       LYS  68   5.578  11.824  -0.599
  547   2HE   LYS  68          1HE       LYS  68   6.353  12.689   0.728
  548   1HZ   LYS  68          1HZ       LYS  68   5.596  10.623   2.083
  549   2HZ   LYS  68          2HZ       LYS  68   6.993  10.541   1.132
  550   3HZ   LYS  68          3HZ       LYS  68   5.547   9.868   0.569
  551    H    GLU  69           H        GLU  69  -1.198  13.223  -0.886
  552    HA   GLU  69           HA       GLU  69  -1.680  15.933  -0.245
  553   1HB   GLU  69          2HB       GLU  69  -2.345  14.698  -2.363
  554   2HB   GLU  69          1HB       GLU  69  -3.681  14.027  -1.439
  555   1HG   GLU  69          2HG       GLU  69  -4.074  16.602  -0.898
  556   2HG   GLU  69          1HG       GLU  69  -3.261  16.771  -2.453
  557    H    ASN  70           H        ASN  70  -3.052  12.897   0.889
  558    HA   ASN  70           HA       ASN  70  -4.484  14.404   2.978
  559   1HB   ASN  70          2HB       ASN  70  -5.475  11.729   2.068
  560   2HB   ASN  70          1HB       ASN  70  -6.365  13.057   2.806
  561   1HD2  ASN  70          1HD2      ASN  70  -4.594  12.199  -0.133
  562   2HD2  ASN  70          2HD2      ASN  70  -5.607  13.088  -1.213
  563    H    SER  71           H        SER  71  -1.794  12.935   2.753
  564    HA   SER  71           HA       SER  71  -1.800  11.893   5.396
  565   1HB   SER  71          2HB       SER  71  -2.380  10.044   3.267
  566   2HB   SER  71          1HB       SER  71  -0.834   9.629   4.005
  567    HG   SER  71           HG       SER  71  -3.266  10.054   5.408
  568    HA   PRO  72           HA       PRO  72   2.226  13.417   3.595
  569   1HB   PRO  72          2HB       PRO  72   2.269  15.141   5.957
  570   2HB   PRO  72          1HB       PRO  72   2.405  15.582   4.253
  571   1HG   PRO  72          2HG       PRO  72   0.220  16.166   5.731
  572   2HG   PRO  72          1HG       PRO  72   0.133  15.816   3.996
  573   1HD   PRO  72          2HD       PRO  72  -0.505  14.044   6.322
  574   2HD   PRO  72          1HD       PRO  72  -1.358  14.224   4.773
  575    H    ASP  73           H        ASP  73   1.132  12.264   6.621
  576    HA   ASP  73           HA       ASP  73   3.867  11.548   7.423
  577   1HB   ASP  73          2HB       ASP  73   2.467  12.880   9.027
  578   2HB   ASP  73          1HB       ASP  73   1.388  11.494   9.144
  579    H    SER  74           H        SER  74   2.327  10.142   5.392
  580    HA   SER  74           HA       SER  74   1.863   7.564   6.725
  581   1HB   SER  74          2HB       SER  74  -0.047   8.469   5.441
  582   2HB   SER  74          1HB       SER  74   0.951   8.472   3.987
  583    HG   SER  74           HG       SER  74  -0.520   6.519   4.808
  584    H    VAL  75           H        VAL  75   2.075   5.942   4.413
  585    HA   VAL  75           HA       VAL  75   4.732   6.395   3.330
  586    HB   VAL  75           HB       VAL  75   4.144   3.888   4.910
  587   1HG1  VAL  75          1HG1      VAL  75   6.511   4.754   3.240
  588   2HG1  VAL  75          2HG1      VAL  75   5.446   3.377   2.956
  589   3HG1  VAL  75          3HG1      VAL  75   6.534   3.379   4.345
  590   1HG2  VAL  75          1HG2      VAL  75   4.641   5.548   6.488
  591   2HG2  VAL  75          2HG2      VAL  75   5.854   6.300   5.452
  592   3HG2  VAL  75          3HG2      VAL  75   6.183   4.740   6.205
  593    H    VAL  76           H        VAL  76   4.962   5.613   1.341
  594    HA   VAL  76           HA       VAL  76   2.758   3.983   0.278
  595    HB   VAL  76           HB       VAL  76   4.723   5.640  -1.300
  596   1HG1  VAL  76          1HG1      VAL  76   3.151   3.629  -2.190
  597   2HG1  VAL  76          2HG1      VAL  76   3.633   5.015  -3.168
  598   3HG1  VAL  76          3HG1      VAL  76   2.060   5.002  -2.371
  599   1HG2  VAL  76          1HG2      VAL  76   1.959   6.584  -1.117
  600   2HG2  VAL  76          2HG2      VAL  76   3.475   7.482  -1.024
  601   3HG2  VAL  76          3HG2      VAL  76   2.847   6.660   0.405
  602    H    ILE  77           H        ILE  77   3.152   1.914  -0.037
  603    HA   ILE  77           HA       ILE  77   5.859   1.085  -0.861
  604    HB   ILE  77           HB       ILE  77   3.948  -0.681   0.651
  605   1HG1  ILE  77          2HG1      ILE  77   4.478   1.274   2.049
  606   2HG1  ILE  77          1HG1      ILE  77   5.225  -0.190   2.682
  607   1HG2  ILE  77          1HG2      ILE  77   5.948  -1.524  -0.771
  608   2HG2  ILE  77          2HG2      ILE  77   5.693  -2.178   0.847
  609   3HG2  ILE  77          3HG2      ILE  77   6.923  -0.943   0.579
  610   1HD1  ILE  77          1HD1      ILE  77   7.203   0.781   1.096
  611   2HD1  ILE  77          2HD1      ILE  77   7.054   1.077   2.829
  612   3HD1  ILE  77          3HD1      ILE  77   6.444   2.264   1.675
  613    H    VAL  78           H        VAL  78   4.160   1.810  -2.832
  614    HA   VAL  78           HA       VAL  78   2.319   0.096  -3.910
  615    HB   VAL  78           HB       VAL  78   4.493   1.572  -5.416
  616   1HG1  VAL  78          1HG1      VAL  78   1.824   0.599  -6.429
  617   2HG1  VAL  78          2HG1      VAL  78   3.368  -0.184  -6.759
  618   3HG1  VAL  78          3HG1      VAL  78   3.061   1.448  -7.353
  619   1HG2  VAL  78          1HG2      VAL  78   1.855   2.378  -4.283
  620   2HG2  VAL  78          2HG2      VAL  78   2.425   3.138  -5.770
  621   3HG2  VAL  78          3HG2      VAL  78   3.389   3.247  -4.297
  622    H    ILE  79           H        ILE  79   2.294  -1.859  -4.849
  623    HA   ILE  79           HA       ILE  79   4.851  -3.165  -5.479
  624    HB   ILE  79           HB       ILE  79   2.608  -4.754  -4.292
  625   1HG1  ILE  79          2HG1      ILE  79   4.753  -3.314  -2.721
  626   2HG1  ILE  79          1HG1      ILE  79   3.037  -2.930  -2.704
  627   1HG2  ILE  79          1HG2      ILE  79   4.761  -5.980  -3.441
  628   2HG2  ILE  79          2HG2      ILE  79   5.528  -5.095  -4.760
  629   3HG2  ILE  79          3HG2      ILE  79   4.195  -6.198  -5.097
  630   1HD1  ILE  79          1HD1      ILE  79   3.791  -4.222  -0.739
  631   2HD1  ILE  79          2HD1      ILE  79   4.199  -5.558  -1.817
  632   3HD1  ILE  79          3HD1      ILE  79   2.524  -5.028  -1.664
  633    H    THR  80           H        THR  80   4.490  -5.193  -6.813
  634    HA   THR  80           HA       THR  80   3.696  -6.235  -8.672
  635    HB   THR  80           HB       THR  80   1.022  -5.050  -8.718
  636    HG1  THR  80           1HG      THR  80   1.887  -6.382  -6.368
  637   1HG2  THR  80          1HG2      THR  80   0.998  -7.059  -9.756
  638   2HG2  THR  80          2HG2      THR  80   0.549  -7.571  -8.129
  639   3HG2  THR  80          3HG2      THR  80   2.212  -7.758  -8.687
  640    H    GLY  81           H        GLY  81   3.135  -5.855 -10.905
  641   1HA   GLY  81          2HA       GLY  81   2.813  -3.094 -11.759
  642   2HA   GLY  81          1HA       GLY  81   4.340  -3.849 -12.191
  643    H    HIS  82           H        HIS  82   2.909  -2.982 -14.242
  644    HA   HIS  82           HA       HIS  82   0.929  -4.659 -15.284
  645   1HB   HIS  82          2HB       HIS  82   1.679  -3.721 -17.521
  646   2HB   HIS  82          1HB       HIS  82   1.228  -2.534 -16.302
  647    HD1  HIS  82           1HD      HIS  82   4.127  -3.778 -18.275
  648    HD2  HIS  82           2HD      HIS  82   3.358  -0.978 -15.303
  649    HE1  HIS  82           1HE      HIS  82   6.183  -2.333 -18.165
  650    HE2  HIS  82           2HE      HIS  82   5.725  -0.696 -16.305
  651    H    GLY  83           H        GLY  83   4.440  -4.661 -15.897
  652   1HA   GLY  83          2HA       GLY  83   4.493  -7.517 -16.117
  653   2HA   GLY  83          1HA       GLY  83   4.634  -6.733 -17.684
  654    H    SER  84           H        SER  84   6.167  -4.531 -17.065
  655    HA   SER  84           HA       SER  84   8.719  -5.809 -16.375
  656   1HB   SER  84          2HB       SER  84   8.137  -4.461 -18.622
  657   2HB   SER  84          1HB       SER  84   8.671  -3.110 -17.621
  658    HG   SER  84           HG       SER  84  10.655  -3.831 -17.702
  659    H    VAL  85           H        VAL  85  10.356  -4.285 -15.369
  660    HA   VAL  85           HA       VAL  85   9.130  -3.090 -13.024
  661    HB   VAL  85           HB       VAL  85  12.070  -3.349 -13.664
  662   1HG1  VAL  85          1HG1      VAL  85  10.510  -2.487 -11.284
  663   2HG1  VAL  85          2HG1      VAL  85  12.027  -1.860 -11.930
  664   3HG1  VAL  85          3HG1      VAL  85  12.011  -3.376 -11.027
  665   1HG2  VAL  85          1HG2      VAL  85  10.374  -5.453 -13.373
  666   2HG2  VAL  85          2HG2      VAL  85  10.880  -5.183 -11.705
  667   3HG2  VAL  85          3HG2      VAL  85  12.088  -5.482 -12.956
  668    H    ASP  86           H        ASP  86   8.212  -1.406 -14.598
  669    HA   ASP  86           HA       ASP  86  10.142   0.802 -14.896
  670   1HB   ASP  86          2HB       ASP  86   9.239   0.004 -17.045
  671   2HB   ASP  86          1HB       ASP  86   7.603   0.309 -16.469
  672    H    THR  87           H        THR  87   6.612   0.288 -14.452
  673    HA   THR  87           HA       THR  87   5.923   2.770 -13.529
  674    HB   THR  87           HB       THR  87   4.400   0.779 -13.933
  675    HG1  THR  87           1HG      THR  87   2.906   1.502 -12.348
  676   1HG2  THR  87          1HG2      THR  87   5.432  -0.874 -12.498
  677   2HG2  THR  87          2HG2      THR  87   3.774  -0.562 -11.984
  678   3HG2  THR  87          3HG2      THR  87   5.123   0.131 -11.083
  679    H    ALA  88           H        ALA  88   7.562   0.203 -11.821
  680    HA   ALA  88           HA       ALA  88   7.366   1.139  -9.199
  681   1HB   ALA  88          1HB       ALA  88   9.766  -0.241 -10.386
  682   2HB   ALA  88          2HB       ALA  88   8.279  -1.080  -9.944
  683   3HB   ALA  88          3HB       ALA  88   9.232  -0.263  -8.707
  684    H    VAL  89           H        VAL  89  10.058   1.563 -11.475
  685    HA   VAL  89           HA       VAL  89  11.444   3.453  -9.934
  686    HB   VAL  89           HB       VAL  89  12.727   3.941 -11.949
  687   1HG1  VAL  89          1HG1      VAL  89  13.611   2.029 -11.101
  688   2HG1  VAL  89          2HG1      VAL  89  13.052   1.396 -12.650
  689   3HG1  VAL  89          3HG1      VAL  89  12.084   1.150 -11.196
  690   1HG2  VAL  89          1HG2      VAL  89  12.119   3.381 -14.105
  691   2HG2  VAL  89          2HG2      VAL  89  10.561   3.821 -13.405
  692   3HG2  VAL  89          3HG2      VAL  89  11.003   2.123 -13.576
  693    H    LYS  90           H        LYS  90   8.716   3.747 -12.045
  694    HA   LYS  90           HA       LYS  90   8.970   6.611 -12.370
  695   1HB   LYS  90          2HB       LYS  90   8.026   5.238 -14.172
  696   2HB   LYS  90          1HB       LYS  90   6.720   4.735 -13.110
  697   1HG   LYS  90          2HG       LYS  90   5.747   6.864 -13.109
  698   2HG   LYS  90          1HG       LYS  90   7.200   7.622 -13.757
  699   1HD   LYS  90          2HD       LYS  90   6.024   5.511 -15.436
  700   2HD   LYS  90          1HD       LYS  90   5.036   6.960 -15.242
  701   1HE   LYS  90          2HE       LYS  90   7.937   7.204 -15.920
  702   2HE   LYS  90          1HE       LYS  90   6.765   6.823 -17.182
  703   1HZ   LYS  90          1HZ       LYS  90   7.397   9.297 -16.514
  704   2HZ   LYS  90          2HZ       LYS  90   6.121   9.060 -15.430
  705   3HZ   LYS  90          3HZ       LYS  90   5.865   8.877 -17.094
  706    H    ALA  91           H        ALA  91   7.572   4.453 -10.098
  707    HA   ALA  91           HA       ALA  91   5.822   6.566  -9.050
  708   1HB   ALA  91          1HB       ALA  91   4.938   4.626  -7.622
  709   2HB   ALA  91          2HB       ALA  91   5.826   3.585  -8.735
  710   3HB   ALA  91          3HB       ALA  91   4.546   4.636  -9.342
  711    H    ILE  92           H        ILE  92   8.550   4.517  -8.236
  712    HA   ILE  92           HA       ILE  92   8.583   5.285  -5.471
  713    HB   ILE  92           HB       ILE  92  10.515   3.965  -5.220
  714   1HG1  ILE  92          2HG1      ILE  92  10.835   4.079  -8.228
  715   2HG1  ILE  92          1HG1      ILE  92  11.870   4.865  -7.041
  716   1HG2  ILE  92          1HG2      ILE  92   9.826   1.989  -6.975
  717   2HG2  ILE  92          2HG2      ILE  92   8.351   2.949  -6.907
  718   3HG2  ILE  92          3HG2      ILE  92   9.041   2.291  -5.427
  719   1HD1  ILE  92          1HD1      ILE  92  13.106   3.012  -7.574
  720   2HD1  ILE  92          2HD1      ILE  92  11.684   1.989  -7.787
  721   3HD1  ILE  92          3HD1      ILE  92  12.218   2.432  -6.165
  722    H    LYS  93           H        LYS  93   9.727   6.698  -8.364
  723    HA   LYS  93           HA       LYS  93  11.835   8.215  -7.083
  724   1HB   LYS  93          2HB       LYS  93  10.906   7.756  -9.833
  725   2HB   LYS  93          1HB       LYS  93  11.477   9.391  -9.527
  726   1HG   LYS  93          2HG       LYS  93  13.616   8.752  -9.393
  727   2HG   LYS  93          1HG       LYS  93  13.228   7.296  -8.474
  728   1HD   LYS  93          2HD       LYS  93  12.914   6.024 -10.367
  729   2HD   LYS  93          1HD       LYS  93  12.498   7.420 -11.364
  730   1HE   LYS  93          2HE       LYS  93  15.075   7.978 -10.657
  731   2HE   LYS  93          1HE       LYS  93  15.109   6.220 -10.786
  732   1HZ   LYS  93          1HZ       LYS  93  15.456   6.673 -12.944
  733   2HZ   LYS  93          2HZ       LYS  93  14.781   8.221 -12.857
  734   3HZ   LYS  93          3HZ       LYS  93  13.777   6.868 -13.001
  735    H    LYS  94           H        LYS  94   8.470   8.526  -7.583
  736    HA   LYS  94           HA       LYS  94   8.408  11.401  -7.574
  737   1HB   LYS  94          2HB       LYS  94   6.677   9.718  -8.558
  738   2HB   LYS  94          1HB       LYS  94   6.035   9.712  -6.922
  739   1HG   LYS  94          2HG       LYS  94   5.813  12.177  -7.052
  740   2HG   LYS  94          1HG       LYS  94   6.326  12.093  -8.738
  741   1HD   LYS  94          2HD       LYS  94   4.403  10.494  -9.109
  742   2HD   LYS  94          1HD       LYS  94   3.841  10.934  -7.496
  743   1HE   LYS  94          2HE       LYS  94   2.748  12.614  -8.471
  744   2HE   LYS  94          1HE       LYS  94   4.323  13.370  -8.708
  745   1HZ   LYS  94          1HZ       LYS  94   4.403  12.730 -10.893
  746   2HZ   LYS  94          2HZ       LYS  94   2.743  12.997 -10.714
  747   3HZ   LYS  94          3HZ       LYS  94   3.353  11.420 -10.681
  748    H    GLY  95           H        GLY  95   8.416   8.887  -5.191
  749   1HA   GLY  95          2HA       GLY  95   9.083  10.336  -3.022
  750   2HA   GLY  95          1HA       GLY  95   7.348  10.589  -3.100
  751    H    ALA  96           H        ALA  96   7.254   7.703  -4.277
  752    HA   ALA  96           HA       ALA  96   6.356   6.394  -2.033
  753   1HB   ALA  96          1HB       ALA  96   5.906   4.729  -3.446
  754   2HB   ALA  96          2HB       ALA  96   7.598   4.553  -3.912
  755   3HB   ALA  96          3HB       ALA  96   6.586   5.763  -4.700
  756    H    TYR  97           H        TYR  97   7.380   4.172  -1.327
  757    HA   TYR  97           HA       TYR  97  10.054   4.818  -0.300
  758   1HB   TYR  97          2HB       TYR  97   8.272   4.440   1.353
  759   2HB   TYR  97          1HB       TYR  97   8.017   2.828   0.698
  760    HD1  TYR  97           1HD      TYR  97  10.704   4.944   2.195
  761    HD2  TYR  97           2HD      TYR  97   9.111   1.034   1.671
  762    HE1  TYR  97           1HE      TYR  97  12.393   4.053   3.743
  763    HE2  TYR  97           2HE      TYR  97  10.795   0.133   3.217
  764    HH   TYR  97           HH       TYR  97  12.238   0.876   5.006
  765    H    GLU  98           H        GLU  98   9.496   3.683  -2.942
  766    HA   GLU  98           HA       GLU  98  10.658   2.287  -4.331
  767   1HB   GLU  98          2HB       GLU  98  12.547   1.266  -3.631
  768   2HB   GLU  98          1HB       GLU  98  12.271   2.196  -2.169
  769   1HG   GLU  98          2HG       GLU  98  10.875   0.031  -1.516
  770   2HG   GLU  98          1HG       GLU  98  11.993  -0.712  -2.659
  771    H    PHE  99           H        PHE  99  10.039   0.482  -5.406
  772    HA   PHE  99           HA       PHE  99   7.600  -0.705  -4.746
  773   1HB   PHE  99          2HB       PHE  99   9.516  -0.845  -6.885
  774   2HB   PHE  99          1HB       PHE  99   8.954  -2.465  -6.492
  775    HD1  PHE  99           1HD      PHE  99   7.534  -3.034  -8.235
  776    HD2  PHE  99           2HD      PHE  99   7.115   0.764  -6.360
  777    HE1  PHE  99           1HE      PHE  99   5.480  -2.627  -9.526
  778    HE2  PHE  99           2HE      PHE  99   5.060   1.178  -7.648
  779    HZ   PHE  99           HZ       PHE  99   4.238  -0.520  -9.231
  780    H    LEU 100           H        LEU 100   7.028  -2.693  -3.924
  781    HA   LEU 100           HA       LEU 100   8.951  -3.902  -2.130
  782   1HB   LEU 100          2HB       LEU 100   6.436  -3.361  -1.707
  783   2HB   LEU 100          1HB       LEU 100   6.145  -4.871  -2.541
  784    HG   LEU 100           HG       LEU 100   6.129  -5.545  -0.341
  785   1HD1  LEU 100          1HD1      LEU 100   7.711  -6.932  -1.500
  786   2HD1  LEU 100          2HD1      LEU 100   8.275  -6.666   0.149
  787   3HD1  LEU 100          3HD1      LEU 100   9.010  -5.780  -1.187
  788   1HD2  LEU 100          1HD2      LEU 100   7.857  -3.219   0.040
  789   2HD2  LEU 100          2HD2      LEU 100   8.257  -4.592   1.073
  790   3HD2  LEU 100          3HD2      LEU 100   6.630  -3.913   1.101
  791    H    GLU 101           H        GLU 101  10.350  -5.262  -3.085
  792    HA   GLU 101           HA       GLU 101   9.802  -6.790  -5.394
  793   1HB   GLU 101          2HB       GLU 101  12.056  -6.147  -3.934
  794   2HB   GLU 101          1HB       GLU 101  11.900  -7.879  -3.672
  795   1HG   GLU 101          2HG       GLU 101  11.759  -6.715  -6.425
  796   2HG   GLU 101          1HG       GLU 101  13.307  -7.051  -5.649
  797    H    LYS 102           H        LYS 102   9.743  -9.118  -5.583
  798    HA   LYS 102           HA       LYS 102   8.888 -11.173  -5.128
  799   1HB   LYS 102          2HB       LYS 102  10.573 -11.213  -3.347
  800   2HB   LYS 102          1HB       LYS 102   9.454 -10.407  -2.258
  801   1HG   LYS 102          2HG       LYS 102   8.526 -12.332  -1.677
  802   2HG   LYS 102          1HG       LYS 102   8.250 -12.772  -3.363
  803   1HD   LYS 102          2HD       LYS 102  11.047 -12.992  -2.578
  804   2HD   LYS 102          1HD       LYS 102   9.984 -14.020  -1.616
  805   1HE   LYS 102          2HE       LYS 102   9.332 -15.275  -3.427
  806   2HE   LYS 102          1HE       LYS 102   9.647 -13.974  -4.575
  807   1HZ   LYS 102          1HZ       LYS 102  11.238 -15.879  -4.656
  808   2HZ   LYS 102          2HZ       LYS 102  11.796 -15.417  -3.129
  809   3HZ   LYS 102          3HZ       LYS 102  11.963 -14.365  -4.443
  810    HA   PRO 103           HA       PRO 103   4.828  -9.247  -3.901
  811   1HB   PRO 103          2HB       PRO 103   3.627  -9.243  -6.296
  812   2HB   PRO 103          1HB       PRO 103   4.753  -7.962  -5.828
  813   1HG   PRO 103          2HG       PRO 103   5.216 -10.348  -7.575
  814   2HG   PRO 103          1HG       PRO 103   5.757  -8.675  -7.800
  815   1HD   PRO 103          2HD       PRO 103   7.336 -10.686  -6.788
  816   2HD   PRO 103          1HD       PRO 103   7.583  -8.962  -6.453
  817    H    PHE 104           H        PHE 104   5.424 -11.776  -3.226
  818    HA   PHE 104           HA       PHE 104   3.455 -13.494  -4.565
  819   1HB   PHE 104          2HB       PHE 104   5.819 -14.307  -4.355
  820   2HB   PHE 104          1HB       PHE 104   5.608 -14.316  -2.607
  821    HD1  PHE 104           1HD      PHE 104   4.521 -15.860  -5.767
  822    HD2  PHE 104           2HD      PHE 104   4.418 -16.054  -1.517
  823    HE1  PHE 104           1HE      PHE 104   3.587 -18.133  -5.897
  824    HE2  PHE 104           2HE      PHE 104   3.485 -18.326  -1.640
  825    HZ   PHE 104           HZ       PHE 104   3.068 -19.369  -3.832
  826    H    SER 105           H        SER 105   4.693 -13.196  -1.230
  827    HA   SER 105           HA       SER 105   1.906 -13.147  -0.293
  828   1HB   SER 105          2HB       SER 105   4.156 -14.768   0.918
  829   2HB   SER 105          1HB       SER 105   2.530 -14.616   1.585
  830    HG   SER 105           HG       SER 105   2.910 -16.526   0.274
  831    H    VAL 106           H        VAL 106   3.679 -10.942  -0.681
  832    HA   VAL 106           HA       VAL 106   4.532  -9.104   0.357
  833    HB   VAL 106           HB       VAL 106   3.217  -8.161   2.051
  834   1HG1  VAL 106          1HG1      VAL 106   1.151  -9.981   0.936
  835   2HG1  VAL 106          2HG1      VAL 106   2.083  -8.967  -0.166
  836   3HG1  VAL 106          3HG1      VAL 106   1.132  -8.227   1.122
  837   1HG2  VAL 106          1HG2      VAL 106   1.702 -10.537   2.875
  838   2HG2  VAL 106          2HG2      VAL 106   2.320  -9.193   3.834
  839   3HG2  VAL 106          3HG2      VAL 106   3.387 -10.519   3.387
  840    H    GLU 107           H        GLU 107   5.688 -11.845   1.085
  841    HA   GLU 107           HA       GLU 107   6.544 -12.001   3.688
  842   1HB   GLU 107          2HB       GLU 107   7.111 -13.823   2.354
  843   2HB   GLU 107          1HB       GLU 107   7.766 -12.815   1.074
  844   1HG   GLU 107          2HG       GLU 107   9.808 -12.753   1.986
  845   2HG   GLU 107          1HG       GLU 107   9.187 -12.666   3.634
  846    H    ARG 108           H        ARG 108   8.209 -10.315   1.015
  847    HA   ARG 108           HA       ARG 108  10.205  -9.175   2.690
  848   1HB   ARG 108          2HB       ARG 108   9.433  -9.038  -0.131
  849   2HB   ARG 108          1HB       ARG 108  10.048  -7.512   0.489
  850   1HG   ARG 108          2HG       ARG 108  11.971  -8.500  -0.262
  851   2HG   ARG 108          1HG       ARG 108  11.974  -8.996   1.432
  852   1HD   ARG 108          2HD       ARG 108  10.677 -11.070   0.542
  853   2HD   ARG 108          1HD       ARG 108  11.357 -10.600  -1.015
  854    HE   ARG 108           HE       ARG 108  13.483 -10.631   0.713
  855   1HH1  ARG 108          1HH1      ARG 108  11.085 -12.947  -0.320
  856   2HH1  ARG 108          2HH1      ARG 108  12.131 -14.310  -0.112
  857   1HH2  ARG 108          1HH2      ARG 108  14.861 -12.423   0.985
  858   2HH2  ARG 108          2HH2      ARG 108  14.275 -14.013   0.629
  859    H    PHE 109           H        PHE 109   6.981  -8.288   1.787
  860    HA   PHE 109           HA       PHE 109   7.030  -5.547   2.368
  861   1HB   PHE 109          2HB       PHE 109   5.045  -5.959   1.368
  862   2HB   PHE 109          1HB       PHE 109   5.022  -7.625   1.911
  863    HD1  PHE 109           1HD      PHE 109   3.607  -4.388   2.308
  864    HD2  PHE 109           2HD      PHE 109   4.302  -8.068   4.331
  865    HE1  PHE 109           1HE      PHE 109   1.816  -3.848   3.907
  866    HE2  PHE 109           2HE      PHE 109   2.511  -7.533   5.928
  867    HZ   PHE 109           HZ       PHE 109   1.266  -5.420   5.718
  868    H    LEU 110           H        LEU 110   6.974  -8.342   4.409
  869    HA   LEU 110           HA       LEU 110   5.887  -7.391   6.754
  870   1HB   LEU 110          2HB       LEU 110   7.174  -9.657   5.987
  871   2HB   LEU 110          1HB       LEU 110   8.325  -8.967   7.114
  872    HG   LEU 110           HG       LEU 110   5.457  -9.232   7.917
  873   1HD1  LEU 110          1HD1      LEU 110   5.818 -11.463   8.718
  874   2HD1  LEU 110          2HD1      LEU 110   7.490 -11.441   8.160
  875   3HD1  LEU 110          3HD1      LEU 110   6.169 -11.421   6.991
  876   1HD2  LEU 110          1HD2      LEU 110   8.107  -8.929   9.239
  877   2HD2  LEU 110          2HD2      LEU 110   6.815  -9.763  10.103
  878   3HD2  LEU 110          3HD2      LEU 110   6.583  -8.101   9.559
  879    H    LEU 111           H        LEU 111   9.251  -7.094   5.652
  880    HA   LEU 111           HA       LEU 111  10.103  -5.623   7.938
  881   1HB   LEU 111          2HB       LEU 111  11.370  -5.757   5.198
  882   2HB   LEU 111          1HB       LEU 111  12.147  -5.209   6.672
  883    HG   LEU 111           HG       LEU 111  11.348  -7.723   7.387
  884   1HD1  LEU 111          1HD1      LEU 111  10.874  -7.781   4.727
  885   2HD1  LEU 111          2HD1      LEU 111  11.319  -9.192   5.686
  886   3HD1  LEU 111          3HD1      LEU 111  12.551  -8.323   4.772
  887   1HD2  LEU 111          1HD2      LEU 111  13.487  -7.283   7.983
  888   2HD2  LEU 111          2HD2      LEU 111  13.859  -6.468   6.464
  889   3HD2  LEU 111          3HD2      LEU 111  13.837  -8.231   6.537
  890    H    THR 112           H        THR 112   9.433  -4.612   4.563
  891    HA   THR 112           HA       THR 112   9.899  -1.933   4.746
  892    HB   THR 112           HB       THR 112   7.621  -3.328   3.330
  893    HG1  THR 112           1HG      THR 112   9.183  -2.726   1.537
  894   1HG2  THR 112          1HG2      THR 112   8.405  -0.960   1.987
  895   2HG2  THR 112          2HG2      THR 112   7.979  -0.541   3.647
  896   3HG2  THR 112          3HG2      THR 112   6.821  -1.395   2.627
  897    H    ILE 113           H        ILE 113   7.175  -3.717   6.018
  898    HA   ILE 113           HA       ILE 113   5.597  -1.494   6.800
  899    HB   ILE 113           HB       ILE 113   5.664  -4.373   7.690
  900   1HG1  ILE 113          2HG1      ILE 113   4.735  -3.989   5.489
  901   2HG1  ILE 113          1HG1      ILE 113   3.431  -4.397   6.598
  902   1HG2  ILE 113          1HG2      ILE 113   4.136  -2.094   8.858
  903   2HG2  ILE 113          2HG2      ILE 113   4.890  -3.475   9.657
  904   3HG2  ILE 113          3HG2      ILE 113   3.382  -3.686   8.767
  905   1HD1  ILE 113          1HD1      ILE 113   4.120  -1.716   5.447
  906   2HD1  ILE 113          2HD1      ILE 113   3.032  -1.911   6.821
  907   3HD1  ILE 113          3HD1      ILE 113   2.630  -2.640   5.267
  908    H    LYS 114           H        LYS 114   7.387  -3.767   8.893
  909    HA   LYS 114           HA       LYS 114   7.363  -2.209  11.175
  910   1HB   LYS 114          2HB       LYS 114   9.326  -3.554  11.906
  911   2HB   LYS 114          1HB       LYS 114   7.951  -4.501  11.348
  912   1HG   LYS 114          2HG       LYS 114   9.385  -5.559  10.079
  913   2HG   LYS 114          1HG       LYS 114   9.384  -4.112   9.077
  914   1HD   LYS 114          2HD       LYS 114  11.217  -3.296  10.746
  915   2HD   LYS 114          1HD       LYS 114  11.397  -5.016  11.093
  916   1HE   LYS 114          2HE       LYS 114  11.883  -5.477   8.778
  917   2HE   LYS 114          1HE       LYS 114  11.555  -3.802   8.338
  918   1HZ   LYS 114          1HZ       LYS 114  13.547  -3.117   9.103
  919   2HZ   LYS 114          2HZ       LYS 114  13.990  -4.723   8.813
  920   3HZ   LYS 114          3HZ       LYS 114  13.584  -4.227  10.379
  921    H    HIS 115           H        HIS 115   9.182  -1.813   8.321
  922    HA   HIS 115           HA       HIS 115  11.213  -0.159   9.581
  923   1HB   HIS 115          2HB       HIS 115  11.677  -1.777   7.671
  924   2HB   HIS 115          1HB       HIS 115  10.856  -0.618   6.629
  925    HD1  HIS 115           1HD      HIS 115  11.973   2.000   7.219
  926    HD2  HIS 115           2HD      HIS 115  14.334  -1.412   7.447
  927    HE1  HIS 115           1HE      HIS 115  14.345   2.807   6.999
  928    HE2  HIS 115           2HE      HIS 115  15.759   0.735   7.230
  929    H    ALA 116           H        ALA 116   8.381   0.124   7.534
  930    HA   ALA 116           HA       ALA 116   8.688   2.875   6.888
  931   1HB   ALA 116          1HB       ALA 116   6.299   2.732   6.223
  932   2HB   ALA 116          2HB       ALA 116   6.259   1.092   6.868
  933   3HB   ALA 116          3HB       ALA 116   7.311   1.478   5.506
  934    H    PHE 117           H        PHE 117   6.557   1.210   9.213
  935    HA   PHE 117           HA       PHE 117   5.396   3.463  10.348
  936   1HB   PHE 117          2HB       PHE 117   5.909   0.685  11.349
  937   2HB   PHE 117          1HB       PHE 117   5.236   1.895  12.435
  938    HD1  PHE 117           1HD      PHE 117   3.198   3.252  11.366
  939    HD2  PHE 117           2HD      PHE 117   4.434  -0.656  10.217
  940    HE1  PHE 117           1HE      PHE 117   0.950   2.809  10.474
  941    HE2  PHE 117           2HE      PHE 117   2.187  -1.106   9.324
  942    HZ   PHE 117           HZ       PHE 117   0.442   0.629   9.450
  943    H    GLU 118           H        GLU 118   8.582   2.174  10.762
  944    HA   GLU 118           HA       GLU 118   9.231   3.253  13.269
  945   1HB   GLU 118          2HB       GLU 118  10.900   2.549  10.872
  946   2HB   GLU 118          1HB       GLU 118  11.612   3.190  12.346
  947   1HG   GLU 118          2HG       GLU 118   9.794   0.895  12.675
  948   2HG   GLU 118          1HG       GLU 118  11.317   0.575  11.846
  949    H    GLU 119           H        GLU 119   8.683   4.797  10.264
  950    HA   GLU 119           HA       GLU 119  10.251   7.149  10.936
  951   1HB   GLU 119          2HB       GLU 119   8.387   6.690   8.602
  952   2HB   GLU 119          1HB       GLU 119   9.535   8.010   8.775
  953   1HG   GLU 119          2HG       GLU 119  11.387   6.515   8.596
  954   2HG   GLU 119          1HG       GLU 119  10.323   5.111   8.658
  955    H    TYR 120           H        TYR 120   7.632   6.138  12.325
  956    HA   TYR 120           HA       TYR 120   6.120   8.648  12.107
  957   1HB   TYR 120          2HB       TYR 120   4.862   6.547  11.698
  958   2HB   TYR 120          1HB       TYR 120   5.258   6.017  13.329
  959    HD1  TYR 120           1HD      TYR 120   3.496   6.177  14.797
  960    HD2  TYR 120           2HD      TYR 120   3.907   9.148  11.781
  961    HE1  TYR 120           1HE      TYR 120   1.494   7.318  15.657
  962    HE2  TYR 120           2HE      TYR 120   1.907  10.298  12.631
  963    HH   TYR 120           HH       TYR 120   0.720  10.333  15.111
  964    H    SER 121           H        SER 121   8.607   8.388  13.585
  965    HA   SER 121           HA       SER 121   7.602   8.906  16.307
  966   1HB   SER 121          2HB       SER 121   9.735   8.115  17.186
  967   2HB   SER 121          1HB       SER 121   9.002   6.863  16.182
  968    HG   SER 121           HG       SER 121  10.454   7.280  14.591
  Start of MODEL   31
    1   1H    MET   1          1HT       MET   1  -3.965   0.491  15.716
    2   2H    MET   1          2HT       MET   1  -3.881   0.447  17.430
    3   3H    MET   1          3HT       MET   1  -3.269  -0.863  16.505
    4    HA   MET   1           HA       MET   1  -2.196   1.841  16.832
    5   1HB   MET   1          2HB       MET   1  -0.993  -0.926  17.055
    6   2HB   MET   1          1HB       MET   1  -0.194   0.588  17.454
    7   1HG   MET   1          2HG       MET   1  -1.901   0.962  19.213
    8   2HG   MET   1          1HG       MET   1  -2.553  -0.637  18.861
    9   1HE   MET   1          1HE       MET   1   0.317   0.377  21.922
   10   2HE   MET   1          2HE       MET   1  -0.747   1.392  20.948
   11   3HE   MET   1          3HE       MET   1   0.920   1.121  20.441
   12    H    LYS   2           H        LYS   2  -1.582  -1.172  15.015
   13    HA   LYS   2           HA       LYS   2  -0.423   0.461  12.861
   14   1HB   LYS   2          2HB       LYS   2  -0.113  -2.511  13.307
   15   2HB   LYS   2          1HB       LYS   2   0.768  -1.521  12.153
   16   1HG   LYS   2          2HG       LYS   2   0.997  -0.634  14.936
   17   2HG   LYS   2          1HG       LYS   2   1.677  -2.229  14.609
   18   1HD   LYS   2          2HD       LYS   2   2.599  -0.790  12.484
   19   2HD   LYS   2          1HD       LYS   2   2.598   0.426  13.765
   20   1HE   LYS   2          2HE       LYS   2   3.890  -2.294  13.957
   21   2HE   LYS   2          1HE       LYS   2   4.742  -0.795  13.584
   22   1HZ   LYS   2          1HZ       LYS   2   3.123  -0.961  16.032
   23   2HZ   LYS   2          2HZ       LYS   2   4.488  -0.014  15.710
   24   3HZ   LYS   2          3HZ       LYS   2   4.658  -1.671  16.007
   25    H    ARG   3           H        ARG   3  -1.519   0.686  11.031
   26    HA   ARG   3           HA       ARG   3  -3.275  -1.444  10.103
   27   1HB   ARG   3          2HB       ARG   3  -4.349   1.364  10.173
   28   2HB   ARG   3          1HB       ARG   3  -5.225  -0.142   9.940
   29   1HG   ARG   3          2HG       ARG   3  -5.811   0.434  12.088
   30   2HG   ARG   3          1HG       ARG   3  -4.461  -0.669  12.361
   31   1HD   ARG   3          2HD       ARG   3  -3.655   0.974  13.658
   32   2HD   ARG   3          1HD       ARG   3  -3.174   1.717  12.133
   33    HE   ARG   3           HE       ARG   3  -5.787   2.508  12.656
   34   1HH1  ARG   3          1HH1      ARG   3  -2.619   2.897  14.067
   35   2HH1  ARG   3          2HH1      ARG   3  -2.981   4.442  14.761
   36   1HH2  ARG   3          1HH2      ARG   3  -6.265   4.541  13.569
   37   2HH2  ARG   3          2HH2      ARG   3  -5.049   5.376  14.478
   38    H    VAL   4           H        VAL   4  -2.157  -1.808   8.250
   39    HA   VAL   4           HA       VAL   4  -1.311   0.435   6.590
   40    HB   VAL   4           HB       VAL   4  -0.955  -2.526   6.090
   41   1HG1  VAL   4          1HG1      VAL   4   1.004  -1.602   4.717
   42   2HG1  VAL   4          2HG1      VAL   4   0.166  -0.055   4.811
   43   3HG1  VAL   4          3HG1      VAL   4  -0.620  -1.435   4.049
   44   1HG2  VAL   4          1HG2      VAL   4   1.330  -2.209   6.952
   45   2HG2  VAL   4          2HG2      VAL   4   0.107  -1.906   8.187
   46   3HG2  VAL   4          3HG2      VAL   4   0.918  -0.553   7.397
   47    H    LEU   5           H        LEU   5  -1.809   0.407   4.245
   48    HA   LEU   5           HA       LEU   5  -4.564  -0.525   3.803
   49   1HB   LEU   5          2HB       LEU   5  -4.104   1.948   3.714
   50   2HB   LEU   5          1HB       LEU   5  -3.120   1.648   2.295
   51    HG   LEU   5           HG       LEU   5  -5.102   0.732   1.135
   52   1HD1  LEU   5          1HD1      LEU   5  -6.962   0.206   2.217
   53   2HD1  LEU   5          2HD1      LEU   5  -7.117   1.849   2.837
   54   3HD1  LEU   5          3HD1      LEU   5  -6.173   0.657   3.729
   55   1HD2  LEU   5          1HD2      LEU   5  -5.409   3.521   2.241
   56   2HD2  LEU   5          2HD2      LEU   5  -6.250   2.886   0.827
   57   3HD2  LEU   5          3HD2      LEU   5  -4.494   3.054   0.807
   58    H    VAL   6           H        VAL   6  -5.045  -1.829   2.118
   59    HA   VAL   6           HA       VAL   6  -2.832  -2.521   0.290
   60    HB   VAL   6           HB       VAL   6  -4.943  -4.480   1.163
   61   1HG1  VAL   6          1HG1      VAL   6  -3.681  -4.875  -0.948
   62   2HG1  VAL   6          2HG1      VAL   6  -3.460  -6.131   0.269
   63   3HG1  VAL   6          3HG1      VAL   6  -2.198  -4.927   0.004
   64   1HG2  VAL   6          1HG2      VAL   6  -3.398  -5.385   2.774
   65   2HG2  VAL   6          2HG2      VAL   6  -3.656  -3.676   3.126
   66   3HG2  VAL   6          3HG2      VAL   6  -2.174  -4.196   2.325
   67    H    VAL   7           H        VAL   7  -3.572  -1.175  -1.365
   68    HA   VAL   7           HA       VAL   7  -6.274  -1.561  -2.368
   69    HB   VAL   7           HB       VAL   7  -4.106   0.206  -3.515
   70   1HG1  VAL   7          1HG1      VAL   7  -7.081   0.051  -3.938
   71   2HG1  VAL   7          2HG1      VAL   7  -5.800  -0.165  -5.131
   72   3HG1  VAL   7          3HG1      VAL   7  -6.101   1.429  -4.438
   73   1HG2  VAL   7          1HG2      VAL   7  -6.332   1.035  -1.660
   74   2HG2  VAL   7          2HG2      VAL   7  -5.007   2.028  -2.267
   75   3HG2  VAL   7          3HG2      VAL   7  -4.679   0.721  -1.130
   76    H    ASP   8           H        ASP   8  -6.535  -3.406  -3.460
   77    HA   ASP   8           HA       ASP   8  -4.803  -3.857  -5.780
   78   1HB   ASP   8          2HB       ASP   8  -3.938  -5.366  -4.102
   79   2HB   ASP   8          1HB       ASP   8  -5.556  -5.944  -3.723
   80    H    ASP   9           H        ASP   9  -5.834  -4.697  -7.566
   81    HA   ASP   9           HA       ASP   9  -8.734  -4.560  -7.490
   82   1HB   ASP   9          2HB       ASP   9  -7.543  -3.401  -9.287
   83   2HB   ASP   9          1HB       ASP   9  -6.833  -4.921  -9.820
   84    H    GLU  10           H        GLU  10  -7.991  -6.697  -6.036
   85    HA   GLU  10           HA       GLU  10  -9.218  -8.862  -7.467
   86   1HB   GLU  10          2HB       GLU  10  -6.728  -8.923  -8.073
   87   2HB   GLU  10          1HB       GLU  10  -6.452  -9.396  -6.403
   88   1HG   GLU  10          2HG       GLU  10  -6.513 -11.398  -7.599
   89   2HG   GLU  10          1HG       GLU  10  -8.091 -11.285  -6.823
   90    H    GLU  11           H        GLU  11 -10.667  -9.475  -6.007
   91    HA   GLU  11           HA       GLU  11 -11.647 -10.083  -4.044
   92   1HB   GLU  11          2HB       GLU  11  -9.361 -11.589  -4.323
   93   2HB   GLU  11          1HB       GLU  11  -9.180 -10.925  -2.705
   94   1HG   GLU  11          2HG       GLU  11 -11.579 -11.742  -2.316
   95   2HG   GLU  11          1HG       GLU  11 -11.336 -12.704  -3.773
   96    H    SER  12           H        SER  12 -11.232  -9.967  -1.481
   97    HA   SER  12           HA       SER  12 -11.134  -7.197  -0.882
   98   1HB   SER  12          2HB       SER  12 -10.839  -9.189   1.313
   99   2HB   SER  12          1HB       SER  12 -11.897  -7.783   1.202
  100    HG   SER  12           HG       SER  12 -13.338  -8.932   0.061
  101    H    ILE  13           H        ILE  13  -9.111  -9.800   0.489
  102    HA   ILE  13           HA       ILE  13  -6.971  -7.841   0.904
  103    HB   ILE  13           HB       ILE  13  -6.909 -10.690   1.849
  104   1HG1  ILE  13          2HG1      ILE  13  -9.028  -9.640   2.620
  105   2HG1  ILE  13          1HG1      ILE  13  -7.932 -10.025   3.943
  106   1HG2  ILE  13          1HG2      ILE  13  -4.841  -9.886   2.287
  107   2HG2  ILE  13          2HG2      ILE  13  -5.651  -9.289   3.735
  108   3HG2  ILE  13          3HG2      ILE  13  -5.387  -8.211   2.365
  109   1HD1  ILE  13          1HD1      ILE  13  -7.226  -7.676   4.012
  110   2HD1  ILE  13          2HD1      ILE  13  -8.956  -7.874   4.296
  111   3HD1  ILE  13          3HD1      ILE  13  -8.378  -7.312   2.728
  112    H    THR  14           H        THR  14  -4.737  -8.555   0.488
  113    HA   THR  14           HA       THR  14  -4.578  -9.845  -2.115
  114    HB   THR  14           HB       THR  14  -2.268  -9.016  -2.165
  115    HG1  THR  14           1HG      THR  14  -2.833  -8.016   0.428
  116   1HG2  THR  14          1HG2      THR  14  -2.690  -6.559  -1.915
  117   2HG2  THR  14          2HG2      THR  14  -4.304  -6.969  -1.330
  118   3HG2  THR  14          3HG2      THR  14  -3.818  -7.415  -2.966
  119    H    SER  15           H        SER  15  -3.327 -11.682  -2.529
  120    HA   SER  15           HA       SER  15  -3.365 -13.681  -0.600
  121   1HB   SER  15          2HB       SER  15  -3.129 -13.803  -3.199
  122   2HB   SER  15          1HB       SER  15  -1.398 -13.776  -2.863
  123    HG   SER  15           HG       SER  15  -2.972 -15.854  -2.798
  124    H    SER  16           H        SER  16  -2.018 -14.392   0.916
  125    HA   SER  16           HA       SER  16  -0.092 -14.769   2.095
  126   1HB   SER  16          2HB       SER  16   1.128 -14.401  -0.101
  127   2HB   SER  16          1HB       SER  16   1.359 -12.733   0.421
  128    HG   SER  16           HG       SER  16   2.138 -14.986   1.954
  129    H    LEU  17           H        LEU  17  -1.086 -11.473   1.379
  130    HA   LEU  17           HA       LEU  17   0.266 -10.250   3.530
  131   1HB   LEU  17          2HB       LEU  17  -1.218  -9.370   1.407
  132   2HB   LEU  17          1HB       LEU  17  -2.302  -9.052   2.742
  133    HG   LEU  17           HG       LEU  17  -0.164  -7.456   1.812
  134   1HD1  LEU  17          1HD1      LEU  17  -1.321  -5.875   2.865
  135   2HD1  LEU  17          2HD1      LEU  17  -1.281  -6.732   4.405
  136   3HD1  LEU  17          3HD1      LEU  17  -2.495  -7.149   3.195
  137   1HD2  LEU  17          1HD2      LEU  17   1.109  -7.088   3.901
  138   2HD2  LEU  17          2HD2      LEU  17   1.412  -8.664   3.173
  139   3HD2  LEU  17          3HD2      LEU  17   0.359  -8.532   4.579
  140    H    SER  18           H        SER  18  -3.207 -11.043   3.233
  141    HA   SER  18           HA       SER  18  -4.033 -10.402   5.754
  142   1HB   SER  18          2HB       SER  18  -5.253 -11.539   3.645
  143   2HB   SER  18          1HB       SER  18  -5.126 -12.952   4.693
  144    HG   SER  18           HG       SER  18  -6.319 -10.460   5.344
  145    H    ALA  19           H        ALA  19  -2.711 -13.566   4.771
  146    HA   ALA  19           HA       ALA  19  -2.878 -14.782   7.297
  147   1HB   ALA  19          1HB       ALA  19  -2.406 -15.937   5.123
  148   2HB   ALA  19          2HB       ALA  19  -1.351 -16.419   6.451
  149   3HB   ALA  19          3HB       ALA  19  -0.761 -15.308   5.215
  150    H    ILE  20           H        ILE  20  -0.513 -12.686   5.835
  151    HA   ILE  20           HA       ILE  20   1.457 -12.972   7.889
  152    HB   ILE  20           HB       ILE  20   1.124 -11.091   5.571
  153   1HG1  ILE  20          2HG1      ILE  20   3.403 -12.952   6.168
  154   2HG1  ILE  20          1HG1      ILE  20   1.933 -13.514   5.378
  155   1HG2  ILE  20          1HG2      ILE  20   3.135 -10.929   7.787
  156   2HG2  ILE  20          2HG2      ILE  20   2.129  -9.647   7.112
  157   3HG2  ILE  20          3HG2      ILE  20   3.472 -10.301   6.174
  158   1HD1  ILE  20          1HD1      ILE  20   3.888 -11.468   4.379
  159   2HD1  ILE  20          2HD1      ILE  20   2.314 -11.758   3.641
  160   3HD1  ILE  20          3HD1      ILE  20   3.517 -13.046   3.685
  161    H    LEU  21           H        LEU  21  -0.430 -10.065   6.919
  162    HA   LEU  21           HA       LEU  21   0.174  -8.657   9.208
  163   1HB   LEU  21          2HB       LEU  21  -1.442  -7.058   8.622
  164   2HB   LEU  21          1HB       LEU  21  -0.719  -7.646   7.152
  165    HG   LEU  21           HG       LEU  21  -3.428  -7.392   7.768
  166   1HD1  LEU  21          1HD1      LEU  21  -1.839  -8.554   5.524
  167   2HD1  LEU  21          2HD1      LEU  21  -2.790  -7.071   5.575
  168   3HD1  LEU  21          3HD1      LEU  21  -3.600  -8.633   5.504
  169   1HD2  LEU  21          1HD2      LEU  21  -4.161  -9.746   7.348
  170   2HD2  LEU  21          2HD2      LEU  21  -3.505  -9.412   8.944
  171   3HD2  LEU  21          3HD2      LEU  21  -2.515 -10.232   7.738
  172    H    GLU  22           H        GLU  22  -1.728 -11.380   9.047
  173    HA   GLU  22           HA       GLU  22  -3.388 -10.690  11.323
  174   1HB   GLU  22          2HB       GLU  22  -3.220 -12.965   9.424
  175   2HB   GLU  22          1HB       GLU  22  -3.869 -13.288  11.024
  176   1HG   GLU  22          2HG       GLU  22  -5.295 -11.117  10.438
  177   2HG   GLU  22          1HG       GLU  22  -4.998 -11.700   8.802
  178    H    GLU  23           H        GLU  23  -0.425 -12.347  10.589
  179    HA   GLU  23           HA       GLU  23  -0.270 -13.667  13.156
  180   1HB   GLU  23          2HB       GLU  23   0.717 -14.867  11.371
  181   2HB   GLU  23          1HB       GLU  23   1.562 -13.446  10.774
  182   1HG   GLU  23          2HG       GLU  23   3.328 -13.843  12.048
  183   2HG   GLU  23          1HG       GLU  23   2.335 -14.096  13.482
  184    H    GLU  24           H        GLU  24   1.040 -10.823  11.568
  185    HA   GLU  24           HA       GLU  24   2.875 -10.180  13.671
  186   1HB   GLU  24          2HB       GLU  24   1.929  -8.811  11.192
  187   2HB   GLU  24          1HB       GLU  24   2.814  -7.896  12.405
  188   1HG   GLU  24          2HG       GLU  24   4.188  -8.832  10.530
  189   2HG   GLU  24          1HG       GLU  24   4.738  -9.239  12.155
  190    H    GLY  25           H        GLY  25  -0.442  -9.407  12.922
  191   1HA   GLY  25          2HA       GLY  25  -1.997  -8.694  14.554
  192   2HA   GLY  25          1HA       GLY  25  -0.663  -8.068  15.508
  193    H    TYR  26           H        TYR  26  -1.590  -7.539  12.127
  194    HA   TYR  26           HA       TYR  26  -1.479  -4.648  12.623
  195   1HB   TYR  26          2HB       TYR  26  -1.072  -6.360  10.202
  196   2HB   TYR  26          1HB       TYR  26  -1.501  -4.669  10.005
  197    HD1  TYR  26           1HD      TYR  26   0.034  -2.906  10.872
  198    HD2  TYR  26           2HD      TYR  26   1.125  -7.017  10.818
  199    HE1  TYR  26           1HE      TYR  26   2.396  -2.275  11.124
  200    HE2  TYR  26           2HE      TYR  26   3.491  -6.399  11.071
  201    HH   TYR  26           HH       TYR  26   4.495  -3.284  11.944
  202    H    HIS  27           H        HIS  27  -2.915  -3.626  10.613
  203    HA   HIS  27           HA       HIS  27  -5.574  -4.828  10.640
  204   1HB   HIS  27          2HB       HIS  27  -5.016  -2.901  12.478
  205   2HB   HIS  27          1HB       HIS  27  -5.567  -1.913  11.129
  206    HD1  HIS  27           1HD      HIS  27  -6.815  -5.047  12.909
  207    HD2  HIS  27           2HD      HIS  27  -8.229  -1.517  11.234
  208    HE1  HIS  27           1HE      HIS  27  -9.300  -5.065  13.299
  209    HE2  HIS  27           2HE      HIS  27 -10.140  -2.941  12.236
  210    HA   PRO  28           HA       PRO  28  -4.574  -3.090   6.539
  211   1HB   PRO  28          2HB       PRO  28  -5.471  -5.126   5.063
  212   2HB   PRO  28          1HB       PRO  28  -3.915  -5.207   5.898
  213   1HG   PRO  28          2HG       PRO  28  -6.546  -6.391   6.684
  214   2HG   PRO  28          1HG       PRO  28  -4.931  -7.108   6.766
  215   1HD   PRO  28          2HD       PRO  28  -6.231  -5.963   8.908
  216   2HD   PRO  28          1HD       PRO  28  -4.469  -6.115   8.781
  217    H    ASP  29           H        ASP  29  -5.863  -1.828   5.350
  218    HA   ASP  29           HA       ASP  29  -8.734  -2.044   5.804
  219   1HB   ASP  29          2HB       ASP  29  -6.970   0.175   5.626
  220   2HB   ASP  29          1HB       ASP  29  -8.188   0.314   4.363
  221    H    THR  30           H        THR  30  -6.611  -3.053   3.670
  222    HA   THR  30           HA       THR  30  -6.593  -3.082   1.295
  223    HB   THR  30           HB       THR  30  -7.432  -5.238   0.822
  224    HG1  THR  30           1HG      THR  30  -9.303  -5.827   1.518
  225   1HG2  THR  30          1HG2      THR  30  -6.315  -6.457   2.344
  226   2HG2  THR  30          2HG2      THR  30  -7.131  -5.701   3.713
  227   3HG2  THR  30          3HG2      THR  30  -5.797  -4.871   2.913
  228    H    ALA  31           H        ALA  31  -7.376  -2.153  -0.414
  229    HA   ALA  31           HA       ALA  31 -10.270  -1.626  -0.575
  230   1HB   ALA  31          1HB       ALA  31  -8.691   0.354  -0.477
  231   2HB   ALA  31          2HB       ALA  31  -9.815   0.326  -1.835
  232   3HB   ALA  31          3HB       ALA  31  -8.130  -0.132  -2.076
  233    H    LYS  32           H        LYS  32 -10.320  -0.948  -3.314
  234    HA   LYS  32           HA       LYS  32  -9.675  -3.548  -4.546
  235   1HB   LYS  32          2HB       LYS  32 -11.926  -1.763  -5.446
  236   2HB   LYS  32          1HB       LYS  32 -11.665  -3.462  -5.818
  237   1HG   LYS  32          2HG       LYS  32 -12.128  -4.040  -3.487
  238   2HG   LYS  32          1HG       LYS  32 -12.408  -2.336  -3.127
  239   1HD   LYS  32          2HD       LYS  32 -14.072  -2.671  -5.227
  240   2HD   LYS  32          1HD       LYS  32 -14.120  -4.289  -4.522
  241   1HE   LYS  32          2HE       LYS  32 -14.598  -3.189  -2.309
  242   2HE   LYS  32          1HE       LYS  32 -14.798  -1.674  -3.190
  243   1HZ   LYS  32          1HZ       LYS  32 -16.672  -2.477  -4.288
  244   2HZ   LYS  32          2HZ       LYS  32 -16.870  -3.039  -2.704
  245   3HZ   LYS  32          3HZ       LYS  32 -16.336  -4.092  -3.915
  246    H    THR  33           H        THR  33  -9.599  -0.082  -4.870
  247    HA   THR  33           HA       THR  33  -7.578  -0.224  -6.869
  248    HB   THR  33           HB       THR  33  -9.678   1.379  -8.067
  249    HG1  THR  33           1HG      THR  33 -11.207   0.001  -7.476
  250   1HG2  THR  33          1HG2      THR  33  -7.569   0.406  -9.128
  251   2HG2  THR  33          2HG2      THR  33  -9.068   0.346 -10.054
  252   3HG2  THR  33          3HG2      THR  33  -8.481  -1.100  -9.234
  253    H    LEU  34           H        LEU  34  -7.685   2.283  -7.941
  254    HA   LEU  34           HA       LEU  34  -6.768   3.885  -5.807
  255   1HB   LEU  34          2HB       LEU  34  -7.605   4.882  -8.524
  256   2HB   LEU  34          1HB       LEU  34  -6.437   5.603  -7.433
  257    HG   LEU  34           HG       LEU  34  -6.094   2.977  -8.884
  258   1HD1  LEU  34          1HD1      LEU  34  -4.418   5.402  -9.328
  259   2HD1  LEU  34          2HD1      LEU  34  -5.982   5.266 -10.132
  260   3HD1  LEU  34          3HD1      LEU  34  -4.740   4.043 -10.403
  261   1HD2  LEU  34          1HD2      LEU  34  -5.017   3.339  -6.557
  262   2HD2  LEU  34          2HD2      LEU  34  -3.946   4.449  -7.412
  263   3HD2  LEU  34          3HD2      LEU  34  -4.016   2.752  -7.886
  264    H    ARG  35           H        ARG  35  -9.780   3.905  -7.678
  265    HA   ARG  35           HA       ARG  35 -10.932   6.192  -6.564
  266   1HB   ARG  35          2HB       ARG  35 -11.867   3.845  -8.060
  267   2HB   ARG  35          1HB       ARG  35 -13.088   4.541  -7.003
  268   1HG   ARG  35          2HG       ARG  35 -13.509   5.839  -8.783
  269   2HG   ARG  35          1HG       ARG  35 -12.143   6.775  -8.173
  270   1HD   ARG  35          2HD       ARG  35 -11.923   6.353 -10.565
  271   2HD   ARG  35          1HD       ARG  35 -10.638   5.562  -9.658
  272    HE   ARG  35           HE       ARG  35 -13.004   4.153 -10.716
  273   1HH1  ARG  35          1HH1      ARG  35  -9.587   4.247  -9.965
  274   2HH1  ARG  35          2HH1      ARG  35  -9.294   2.650 -10.561
  275   1HH2  ARG  35          1HH2      ARG  35 -12.605   2.058 -11.494
  276   2HH2  ARG  35          2HH2      ARG  35 -11.001   1.409 -11.426
  277    H    GLU  36           H        GLU  36 -11.253   2.792  -5.570
  278    HA   GLU  36           HA       GLU  36 -12.826   3.364  -3.275
  279   1HB   GLU  36          2HB       GLU  36 -11.283   0.956  -4.206
  280   2HB   GLU  36          1HB       GLU  36 -12.037   0.986  -2.618
  281   1HG   GLU  36          2HG       GLU  36 -13.833   0.172  -3.643
  282   2HG   GLU  36          1HG       GLU  36 -14.074   1.812  -4.242
  283    H    ALA  37           H        ALA  37  -9.399   3.229  -3.908
  284    HA   ALA  37           HA       ALA  37  -8.606   3.110  -1.158
  285   1HB   ALA  37          1HB       ALA  37  -6.974   3.964  -3.546
  286   2HB   ALA  37          2HB       ALA  37  -7.180   2.298  -3.009
  287   3HB   ALA  37          3HB       ALA  37  -6.363   3.464  -1.970
  288    H    GLU  38           H        GLU  38  -9.357   5.646  -3.433
  289    HA   GLU  38           HA       GLU  38  -8.172   7.762  -1.915
  290   1HB   GLU  38          2HB       GLU  38 -10.148   7.683  -4.178
  291   2HB   GLU  38          1HB       GLU  38  -9.719   9.190  -3.381
  292   1HG   GLU  38          2HG       GLU  38  -7.401   8.897  -4.000
  293   2HG   GLU  38          1HG       GLU  38  -7.768   7.331  -4.720
  294    H    LYS  39           H        LYS  39 -11.336   6.267  -2.136
  295    HA   LYS  39           HA       LYS  39 -12.696   8.137  -0.486
  296   1HB   LYS  39          2HB       LYS  39 -13.957   6.704  -1.967
  297   2HB   LYS  39          1HB       LYS  39 -13.312   5.263  -1.195
  298   1HG   LYS  39          2HG       LYS  39 -14.865   7.225   0.426
  299   2HG   LYS  39          1HG       LYS  39 -15.711   6.094  -0.631
  300   1HD   LYS  39          2HD       LYS  39 -14.111   4.351   0.548
  301   2HD   LYS  39          1HD       LYS  39 -14.103   5.575   1.819
  302   1HE   LYS  39          2HE       LYS  39 -16.655   5.531   1.615
  303   2HE   LYS  39          1HE       LYS  39 -16.430   4.035   0.709
  304   1HZ   LYS  39          1HZ       LYS  39 -16.719   4.118   3.345
  305   2HZ   LYS  39          2HZ       LYS  39 -15.033   4.210   3.250
  306   3HZ   LYS  39          3HZ       LYS  39 -15.849   2.904   2.550
  307    H    LYS  40           H        LYS  40 -10.880   5.187   0.112
  308    HA   LYS  40           HA       LYS  40 -11.597   5.006   2.879
  309   1HB   LYS  40          2HB       LYS  40  -9.463   3.691   1.214
  310   2HB   LYS  40          1HB       LYS  40  -9.630   3.395   2.939
  311   1HG   LYS  40          2HG       LYS  40 -12.148   3.084   1.544
  312   2HG   LYS  40          1HG       LYS  40 -10.893   2.028   0.894
  313   1HD   LYS  40          2HD       LYS  40 -10.548   0.980   2.970
  314   2HD   LYS  40          1HD       LYS  40 -11.407   2.247   3.846
  315   1HE   LYS  40          2HE       LYS  40 -13.221   0.963   3.752
  316   2HE   LYS  40          1HE       LYS  40 -13.260   1.261   2.014
  317   1HZ   LYS  40          1HZ       LYS  40 -13.166  -0.985   1.989
  318   2HZ   LYS  40          2HZ       LYS  40 -12.368  -1.099   3.475
  319   3HZ   LYS  40          3HZ       LYS  40 -11.500  -0.697   2.080
  320    H    ILE  41           H        ILE  41  -9.031   6.508   1.037
  321    HA   ILE  41           HA       ILE  41  -7.510   7.182   3.416
  322    HB   ILE  41           HB       ILE  41  -7.071   8.003   0.544
  323   1HG1  ILE  41          2HG1      ILE  41  -5.397   6.009   2.023
  324   2HG1  ILE  41          1HG1      ILE  41  -6.923   5.495   1.310
  325   1HG2  ILE  41          1HG2      ILE  41  -5.680   8.634   3.063
  326   2HG2  ILE  41          2HG2      ILE  41  -5.771   9.544   1.555
  327   3HG2  ILE  41          3HG2      ILE  41  -4.651   8.189   1.702
  328   1HD1  ILE  41          1HD1      ILE  41  -6.056   6.495  -0.860
  329   2HD1  ILE  41          2HD1      ILE  41  -5.296   5.008  -0.292
  330   3HD1  ILE  41          3HD1      ILE  41  -4.484   6.556  -0.065
  331    H    LYS  42           H        LYS  42  -9.906   8.617   1.364
  332    HA   LYS  42           HA       LYS  42  -9.474  11.318   1.678
  333   1HB   LYS  42          2HB       LYS  42 -11.558   9.688   0.765
  334   2HB   LYS  42          1HB       LYS  42 -12.274  10.763   1.956
  335   1HG   LYS  42          2HG       LYS  42 -10.480  12.084   0.056
  336   2HG   LYS  42          1HG       LYS  42 -11.915  11.356  -0.669
  337   1HD   LYS  42          2HD       LYS  42 -12.121  13.088   1.772
  338   2HD   LYS  42          1HD       LYS  42 -12.049  13.796   0.158
  339   1HE   LYS  42          2HE       LYS  42 -14.039  12.673  -0.511
  340   2HE   LYS  42          1HE       LYS  42 -14.041  11.682   0.947
  341   1HZ   LYS  42          1HZ       LYS  42 -14.926  13.332   2.175
  342   2HZ   LYS  42          2HZ       LYS  42 -15.496  13.881   0.679
  343   3HZ   LYS  42          3HZ       LYS  42 -14.101  14.559   1.354
  344    H    GLU  43           H        GLU  43 -10.516   9.013   4.040
  345    HA   GLU  43           HA       GLU  43 -10.801  11.190   5.992
  346   1HB   GLU  43          2HB       GLU  43 -12.324   8.581   5.970
  347   2HB   GLU  43          1HB       GLU  43 -12.462   9.842   7.186
  348   1HG   GLU  43          2HG       GLU  43 -13.277  11.385   5.436
  349   2HG   GLU  43          1HG       GLU  43 -13.232  10.051   4.286
  350    H    LEU  44           H        LEU  44 -10.397   7.645   5.910
  351    HA   LEU  44           HA       LEU  44  -9.040   7.461   8.354
  352   1HB   LEU  44          2HB       LEU  44  -9.823   5.705   6.255
  353   2HB   LEU  44          1HB       LEU  44  -8.135   5.395   6.608
  354    HG   LEU  44           HG       LEU  44  -9.529   3.910   7.908
  355   1HD1  LEU  44          1HD1      LEU  44  -7.604   4.364   9.099
  356   2HD1  LEU  44          2HD1      LEU  44  -8.865   4.782  10.260
  357   3HD1  LEU  44          3HD1      LEU  44  -8.037   6.053   9.360
  358   1HD2  LEU  44          1HD2      LEU  44 -11.574   5.175   7.977
  359   2HD2  LEU  44          2HD2      LEU  44 -10.810   6.432   8.950
  360   3HD2  LEU  44          3HD2      LEU  44 -11.061   4.823   9.627
  361    H    PHE  45           H        PHE  45  -7.069   8.075   8.928
  362    HA   PHE  45           HA       PHE  45  -5.164   8.864   6.868
  363   1HB   PHE  45          2HB       PHE  45  -5.619  10.404   8.741
  364   2HB   PHE  45          1HB       PHE  45  -5.033   9.192   9.874
  365    HD1  PHE  45           1HD      PHE  45  -4.062  11.517   7.197
  366    HD2  PHE  45           2HD      PHE  45  -2.703   8.830  10.204
  367    HE1  PHE  45           1HE      PHE  45  -1.777  12.394   6.943
  368    HE2  PHE  45           2HE      PHE  45  -0.416   9.703   9.956
  369    HZ   PHE  45           HZ       PHE  45   0.049  11.487   8.323
  370    H    PHE  46           H        PHE  46  -4.793   6.605   6.231
  371    HA   PHE  46           HA       PHE  46  -3.638   4.712   7.971
  372   1HB   PHE  46          2HB       PHE  46  -3.357   4.955   4.969
  373   2HB   PHE  46          1HB       PHE  46  -2.949   3.531   5.918
  374    HD1  PHE  46           1HD      PHE  46  -5.331   4.874   3.835
  375    HD2  PHE  46           2HD      PHE  46  -4.998   2.784   7.527
  376    HE1  PHE  46           1HE      PHE  46  -7.631   4.045   3.567
  377    HE2  PHE  46           2HE      PHE  46  -7.297   1.949   7.265
  378    HZ   PHE  46           HZ       PHE  46  -8.618   2.582   5.283
  379    HA   PRO  47           HA       PRO  47   0.514   6.337   8.099
  380   1HB   PRO  47          2HB       PRO  47   1.532   3.987   9.320
  381   2HB   PRO  47          1HB       PRO  47   0.971   5.450  10.130
  382   1HG   PRO  47          2HG       PRO  47  -0.241   2.940  10.261
  383   2HG   PRO  47          1HG       PRO  47  -0.981   4.476  10.734
  384   1HD   PRO  47          2HD       PRO  47  -1.309   2.902   8.226
  385   2HD   PRO  47          1HD       PRO  47  -2.490   3.899   9.100
  386    H    VAL  48           H        VAL  48  -0.311   3.326   6.614
  387    HA   VAL  48           HA       VAL  48   1.951   3.550   4.797
  388    HB   VAL  48           HB       VAL  48   1.284   0.888   6.021
  389   1HG1  VAL  48          1HG1      VAL  48   2.736   1.500   3.822
  390   2HG1  VAL  48          2HG1      VAL  48   2.995   0.069   4.819
  391   3HG1  VAL  48          3HG1      VAL  48   3.989   1.505   5.063
  392   1HG2  VAL  48          1HG2      VAL  48   1.931   2.079   7.906
  393   2HG2  VAL  48          2HG2      VAL  48   3.138   3.008   7.018
  394   3HG2  VAL  48          3HG2      VAL  48   3.417   1.300   7.362
  395    H    ILE  49           H        ILE  49   1.367   3.086   2.748
  396    HA   ILE  49           HA       ILE  49  -1.223   1.766   2.313
  397    HB   ILE  49           HB       ILE  49   0.089   3.717   0.425
  398   1HG1  ILE  49          2HG1      ILE  49  -0.421   4.853   2.544
  399   2HG1  ILE  49          1HG1      ILE  49  -1.487   5.404   1.255
  400   1HG2  ILE  49          1HG2      ILE  49  -2.505   2.260   0.515
  401   2HG2  ILE  49          2HG2      ILE  49  -1.425   2.559  -0.846
  402   3HG2  ILE  49          3HG2      ILE  49  -2.450   3.856  -0.232
  403   1HD1  ILE  49          1HD1      ILE  49  -2.111   3.683   3.613
  404   2HD1  ILE  49          2HD1      ILE  49  -3.126   3.641   2.170
  405   3HD1  ILE  49          3HD1      ILE  49  -2.911   5.152   3.053
  406    H    VAL  50           H        VAL  50  -1.401   0.466   0.350
  407    HA   VAL  50           HA       VAL  50   1.086  -0.305  -0.932
  408    HB   VAL  50           HB       VAL  50  -0.578  -2.305   0.604
  409   1HG1  VAL  50          1HG1      VAL  50   1.582  -3.694  -0.192
  410   2HG1  VAL  50          2HG1      VAL  50   1.401  -2.606  -1.568
  411   3HG1  VAL  50          3HG1      VAL  50   0.066  -3.657  -1.095
  412   1HG2  VAL  50          1HG2      VAL  50   1.632  -2.689   1.759
  413   2HG2  VAL  50          2HG2      VAL  50   0.838  -1.153   2.108
  414   3HG2  VAL  50          3HG2      VAL  50   2.195  -1.209   0.983
  415    H    LEU  51           H        LEU  51   0.348   0.280  -2.887
  416    HA   LEU  51           HA       LEU  51  -2.225  -0.710  -3.836
  417   1HB   LEU  51          2HB       LEU  51  -1.800   1.577  -4.353
  418   2HB   LEU  51          1HB       LEU  51  -0.209   1.208  -4.988
  419    HG   LEU  51           HG       LEU  51  -1.640  -0.240  -6.708
  420   1HD1  LEU  51          1HD1      LEU  51  -3.710   0.887  -7.292
  421   2HD1  LEU  51          2HD1      LEU  51  -3.509   1.994  -5.935
  422   3HD1  LEU  51          3HD1      LEU  51  -3.780   0.277  -5.638
  423   1HD2  LEU  51          1HD2      LEU  51  -1.012   2.693  -6.747
  424   2HD2  LEU  51          2HD2      LEU  51  -1.721   1.877  -8.140
  425   3HD2  LEU  51          3HD2      LEU  51  -0.150   1.365  -7.525
  426    H    ASP  52           H        ASP  52  -2.455  -2.391  -5.139
  427    HA   ASP  52           HA       ASP  52  -0.041  -3.636  -6.260
  428   1HB   ASP  52          2HB       ASP  52  -1.454  -4.905  -4.537
  429   2HB   ASP  52          1HB       ASP  52  -2.671  -5.038  -5.803
  430    H    VAL  53           H        VAL  53   0.185  -3.333  -8.370
  431    HA   VAL  53           HA       VAL  53  -2.006  -2.501 -10.023
  432    HB   VAL  53           HB       VAL  53  -0.413  -2.190 -11.762
  433   1HG1  VAL  53          1HG1      VAL  53   0.935  -0.591 -10.799
  434   2HG1  VAL  53          2HG1      VAL  53   1.271  -1.577  -9.376
  435   3HG1  VAL  53          3HG1      VAL  53  -0.301  -0.799  -9.559
  436   1HG2  VAL  53          1HG2      VAL  53   1.226  -3.648 -12.134
  437   2HG2  VAL  53          2HG2      VAL  53   0.909  -4.429 -10.587
  438   3HG2  VAL  53          3HG2      VAL  53   2.048  -3.088 -10.678
  439    H    TRP  54           H        TRP  54  -2.966  -4.813  -9.251
  440    HA   TRP  54           HA       TRP  54  -2.136  -7.104 -10.667
  441   1HB   TRP  54          2HB       TRP  54  -3.569  -7.281  -8.706
  442   2HB   TRP  54          1HB       TRP  54  -4.861  -6.422  -9.538
  443    HD1  TRP  54           HD       TRP  54  -6.699  -8.104 -10.118
  444    HE1  TRP  54           1HE      TRP  54  -6.787 -10.502 -11.049
  445    HE3  TRP  54           3HE      TRP  54  -1.688  -9.052 -10.379
  446    HZ2  TRP  54           2HZ      TRP  54  -4.968 -12.527 -11.799
  447    HZ3  TRP  54           3HZ      TRP  54  -0.941 -11.244 -11.215
  448    HH2  TRP  54           HH       TRP  54  -2.549 -12.945 -11.910
  449    H    MET  55           H        MET  55  -5.355  -5.744 -11.235
  450    HA   MET  55           HA       MET  55  -4.771  -5.388 -14.062
  451   1HB   MET  55          2HB       MET  55  -5.498  -7.795 -13.650
  452   2HB   MET  55          1HB       MET  55  -7.075  -7.143 -13.227
  453   1HG   MET  55          2HG       MET  55  -7.184  -6.098 -15.472
  454   2HG   MET  55          1HG       MET  55  -5.673  -6.909 -15.878
  455   1HE   MET  55          1HE       MET  55  -7.300  -9.596 -17.836
  456   2HE   MET  55          2HE       MET  55  -5.821  -8.725 -17.434
  457   3HE   MET  55          3HE       MET  55  -7.219  -7.848 -18.055
  458    HA   PRO  56           HA       PRO  56  -8.134  -2.635 -12.129
  459   1HB   PRO  56          2HB       PRO  56  -6.737  -0.442 -11.454
  460   2HB   PRO  56          1HB       PRO  56  -6.878  -1.824 -10.361
  461   1HG   PRO  56          2HG       PRO  56  -4.624  -1.078 -12.184
  462   2HG   PRO  56          1HG       PRO  56  -4.561  -1.635 -10.503
  463   1HD   PRO  56          2HD       PRO  56  -4.118  -3.266 -12.645
  464   2HD   PRO  56          1HD       PRO  56  -4.774  -3.839 -11.098
  465    H    ASP  57           H        ASP  57  -8.144   0.009 -12.710
  466    HA   ASP  57           HA       ASP  57  -7.488   0.155 -15.577
  467   1HB   ASP  57          2HB       ASP  57  -9.977   1.235 -14.240
  468   2HB   ASP  57          1HB       ASP  57  -9.569   1.396 -15.946
  469    H    GLY  58           H        GLY  58  -8.128   1.990 -12.611
  470   1HA   GLY  58          2HA       GLY  58  -7.373   4.517 -13.617
  471   2HA   GLY  58          1HA       GLY  58  -7.413   4.059 -11.921
  472    H    ASP  59           H        ASP  59  -5.477   5.698 -13.441
  473    HA   ASP  59           HA       ASP  59  -3.064   4.161 -13.643
  474   1HB   ASP  59          2HB       ASP  59  -3.743   6.394 -14.846
  475   2HB   ASP  59          1HB       ASP  59  -3.069   7.147 -13.404
  476    H    GLY  60           H        GLY  60  -1.943   3.457 -11.956
  477   1HA   GLY  60          2HA       GLY  60  -2.362   4.459  -9.311
  478   2HA   GLY  60          1HA       GLY  60  -1.180   3.251  -9.791
  479    H    VAL  61           H        VAL  61   0.032   5.044 -11.798
  480    HA   VAL  61           HA       VAL  61   2.114   6.092 -10.320
  481    HB   VAL  61           HB       VAL  61   1.181   7.147 -12.989
  482   1HG1  VAL  61          1HG1      VAL  61   3.748   7.247 -11.465
  483   2HG1  VAL  61          2HG1      VAL  61   2.877   8.548 -12.276
  484   3HG1  VAL  61          3HG1      VAL  61   3.744   7.341 -13.227
  485   1HG2  VAL  61          1HG2      VAL  61   2.693   4.657 -12.267
  486   2HG2  VAL  61          2HG2      VAL  61   2.881   5.426 -13.843
  487   3HG2  VAL  61          3HG2      VAL  61   1.299   4.837 -13.334
  488    H    ASN  62           H        ASN  62  -0.781   7.743 -11.547
  489    HA   ASN  62           HA       ASN  62   0.006  10.260 -10.382
  490   1HB   ASN  62          2HB       ASN  62  -1.781   9.441 -12.399
  491   2HB   ASN  62          1HB       ASN  62  -2.774  10.176 -11.144
  492   1HD2  ASN  62          1HD2      ASN  62   0.376  10.786 -12.667
  493   2HD2  ASN  62          2HD2      ASN  62   0.112  12.473 -12.929
  494    H    PHE  63           H        PHE  63  -1.126   7.522  -8.991
  495    HA   PHE  63           HA       PHE  63  -3.039   8.787  -7.203
  496   1HB   PHE  63          2HB       PHE  63  -3.510   6.517  -7.986
  497   2HB   PHE  63          1HB       PHE  63  -1.997   5.947  -7.289
  498    HD1  PHE  63           1HD      PHE  63  -4.676   8.161  -5.946
  499    HD2  PHE  63           2HD      PHE  63  -2.493   4.531  -5.544
  500    HE1  PHE  63           1HE      PHE  63  -5.829   7.709  -3.821
  501    HE2  PHE  63           2HE      PHE  63  -3.643   4.072  -3.418
  502    HZ   PHE  63           HZ       PHE  63  -5.313   5.662  -2.553
  503    H    ILE  64           H        ILE  64   0.256   7.595  -7.189
  504    HA   ILE  64           HA       ILE  64   0.853   7.425  -4.522
  505    HB   ILE  64           HB       ILE  64   2.599   8.627  -6.675
  506   1HG1  ILE  64          2HG1      ILE  64   3.390   5.998  -5.995
  507   2HG1  ILE  64          1HG1      ILE  64   1.644   5.954  -6.214
  508   1HG2  ILE  64          1HG2      ILE  64   4.145   7.284  -4.747
  509   2HG2  ILE  64          2HG2      ILE  64   3.036   8.331  -3.862
  510   3HG2  ILE  64          3HG2      ILE  64   4.099   9.013  -5.092
  511   1HD1  ILE  64          1HD1      ILE  64   3.405   7.261  -8.243
  512   2HD1  ILE  64          2HD1      ILE  64   1.784   6.594  -8.434
  513   3HD1  ILE  64          3HD1      ILE  64   3.164   5.513  -8.234
  514    H    ASP  65           H        ASP  65   0.203  10.307  -6.372
  515    HA   ASP  65           HA       ASP  65   1.244  12.105  -4.375
  516   1HB   ASP  65          2HB       ASP  65   1.173  12.683  -6.801
  517   2HB   ASP  65          1HB       ASP  65  -0.585  12.710  -6.713
  518    H    PHE  66           H        PHE  66  -1.868  10.707  -5.199
  519    HA   PHE  66           HA       PHE  66  -3.496  12.415  -3.672
  520   1HB   PHE  66          2HB       PHE  66  -4.395  10.829  -5.326
  521   2HB   PHE  66          1HB       PHE  66  -3.893   9.482  -4.311
  522    HD1  PHE  66           1HD      PHE  66  -4.905   9.351  -1.958
  523    HD2  PHE  66           2HD      PHE  66  -6.501  11.763  -5.079
  524    HE1  PHE  66           1HE      PHE  66  -7.070   9.420  -0.792
  525    HE2  PHE  66           2HE      PHE  66  -8.669  11.837  -3.918
  526    HZ   PHE  66           HZ       PHE  66  -8.955  10.665  -1.772
  527    H    ILE  67           H        ILE  67  -1.674   9.511  -2.863
  528    HA   ILE  67           HA       ILE  67  -2.649   9.184  -0.235
  529    HB   ILE  67           HB       ILE  67  -0.011   8.360  -1.464
  530   1HG1  ILE  67          2HG1      ILE  67  -1.269   6.065  -1.144
  531   2HG1  ILE  67          1HG1      ILE  67  -2.703   7.087  -1.157
  532   1HG2  ILE  67          1HG2      ILE  67   0.525   8.302   0.777
  533   2HG2  ILE  67          2HG2      ILE  67  -0.125   6.681   0.532
  534   3HG2  ILE  67          3HG2      ILE  67  -1.126   7.930   1.272
  535   1HD1  ILE  67          1HD1      ILE  67  -0.752   7.509  -3.330
  536   2HD1  ILE  67          2HD1      ILE  67  -2.515   7.554  -3.356
  537   3HD1  ILE  67          3HD1      ILE  67  -1.672   6.005  -3.354
  538    H    LYS  68           H        LYS  68   0.284  10.783  -1.483
  539    HA   LYS  68           HA       LYS  68   1.093  11.763   1.056
  540   1HB   LYS  68          2HB       LYS  68   2.654  13.185  -0.226
  541   2HB   LYS  68          1HB       LYS  68   2.722  11.496  -0.710
  542   1HG   LYS  68          2HG       LYS  68   2.708  12.476  -2.739
  543   2HG   LYS  68          1HG       LYS  68   0.975  12.290  -2.486
  544   1HD   LYS  68          2HD       LYS  68   0.650  14.499  -2.513
  545   2HD   LYS  68          1HD       LYS  68   1.953  14.768  -1.355
  546   1HE   LYS  68          2HE       LYS  68   3.587  14.815  -3.086
  547   2HE   LYS  68          1HE       LYS  68   2.422  14.251  -4.284
  548   1HZ   LYS  68          1HZ       LYS  68   1.221  16.463  -3.432
  549   2HZ   LYS  68          2HZ       LYS  68   2.292  16.434  -4.742
  550   3HZ   LYS  68          3HZ       LYS  68   2.834  16.918  -3.214
  551    H    GLU  69           H        GLU  69  -1.095  12.870  -1.385
  552    HA   GLU  69           HA       GLU  69  -1.214  15.600  -0.780
  553   1HB   GLU  69          2HB       GLU  69  -2.272  14.430  -2.754
  554   2HB   GLU  69          1HB       GLU  69  -3.541  13.900  -1.662
  555   1HG   GLU  69          2HG       GLU  69  -4.398  16.022  -1.406
  556   2HG   GLU  69          1HG       GLU  69  -2.885  16.800  -1.870
  557    H    ASN  70           H        ASN  70  -2.951  12.835   0.563
  558    HA   ASN  70           HA       ASN  70  -3.924  14.584   2.726
  559   1HB   ASN  70          2HB       ASN  70  -5.270  11.999   2.006
  560   2HB   ASN  70          1HB       ASN  70  -5.936  13.403   2.834
  561   1HD2  ASN  70          1HD2      ASN  70  -4.643  12.357  -0.287
  562   2HD2  ASN  70          2HD2      ASN  70  -5.667  13.361  -1.248
  563    H    SER  71           H        SER  71  -1.440  12.808   2.353
  564    HA   SER  71           HA       SER  71  -1.263  11.939   5.038
  565   1HB   SER  71          2HB       SER  71  -2.600  10.124   3.420
  566   2HB   SER  71          1HB       SER  71  -0.954   9.498   3.463
  567    HG   SER  71           HG       SER  71  -2.679   9.044   5.249
  568    HA   PRO  72           HA       PRO  72   2.738  12.433   2.807
  569   1HB   PRO  72          2HB       PRO  72   3.457  14.666   4.381
  570   2HB   PRO  72          1HB       PRO  72   2.898  14.682   2.709
  571   1HG   PRO  72          2HG       PRO  72   1.529  15.720   4.923
  572   2HG   PRO  72          1HG       PRO  72   0.850  15.428   3.315
  573   1HD   PRO  72          2HD       PRO  72   0.647  13.783   5.790
  574   2HD   PRO  72          1HD       PRO  72  -0.530  14.005   4.476
  575    H    ASP  73           H        ASP  73   1.788  11.849   5.983
  576    HA   ASP  73           HA       ASP  73   4.527  11.502   6.936
  577   1HB   ASP  73          2HB       ASP  73   2.564  12.637   8.255
  578   2HB   ASP  73          1HB       ASP  73   2.151  10.972   8.654
  579    H    SER  74           H        SER  74   1.968   9.742   5.643
  580    HA   SER  74           HA       SER  74   2.411   7.237   6.911
  581   1HB   SER  74          2HB       SER  74   1.240   6.978   4.287
  582   2HB   SER  74          1HB       SER  74   0.493   6.752   5.865
  583    HG   SER  74           HG       SER  74   0.696   9.112   4.335
  584    H    VAL  75           H        VAL  75   2.418   5.629   4.470
  585    HA   VAL  75           HA       VAL  75   5.017   6.184   3.290
  586    HB   VAL  75           HB       VAL  75   4.473   3.505   4.570
  587   1HG1  VAL  75          1HG1      VAL  75   6.531   4.596   2.712
  588   2HG1  VAL  75          2HG1      VAL  75   5.831   2.980   2.796
  589   3HG1  VAL  75          3HG1      VAL  75   7.070   3.467   3.954
  590   1HG2  VAL  75          1HG2      VAL  75   5.029   4.757   6.406
  591   2HG2  VAL  75          2HG2      VAL  75   5.965   5.921   5.469
  592   3HG2  VAL  75          3HG2      VAL  75   6.643   4.334   5.834
  593    H    VAL  76           H        VAL  76   5.156   5.652   1.252
  594    HA   VAL  76           HA       VAL  76   2.906   4.199   0.045
  595    HB   VAL  76           HB       VAL  76   4.902   6.077  -1.220
  596   1HG1  VAL  76          1HG1      VAL  76   4.157   4.401  -2.818
  597   2HG1  VAL  76          2HG1      VAL  76   3.452   5.972  -3.202
  598   3HG1  VAL  76          3HG1      VAL  76   2.475   4.737  -2.409
  599   1HG2  VAL  76          1HG2      VAL  76   2.241   6.443  -0.010
  600   2HG2  VAL  76          2HG2      VAL  76   2.525   7.275  -1.539
  601   3HG2  VAL  76          3HG2      VAL  76   3.588   7.571  -0.162
  602    H    ILE  77           H        ILE  77   3.478   2.071   0.083
  603    HA   ILE  77           HA       ILE  77   6.147   1.275  -0.767
  604    HB   ILE  77           HB       ILE  77   3.837  -0.454   0.124
  605   1HG1  ILE  77          2HG1      ILE  77   4.593   1.073   1.896
  606   2HG1  ILE  77          1HG1      ILE  77   5.025  -0.593   2.267
  607   1HG2  ILE  77          1HG2      ILE  77   5.611  -1.521  -1.317
  608   2HG2  ILE  77          2HG2      ILE  77   5.384  -2.246   0.275
  609   3HG2  ILE  77          3HG2      ILE  77   6.755  -1.177  -0.021
  610   1HD1  ILE  77          1HD1      ILE  77   7.307  -0.193   1.633
  611   2HD1  ILE  77          2HD1      ILE  77   6.803   1.035   2.794
  612   3HD1  ILE  77          3HD1      ILE  77   6.907   1.433   1.079
  613    H    VAL  78           H        VAL  78   2.788   0.443  -1.701
  614    HA   VAL  78           HA       VAL  78   1.939  -0.390  -3.665
  615    HB   VAL  78           HB       VAL  78   4.032   1.421  -4.899
  616   1HG1  VAL  78          1HG1      VAL  78   1.341   0.752  -6.049
  617   2HG1  VAL  78          2HG1      VAL  78   2.738  -0.284  -6.335
  618   3HG1  VAL  78          3HG1      VAL  78   2.766   1.398  -6.860
  619   1HG2  VAL  78          1HG2      VAL  78   1.314   2.450  -4.710
  620   2HG2  VAL  78          2HG2      VAL  78   2.848   3.217  -4.301
  621   3HG2  VAL  78          3HG2      VAL  78   2.050   2.164  -3.134
  622    H    ILE  79           H        ILE  79   2.692  -2.541  -3.343
  623    HA   ILE  79           HA       ILE  79   5.210  -3.250  -4.640
  624    HB   ILE  79           HB       ILE  79   3.496  -5.307  -3.339
  625   1HG1  ILE  79          2HG1      ILE  79   5.279  -3.407  -1.807
  626   2HG1  ILE  79          1HG1      ILE  79   3.521  -3.364  -1.783
  627   1HG2  ILE  79          1HG2      ILE  79   5.791  -6.102  -2.660
  628   2HG2  ILE  79          2HG2      ILE  79   6.442  -4.813  -3.672
  629   3HG2  ILE  79          3HG2      ILE  79   5.465  -6.091  -4.393
  630   1HD1  ILE  79          1HD1      ILE  79   3.674  -4.683  -0.004
  631   2HD1  ILE  79          2HD1      ILE  79   5.365  -5.063  -0.329
  632   3HD1  ILE  79          3HD1      ILE  79   4.087  -5.971  -1.136
  633    H    THR  80           H        THR  80   5.401  -4.631  -6.319
  634    HA   THR  80           HA       THR  80   3.723  -6.387  -7.474
  635    HB   THR  80           HB       THR  80   2.924  -4.649  -9.437
  636    HG1  THR  80           1HG      THR  80   2.024  -3.264  -7.221
  637   1HG2  THR  80          1HG2      THR  80   1.690  -6.378  -7.716
  638   2HG2  THR  80          2HG2      THR  80   0.901  -5.440  -8.981
  639   3HG2  THR  80          3HG2      THR  80   0.934  -4.836  -7.328
  640    H    GLY  81           H        GLY  81   3.942  -6.237 -10.116
  641   1HA   GLY  81          2HA       GLY  81   6.409  -5.099 -11.015
  642   2HA   GLY  81          1HA       GLY  81   6.563  -6.819 -10.697
  643    H    HIS  82           H        HIS  82   4.300  -7.914 -11.592
  644    HA   HIS  82           HA       HIS  82   3.257  -8.667 -13.466
  645   1HB   HIS  82          2HB       HIS  82   2.345  -6.297 -13.348
  646   2HB   HIS  82          1HB       HIS  82   3.551  -5.868 -14.555
  647    HD1  HIS  82           1HD      HIS  82   0.853  -8.545 -14.233
  648    HD2  HIS  82           2HD      HIS  82   2.514  -5.968 -17.039
  649    HE1  HIS  82           1HE      HIS  82  -0.450  -8.926 -16.351
  650    HE2  HIS  82           2HE      HIS  82   0.614  -7.402 -18.051
  651    H    GLY  83           H        GLY  83   6.187  -8.710 -13.287
  652   1HA   GLY  83          2HA       GLY  83   7.235 -10.021 -15.188
  653   2HA   GLY  83          1HA       GLY  83   6.872  -8.600 -16.157
  654    H    SER  84           H        SER  84   7.647  -6.508 -14.723
  655    HA   SER  84           HA       SER  84  10.380  -7.037 -13.805
  656   1HB   SER  84          2HB       SER  84  10.418  -6.366 -16.222
  657   2HB   SER  84          1HB       SER  84   9.698  -4.826 -15.753
  658    HG   SER  84           HG       SER  84  12.146  -5.833 -14.729
  659    H    VAL  85           H        VAL  85  11.269  -4.571 -13.266
  660    HA   VAL  85           HA       VAL  85   9.307  -3.552 -11.319
  661    HB   VAL  85           HB       VAL  85  12.307  -3.242 -11.181
  662   1HG1  VAL  85          1HG1      VAL  85  10.020  -2.407  -9.501
  663   2HG1  VAL  85          2HG1      VAL  85  11.582  -1.631  -9.762
  664   3HG1  VAL  85          3HG1      VAL  85  11.451  -3.001  -8.658
  665   1HG2  VAL  85          1HG2      VAL  85  10.503  -5.388 -10.129
  666   2HG2  VAL  85          2HG2      VAL  85  11.982  -4.960  -9.268
  667   3HG2  VAL  85          3HG2      VAL  85  12.067  -5.536 -10.934
  668    H    ASP  86           H        ASP  86   9.169  -2.649 -13.952
  669    HA   ASP  86           HA       ASP  86  10.583  -0.136 -14.158
  670   1HB   ASP  86          2HB       ASP  86   9.177   0.135 -16.238
  671   2HB   ASP  86          1HB       ASP  86  10.205  -1.294 -16.216
  672    H    THR  87           H        THR  87   7.479  -1.253 -13.049
  673    HA   THR  87           HA       THR  87   6.168   1.280 -13.168
  674    HB   THR  87           HB       THR  87   5.066  -1.031 -13.013
  675    HG1  THR  87           1HG      THR  87   3.323  -0.152 -11.817
  676   1HG2  THR  87          1HG2      THR  87   6.212  -1.938 -11.088
  677   2HG2  THR  87          2HG2      THR  87   4.486  -1.790 -10.757
  678   3HG2  THR  87          3HG2      THR  87   5.617  -0.616 -10.083
  679    H    ALA  88           H        ALA  88   8.120  -0.419 -10.821
  680    HA   ALA  88           HA       ALA  88   7.637   1.112  -8.545
  681   1HB   ALA  88          1HB       ALA  88   9.944   0.427  -7.863
  682   2HB   ALA  88          2HB       ALA  88  10.151  -0.267  -9.471
  683   3HB   ALA  88          3HB       ALA  88   8.916  -0.908  -8.387
  684    H    VAL  89           H        VAL  89  10.293   1.454 -10.873
  685    HA   VAL  89           HA       VAL  89  11.341   3.843  -9.930
  686    HB   VAL  89           HB       VAL  89  12.307   4.143 -12.179
  687   1HG1  VAL  89          1HG1      VAL  89  12.567   1.227 -11.793
  688   2HG1  VAL  89          2HG1      VAL  89  12.923   2.240 -10.393
  689   3HG1  VAL  89          3HG1      VAL  89  13.809   2.475 -11.900
  690   1HG2  VAL  89          1HG2      VAL  89  11.742   2.809 -14.029
  691   2HG2  VAL  89          2HG2      VAL  89  10.196   3.304 -13.339
  692   3HG2  VAL  89          3HG2      VAL  89  10.817   1.681 -13.039
  693    H    LYS  90           H        LYS  90   8.462   3.244 -11.766
  694    HA   LYS  90           HA       LYS  90   8.164   6.000 -12.613
  695   1HB   LYS  90          2HB       LYS  90   7.400   4.179 -14.064
  696   2HB   LYS  90          1HB       LYS  90   6.275   3.651 -12.821
  697   1HG   LYS  90          2HG       LYS  90   4.910   5.530 -13.096
  698   2HG   LYS  90          1HG       LYS  90   6.153   6.409 -13.989
  699   1HD   LYS  90          2HD       LYS  90   4.981   3.845 -15.025
  700   2HD   LYS  90          1HD       LYS  90   4.206   5.403 -15.321
  701   1HE   LYS  90          2HE       LYS  90   6.777   5.948 -16.008
  702   2HE   LYS  90          1HE       LYS  90   6.651   4.253 -16.476
  703   1HZ   LYS  90          1HZ       LYS  90   6.041   5.709 -18.295
  704   2HZ   LYS  90          2HZ       LYS  90   4.837   6.435 -17.355
  705   3HZ   LYS  90          3HZ       LYS  90   4.700   4.807 -17.796
  706    H    ALA  91           H        ALA  91   7.952   4.717  -9.683
  707    HA   ALA  91           HA       ALA  91   5.749   6.492  -8.905
  708   1HB   ALA  91          1HB       ALA  91   4.953   4.861  -7.277
  709   2HB   ALA  91          2HB       ALA  91   6.176   3.713  -7.818
  710   3HB   ALA  91          3HB       ALA  91   4.886   4.207  -8.913
  711    H    ILE  92           H        ILE  92   8.630   4.699  -7.867
  712    HA   ILE  92           HA       ILE  92   8.851   5.925  -5.334
  713    HB   ILE  92           HB       ILE  92  11.012   4.994  -5.152
  714   1HG1  ILE  92          2HG1      ILE  92  11.016   4.664  -8.164
  715   2HG1  ILE  92          1HG1      ILE  92  11.961   5.844  -7.260
  716   1HG2  ILE  92          1HG2      ILE  92  10.670   2.661  -6.146
  717   2HG2  ILE  92          2HG2      ILE  92   9.141   3.288  -6.757
  718   3HG2  ILE  92          3HG2      ILE  92   9.453   3.266  -5.023
  719   1HD1  ILE  92          1HD1      ILE  92  12.543   3.325  -6.154
  720   2HD1  ILE  92          2HD1      ILE  92  13.593   4.366  -7.116
  721   3HD1  ILE  92          3HD1      ILE  92  12.597   3.144  -7.907
  722    H    LYS  93           H        LYS  93   9.482   7.101  -8.477
  723    HA   LYS  93           HA       LYS  93  11.270   9.196  -7.508
  724   1HB   LYS  93          2HB       LYS  93  10.424   8.259 -10.230
  725   2HB   LYS  93          1HB       LYS  93  11.134   9.854 -10.026
  726   1HG   LYS  93          2HG       LYS  93  12.803   8.066  -8.644
  727   2HG   LYS  93          1HG       LYS  93  12.419   7.305 -10.188
  728   1HD   LYS  93          2HD       LYS  93  12.924   9.909 -10.906
  729   2HD   LYS  93          1HD       LYS  93  14.083   9.634  -9.603
  730   1HE   LYS  93          2HE       LYS  93  15.172   7.949 -10.750
  731   2HE   LYS  93          1HE       LYS  93  13.775   7.599 -11.767
  732   1HZ   LYS  93          1HZ       LYS  93  15.204   8.688 -13.194
  733   2HZ   LYS  93          2HZ       LYS  93  15.746   9.775 -12.016
  734   3HZ   LYS  93          3HZ       LYS  93  14.200   9.951 -12.682
  735    H    LYS  94           H        LYS  94   8.321   8.935  -6.881
  736    HA   LYS  94           HA       LYS  94   7.629  11.697  -7.554
  737   1HB   LYS  94          2HB       LYS  94   5.767   9.336  -7.840
  738   2HB   LYS  94          1HB       LYS  94   5.286  11.022  -7.976
  739   1HG   LYS  94          2HG       LYS  94   7.267   9.632  -9.769
  740   2HG   LYS  94          1HG       LYS  94   5.574   9.944 -10.160
  741   1HD   LYS  94          2HD       LYS  94   7.601  12.080  -9.504
  742   2HD   LYS  94          1HD       LYS  94   7.150  11.599 -11.141
  743   1HE   LYS  94          2HE       LYS  94   5.306  12.846 -11.082
  744   2HE   LYS  94          1HE       LYS  94   4.816  12.165  -9.532
  745   1HZ   LYS  94          1HZ       LYS  94   6.780  13.781  -8.760
  746   2HZ   LYS  94          2HZ       LYS  94   5.161  14.264  -8.846
  747   3HZ   LYS  94          3HZ       LYS  94   6.224  14.639 -10.109
  748    H    GLY  95           H        GLY  95   6.617   8.835  -5.672
  749   1HA   GLY  95          2HA       GLY  95   6.738  10.315  -3.224
  750   2HA   GLY  95          1HA       GLY  95   5.085  10.070  -3.752
  751    H    ALA  96           H        ALA  96   7.226   7.518  -4.613
  752    HA   ALA  96           HA       ALA  96   5.920   5.814  -2.655
  753   1HB   ALA  96          1HB       ALA  96   6.177   4.137  -4.099
  754   2HB   ALA  96          2HB       ALA  96   7.879   4.510  -4.369
  755   3HB   ALA  96          3HB       ALA  96   6.632   5.378  -5.265
  756    H    TYR  97           H        TYR  97   7.453   3.993  -1.775
  757    HA   TYR  97           HA       TYR  97   9.566   5.407  -0.356
  758   1HB   TYR  97          2HB       TYR  97   8.052   4.292   1.097
  759   2HB   TYR  97          1HB       TYR  97   8.130   2.807   0.160
  760    HD1  TYR  97           1HD      TYR  97  10.054   4.996   2.445
  761    HD2  TYR  97           2HD      TYR  97   9.757   1.162   0.629
  762    HE1  TYR  97           1HE      TYR  97  11.807   4.155   3.948
  763    HE2  TYR  97           2HE      TYR  97  11.510   0.309   2.124
  764    HH   TYR  97           HH       TYR  97  13.433   2.372   4.068
  765    H    GLU  98           H        GLU  98   9.223   3.255  -2.917
  766    HA   GLU  98           HA       GLU  98  11.503   3.130  -4.102
  767   1HB   GLU  98          2HB       GLU  98  13.000   1.415  -3.137
  768   2HB   GLU  98          1HB       GLU  98  12.842   2.828  -2.108
  769   1HG   GLU  98          2HG       GLU  98  10.972   1.388  -0.962
  770   2HG   GLU  98          1HG       GLU  98  11.854   0.052  -1.699
  771    H    PHE  99           H        PHE  99   8.866   1.355  -2.938
  772    HA   PHE  99           HA       PHE  99   7.597  -0.257  -3.937
  773   1HB   PHE  99          2HB       PHE  99   9.169   0.718  -6.074
  774   2HB   PHE  99          1HB       PHE  99   9.237  -1.037  -6.171
  775    HD1  PHE  99           1HD      PHE  99   7.475  -2.233  -7.102
  776    HD2  PHE  99           2HD      PHE  99   6.870   1.810  -5.920
  777    HE1  PHE  99           1HE      PHE  99   5.265  -2.253  -8.183
  778    HE2  PHE  99           2HE      PHE  99   4.660   1.799  -7.000
  779    HZ   PHE  99           HZ       PHE  99   3.854  -0.235  -8.133
  780    H    LEU 100           H        LEU 100   7.454  -2.333  -3.363
  781    HA   LEU 100           HA       LEU 100   9.881  -3.680  -2.491
  782   1HB   LEU 100          2HB       LEU 100   7.174  -3.594  -1.632
  783   2HB   LEU 100          1HB       LEU 100   7.531  -5.249  -2.073
  784    HG   LEU 100           HG       LEU 100   8.000  -5.175   0.192
  785   1HD1  LEU 100          1HD1      LEU 100   9.871  -6.092  -1.184
  786   2HD1  LEU 100          2HD1      LEU 100  10.339  -5.531   0.419
  787   3HD1  LEU 100          3HD1      LEU 100  10.690  -4.541  -0.997
  788   1HD2  LEU 100          1HD2      LEU 100   9.204  -2.474  -0.326
  789   2HD2  LEU 100          2HD2      LEU 100   9.439  -3.350   1.187
  790   3HD2  LEU 100          3HD2      LEU 100   7.816  -2.881   0.683
  791    H    GLU 101           H        GLU 101  10.314  -5.898  -3.054
  792    HA   GLU 101           HA       GLU 101   9.629  -6.464  -5.831
  793   1HB   GLU 101          2HB       GLU 101  11.526  -8.035  -4.092
  794   2HB   GLU 101          1HB       GLU 101  11.470  -7.966  -5.848
  795   1HG   GLU 101          2HG       GLU 101  12.248  -5.679  -5.817
  796   2HG   GLU 101          1HG       GLU 101  12.215  -5.667  -4.055
  797    H    LYS 102           H        LYS 102   9.420  -8.939  -6.301
  798    HA   LYS 102           HA       LYS 102   8.179 -10.837  -6.140
  799   1HB   LYS 102          2HB       LYS 102   9.259 -10.463  -3.591
  800   2HB   LYS 102          1HB       LYS 102   7.554 -10.778  -3.305
  801   1HG   LYS 102          2HG       LYS 102   7.663 -12.907  -4.167
  802   2HG   LYS 102          1HG       LYS 102   9.081 -12.549  -5.155
  803   1HD   LYS 102          2HD       LYS 102  10.478 -12.477  -3.173
  804   2HD   LYS 102          1HD       LYS 102   9.069 -12.730  -2.142
  805   1HE   LYS 102          2HE       LYS 102   9.512 -14.729  -4.268
  806   2HE   LYS 102          1HE       LYS 102  10.693 -14.711  -2.960
  807   1HZ   LYS 102          1HZ       LYS 102   8.621 -16.174  -2.722
  808   2HZ   LYS 102          2HZ       LYS 102   7.802 -14.736  -2.376
  809   3HZ   LYS 102          3HZ       LYS 102   9.088 -15.232  -1.396
  810    HA   PRO 103           HA       PRO 103   4.341  -8.285  -6.109
  811   1HB   PRO 103          2HB       PRO 103   3.362  -9.331  -8.419
  812   2HB   PRO 103          1HB       PRO 103   4.497  -7.977  -8.377
  813   1HG   PRO 103          2HG       PRO 103   5.038 -10.886  -8.845
  814   2HG   PRO 103          1HG       PRO 103   5.684  -9.477  -9.707
  815   1HD   PRO 103          2HD       PRO 103   7.108 -10.770  -7.818
  816   2HD   PRO 103          1HD       PRO 103   7.229  -9.015  -8.050
  817    H    PHE 104           H        PHE 104   5.049 -11.565  -5.833
  818    HA   PHE 104           HA       PHE 104   2.243 -12.347  -5.571
  819   1HB   PHE 104          2HB       PHE 104   4.812 -13.905  -5.764
  820   2HB   PHE 104          1HB       PHE 104   3.314 -14.666  -5.238
  821    HD1  PHE 104           1HD      PHE 104   5.339 -13.969  -7.994
  822    HD2  PHE 104           2HD      PHE 104   1.254 -14.222  -6.834
  823    HE1  PHE 104           1HE      PHE 104   4.699 -14.314 -10.345
  824    HE2  PHE 104           2HE      PHE 104   0.605 -14.570  -9.182
  825    HZ   PHE 104           HZ       PHE 104   2.328 -14.616 -10.940
  826    H    SER 105           H        SER 105   5.283 -12.669  -3.728
  827    HA   SER 105           HA       SER 105   3.689 -12.963  -1.280
  828   1HB   SER 105          2HB       SER 105   5.606 -13.970  -0.266
  829   2HB   SER 105          1HB       SER 105   5.444 -14.689  -1.867
  830    HG   SER 105           HG       SER 105   7.232 -12.631  -1.084
  831    H    VAL 106           H        VAL 106   4.573 -11.923   0.696
  832    HA   VAL 106           HA       VAL 106   5.869  -9.341   0.118
  833    HB   VAL 106           HB       VAL 106   4.402  -8.291   1.830
  834   1HG1  VAL 106          1HG1      VAL 106   3.246  -9.450  -0.680
  835   2HG1  VAL 106          2HG1      VAL 106   3.784  -7.801  -0.361
  836   3HG1  VAL 106          3HG1      VAL 106   2.291  -8.397   0.364
  837   1HG2  VAL 106          1HG2      VAL 106   2.168  -9.904   1.872
  838   2HG2  VAL 106          2HG2      VAL 106   3.309  -9.669   3.196
  839   3HG2  VAL 106          3HG2      VAL 106   3.500 -11.036   2.098
  840    H    GLU 107           H        GLU 107   6.263 -12.170   1.658
  841    HA   GLU 107           HA       GLU 107   6.782 -11.923   4.268
  842   1HB   GLU 107          2HB       GLU 107   7.338 -13.858   2.699
  843   2HB   GLU 107          1HB       GLU 107   8.892 -13.071   2.462
  844   1HG   GLU 107          2HG       GLU 107   8.816 -13.100   5.135
  845   2HG   GLU 107          1HG       GLU 107   7.833 -14.523   4.794
  846    H    ARG 108           H        ARG 108   8.923 -10.667   1.724
  847    HA   ARG 108           HA       ARG 108  10.829  -9.595   3.574
  848   1HB   ARG 108          2HB       ARG 108  11.062 -10.224   1.016
  849   2HB   ARG 108          1HB       ARG 108  10.570  -8.552   0.785
  850   1HG   ARG 108          2HG       ARG 108  12.748  -8.097   0.931
  851   2HG   ARG 108          1HG       ARG 108  12.520  -8.295   2.669
  852   1HD   ARG 108          2HD       ARG 108  14.010  -9.942   2.617
  853   2HD   ARG 108          1HD       ARG 108  12.873 -10.881   1.651
  854    HE   ARG 108           HE       ARG 108  14.169  -9.241  -0.132
  855   1HH1  ARG 108          1HH1      ARG 108  15.112 -11.696   2.161
  856   2HH1  ARG 108          2HH1      ARG 108  16.499 -12.192   1.251
  857   1HH2  ARG 108          1HH2      ARG 108  15.991  -9.893  -1.333
  858   2HH2  ARG 108          2HH2      ARG 108  16.998 -11.169  -0.733
  859    H    PHE 109           H        PHE 109   8.037  -8.398   1.838
  860    HA   PHE 109           HA       PHE 109   8.291  -5.660   2.223
  861   1HB   PHE 109          2HB       PHE 109   6.530  -6.152   0.830
  862   2HB   PHE 109          1HB       PHE 109   6.043  -7.548   1.766
  863    HD1  PHE 109           1HD      PHE 109   5.721  -3.934   1.378
  864    HD2  PHE 109           2HD      PHE 109   4.502  -7.343   3.613
  865    HE1  PHE 109           1HE      PHE 109   3.882  -2.626   2.359
  866    HE2  PHE 109           2HE      PHE 109   2.660  -6.043   4.599
  867    HZ   PHE 109           HZ       PHE 109   2.347  -3.681   3.971
  868    H    LEU 110           H        LEU 110   7.563  -8.163   4.493
  869    HA   LEU 110           HA       LEU 110   6.243  -6.648   6.466
  870   1HB   LEU 110          2HB       LEU 110   6.891  -9.275   6.119
  871   2HB   LEU 110          1HB       LEU 110   7.934  -8.811   7.448
  872    HG   LEU 110           HG       LEU 110   4.987  -8.234   7.502
  873   1HD1  LEU 110          1HD1      LEU 110   4.714 -10.306   8.795
  874   2HD1  LEU 110          2HD1      LEU 110   6.381 -10.743   8.420
  875   3HD1  LEU 110          3HD1      LEU 110   5.191 -10.612   7.125
  876   1HD2  LEU 110          1HD2      LEU 110   7.058  -7.466   9.138
  877   2HD2  LEU 110          2HD2      LEU 110   6.405  -8.880   9.967
  878   3HD2  LEU 110          3HD2      LEU 110   5.353  -7.516   9.587
  879    H    LEU 111           H        LEU 111   9.658  -7.444   5.991
  880    HA   LEU 111           HA       LEU 111  10.699  -6.366   8.324
  881   1HB   LEU 111          2HB       LEU 111  11.856  -6.582   5.560
  882   2HB   LEU 111          1HB       LEU 111  12.783  -5.981   6.923
  883    HG   LEU 111           HG       LEU 111  12.166  -8.216   8.063
  884   1HD1  LEU 111          1HD1      LEU 111  11.219  -8.634   5.288
  885   2HD1  LEU 111          2HD1      LEU 111  10.628  -9.311   6.806
  886   3HD1  LEU 111          3HD1      LEU 111  12.087  -9.963   6.058
  887   1HD2  LEU 111          1HD2      LEU 111  14.411  -7.516   7.214
  888   2HD2  LEU 111          2HD2      LEU 111  14.020  -8.316   5.691
  889   3HD2  LEU 111          3HD2      LEU 111  14.124  -9.256   7.179
  890    H    THR 112           H        THR 112  10.431  -4.756   5.157
  891    HA   THR 112           HA       THR 112  11.289  -2.234   6.021
  892    HB   THR 112           HB       THR 112   9.447  -2.966   3.737
  893    HG1  THR 112           1HG      THR 112  11.655  -3.830   3.796
  894   1HG2  THR 112          1HG2      THR 112  10.016  -0.889   2.705
  895   2HG2  THR 112          2HG2      THR 112  11.077  -0.459   4.047
  896   3HG2  THR 112          3HG2      THR 112   9.334  -0.559   4.297
  897    H    ILE 113           H        ILE 113   8.072  -3.679   5.910
  898    HA   ILE 113           HA       ILE 113   6.430  -1.548   6.331
  899    HB   ILE 113           HB       ILE 113   6.321  -4.392   7.161
  900   1HG1  ILE 113          2HG1      ILE 113   5.543  -3.636   4.961
  901   2HG1  ILE 113          1HG1      ILE 113   4.221  -4.315   5.904
  902   1HG2  ILE 113          1HG2      ILE 113   5.520  -3.529   9.203
  903   2HG2  ILE 113          2HG2      ILE 113   4.085  -3.961   8.272
  904   3HG2  ILE 113          3HG2      ILE 113   4.582  -2.274   8.395
  905   1HD1  ILE 113          1HD1      ILE 113   4.427  -1.477   6.327
  906   2HD1  ILE 113          2HD1      ILE 113   3.064  -2.438   5.749
  907   3HD1  ILE 113          3HD1      ILE 113   4.281  -1.860   4.611
  908    H    LYS 114           H        LYS 114   8.052  -3.372   8.943
  909    HA   LYS 114           HA       LYS 114   7.145  -1.944  11.107
  910   1HB   LYS 114          2HB       LYS 114   8.787  -3.979  10.927
  911   2HB   LYS 114          1HB       LYS 114  10.024  -2.732  10.994
  912   1HG   LYS 114          2HG       LYS 114   7.850  -2.899  13.050
  913   2HG   LYS 114          1HG       LYS 114   9.332  -3.847  13.181
  914   1HD   LYS 114          2HD       LYS 114   9.262  -0.848  12.875
  915   2HD   LYS 114          1HD       LYS 114   9.381  -1.682  14.425
  916   1HE   LYS 114          2HE       LYS 114  11.350  -1.800  12.146
  917   2HE   LYS 114          1HE       LYS 114  11.582  -1.014  13.707
  918   1HZ   LYS 114          1HZ       LYS 114  12.693  -3.100  13.752
  919   2HZ   LYS 114          2HZ       LYS 114  11.327  -3.925  13.189
  920   3HZ   LYS 114          3HZ       LYS 114  11.327  -3.243  14.738
  921    H    HIS 115           H        HIS 115  10.227  -1.375   9.441
  922    HA   HIS 115           HA       HIS 115  10.826   1.060  10.640
  923   1HB   HIS 115          2HB       HIS 115  12.321  -0.401   9.185
  924   2HB   HIS 115          1HB       HIS 115  11.561   0.380   7.801
  925    HD1  HIS 115           1HD      HIS 115  14.388   0.692   9.970
  926    HD2  HIS 115           2HD      HIS 115  11.885   3.360   7.999
  927    HE1  HIS 115           1HE      HIS 115  15.648   2.866   9.896
  928    HE2  HIS 115           2HE      HIS 115  14.077   4.490   8.783
  929    H    ALA 116           H        ALA 116   8.613   0.315   8.056
  930    HA   ALA 116           HA       ALA 116   8.394   2.890   6.922
  931   1HB   ALA 116          1HB       ALA 116   6.135   0.916   7.045
  932   2HB   ALA 116          2HB       ALA 116   7.537   0.662   6.006
  933   3HB   ALA 116          3HB       ALA 116   6.516   2.082   5.778
  934    H    PHE 117           H        PHE 117   6.662   1.293   9.561
  935    HA   PHE 117           HA       PHE 117   4.816   3.399  10.010
  936   1HB   PHE 117          2HB       PHE 117   5.666   0.951  11.495
  937   2HB   PHE 117          1HB       PHE 117   4.737   2.178  12.352
  938    HD1  PHE 117           1HD      PHE 117   2.431   2.231  12.177
  939    HD2  PHE 117           2HD      PHE 117   4.687   0.057   9.299
  940    HE1  PHE 117           1HE      PHE 117   0.349   1.330  11.236
  941    HE2  PHE 117           2HE      PHE 117   2.610  -0.847   8.351
  942    HZ   PHE 117           HZ       PHE 117   0.434  -0.210   9.320
  943    H    GLU 118           H        GLU 118   8.109   2.910  10.914
  944    HA   GLU 118           HA       GLU 118   8.311   4.357  13.270
  945   1HB   GLU 118          2HB       GLU 118  10.287   4.214  10.989
  946   2HB   GLU 118          1HB       GLU 118  10.657   4.787  12.610
  947   1HG   GLU 118          2HG       GLU 118   9.609   2.028  12.055
  948   2HG   GLU 118          1HG       GLU 118  11.327   2.419  12.079
  949    H    GLU 119           H        GLU 119   7.694   5.482  10.058
  950    HA   GLU 119           HA       GLU 119   8.541   8.169  10.434
  951   1HB   GLU 119          2HB       GLU 119   6.537   7.052   8.471
  952   2HB   GLU 119          1HB       GLU 119   7.282   8.642   8.382
  953   1HG   GLU 119          2HG       GLU 119   9.162   6.395   8.539
  954   2HG   GLU 119          1HG       GLU 119   8.176   6.451   7.080
  955    H    TYR 120           H        TYR 120   5.949   6.460  11.696
  956    HA   TYR 120           HA       TYR 120   4.697   8.945  12.580
  957   1HB   TYR 120          2HB       TYR 120   3.503   7.909  10.522
  958   2HB   TYR 120          1HB       TYR 120   2.943   6.685  11.656
  959    HD1  TYR 120           1HD      TYR 120   0.861   7.022  12.579
  960    HD2  TYR 120           2HD      TYR 120   3.176  10.415  11.474
  961    HE1  TYR 120           1HE      TYR 120  -0.984   8.496  13.264
  962    HE2  TYR 120           2HE      TYR 120   1.338  11.900  12.155
  963    HH   TYR 120           HH       TYR 120  -1.711  10.996  12.539
  964    H    SER 121           H        SER 121   6.398   6.921  13.828
  965    HA   SER 121           HA       SER 121   6.576   5.792  15.793
  966   1HB   SER 121          2HB       SER 121   4.315   7.657  16.231
  967   2HB   SER 121          1HB       SER 121   4.458   6.328  17.380
  968    HG   SER 121           HG       SER 121   6.647   7.981  16.690
  Start of MODEL   32
    1   1H    MET   1          1HT       MET   1  -3.588  -0.716  16.047
    2   2H    MET   1          2HT       MET   1  -3.615  -0.562  17.756
    3   3H    MET   1          3HT       MET   1  -2.339  -1.415  16.989
    4    HA   MET   1           HA       MET   1  -2.884   1.459  17.043
    5   1HB   MET   1          2HB       MET   1  -0.656  -0.405  17.814
    6   2HB   MET   1          1HB       MET   1  -0.343   1.306  17.548
    7   1HG   MET   1          2HG       MET   1  -1.517   1.953  19.401
    8   2HG   MET   1          1HG       MET   1  -2.549   0.524  19.382
    9   1HE   MET   1          1HE       MET   1   1.320   1.306  21.476
   10   2HE   MET   1          2HE       MET   1   0.615   2.186  20.119
   11   3HE   MET   1          3HE       MET   1   1.688   0.819  19.820
   12    H    LYS   2           H        LYS   2  -1.561  -1.159  15.147
   13    HA   LYS   2           HA       LYS   2  -0.609   0.784  13.150
   14   1HB   LYS   2          2HB       LYS   2   0.140  -2.134  13.265
   15   2HB   LYS   2          1HB       LYS   2   0.930  -0.848  12.361
   16   1HG   LYS   2          2HG       LYS   2   0.867  -0.351  15.230
   17   2HG   LYS   2          1HG       LYS   2   1.723  -1.831  14.795
   18   1HD   LYS   2          2HD       LYS   2   2.681  -0.091  12.936
   19   2HD   LYS   2          1HD       LYS   2   2.436   0.979  14.318
   20   1HE   LYS   2          2HE       LYS   2   3.694  -0.741  15.691
   21   2HE   LYS   2          1HE       LYS   2   4.136  -1.498  14.162
   22   1HZ   LYS   2          1HZ       LYS   2   5.653   0.306  15.288
   23   2HZ   LYS   2          2HZ       LYS   2   4.629   1.371  14.464
   24   3HZ   LYS   2          3HZ       LYS   2   5.510   0.209  13.606
   25    H    ARG   3           H        ARG   3  -1.409   0.754  11.114
   26    HA   ARG   3           HA       ARG   3  -3.130  -1.448  10.268
   27   1HB   ARG   3          2HB       ARG   3  -4.131   1.357   9.916
   28   2HB   ARG   3          1HB       ARG   3  -5.029  -0.154   9.850
   29   1HG   ARG   3          2HG       ARG   3  -5.711   0.789  11.850
   30   2HG   ARG   3          1HG       ARG   3  -4.465  -0.356  12.351
   31   1HD   ARG   3          2HD       ARG   3  -3.247   1.277  13.240
   32   2HD   ARG   3          1HD       ARG   3  -3.283   2.190  11.733
   33    HE   ARG   3           HE       ARG   3  -4.932   2.602  14.061
   34   1HH1  ARG   3          1HH1      ARG   3  -4.616   3.142  10.626
   35   2HH1  ARG   3          2HH1      ARG   3  -5.675   4.511  10.619
   36   1HH2  ARG   3          1HH2      ARG   3  -6.324   4.402  14.050
   37   2HH2  ARG   3          2HH2      ARG   3  -6.645   5.227  12.561
   38    H    VAL   4           H        VAL   4  -2.701  -1.981   8.210
   39    HA   VAL   4           HA       VAL   4  -1.453   0.071   6.495
   40    HB   VAL   4           HB       VAL   4  -1.015  -2.912   6.284
   41   1HG1  VAL   4          1HG1      VAL   4   1.016  -1.960   4.955
   42   2HG1  VAL   4          2HG1      VAL   4   0.003  -0.525   4.809
   43   3HG1  VAL   4          3HG1      VAL   4  -0.566  -2.071   4.183
   44   1HG2  VAL   4          1HG2      VAL   4   0.855  -0.833   7.420
   45   2HG2  VAL   4          2HG2      VAL   4   1.168  -2.561   7.263
   46   3HG2  VAL   4          3HG2      VAL   4  -0.072  -1.987   8.378
   47    H    LEU   5           H        LEU   5  -2.149   0.235   4.367
   48    HA   LEU   5           HA       LEU   5  -4.718  -1.061   3.830
   49   1HB   LEU   5          2HB       LEU   5  -4.682   1.383   3.768
   50   2HB   LEU   5          1HB       LEU   5  -3.434   1.344   2.538
   51    HG   LEU   5           HG       LEU   5  -5.026   0.220   1.003
   52   1HD1  LEU   5          1HD1      LEU   5  -7.213  -0.226   1.531
   53   2HD1  LEU   5          2HD1      LEU   5  -7.255   0.955   2.839
   54   3HD1  LEU   5          3HD1      LEU   5  -6.421  -0.582   3.065
   55   1HD2  LEU   5          1HD2      LEU   5  -6.090   2.816   2.103
   56   2HD2  LEU   5          2HD2      LEU   5  -6.288   2.189   0.467
   57   3HD2  LEU   5          3HD2      LEU   5  -4.693   2.684   1.035
   58    H    VAL   6           H        VAL   6  -4.931  -2.570   2.324
   59    HA   VAL   6           HA       VAL   6  -2.697  -2.963   0.439
   60    HB   VAL   6           HB       VAL   6  -4.678  -5.050   1.355
   61   1HG1  VAL   6          1HG1      VAL   6  -2.487  -4.985  -0.610
   62   2HG1  VAL   6          2HG1      VAL   6  -3.919  -6.012  -0.536
   63   3HG1  VAL   6          3HG1      VAL   6  -2.511  -6.391   0.454
   64   1HG2  VAL   6          1HG2      VAL   6  -3.163  -5.815   2.932
   65   2HG2  VAL   6          2HG2      VAL   6  -3.016  -4.065   3.085
   66   3HG2  VAL   6          3HG2      VAL   6  -1.804  -4.977   2.185
   67    H    VAL   7           H        VAL   7  -3.405  -1.748  -1.273
   68    HA   VAL   7           HA       VAL   7  -6.094  -2.075  -2.308
   69    HB   VAL   7           HB       VAL   7  -3.748  -0.446  -3.307
   70   1HG1  VAL   7          1HG1      VAL   7  -5.229  -1.077  -5.159
   71   2HG1  VAL   7          2HG1      VAL   7  -5.294   0.653  -4.822
   72   3HG1  VAL   7          3HG1      VAL   7  -6.601  -0.400  -4.281
   73   1HG2  VAL   7          1HG2      VAL   7  -6.296   0.489  -2.005
   74   2HG2  VAL   7          2HG2      VAL   7  -4.877   1.455  -2.409
   75   3HG2  VAL   7          3HG2      VAL   7  -4.779   0.236  -1.139
   76    H    ASP   8           H        ASP   8  -6.606  -3.717  -3.614
   77    HA   ASP   8           HA       ASP   8  -4.909  -4.428  -5.830
   78   1HB   ASP   8          2HB       ASP   8  -3.891  -5.745  -4.010
   79   2HB   ASP   8          1HB       ASP   8  -5.454  -6.484  -3.677
   80    H    ASP   9           H        ASP   9  -5.972  -5.686  -7.402
   81    HA   ASP   9           HA       ASP   9  -8.794  -5.354  -7.458
   82   1HB   ASP   9          2HB       ASP   9  -7.478  -5.241  -9.503
   83   2HB   ASP   9          1HB       ASP   9  -6.968  -6.914  -9.297
   84    H    GLU  10           H        GLU  10  -7.061  -8.418  -8.002
   85    HA   GLU  10           HA       GLU  10  -9.307  -9.925  -7.042
   86   1HB   GLU  10          2HB       GLU  10  -7.631 -10.591  -8.881
   87   2HB   GLU  10          1HB       GLU  10  -6.563 -11.047  -7.559
   88   1HG   GLU  10          2HG       GLU  10  -7.889 -12.808  -6.913
   89   2HG   GLU  10          1HG       GLU  10  -9.344 -12.112  -7.624
   90    H    GLU  11           H        GLU  11  -8.941 -11.720  -5.415
   91    HA   GLU  11           HA       GLU  11  -7.676 -10.550  -3.047
   92   1HB   GLU  11          2HB       GLU  11  -9.037 -12.157  -1.772
   93   2HB   GLU  11          1HB       GLU  11 -10.025 -11.143  -2.815
   94   1HG   GLU  11          2HG       GLU  11  -9.283 -13.506  -4.234
   95   2HG   GLU  11          1HG       GLU  11  -9.956 -13.951  -2.667
   96    H    SER  12           H        SER  12  -5.863 -11.569  -4.831
   97    HA   SER  12           HA       SER  12  -5.187 -14.283  -4.112
   98   1HB   SER  12          2HB       SER  12  -3.099 -13.743  -5.500
   99   2HB   SER  12          1HB       SER  12  -4.647 -13.714  -6.346
  100    HG   SER  12           HG       SER  12  -4.459 -11.627  -6.632
  101    H    ILE  13           H        ILE  13  -3.910 -11.040  -3.486
  102    HA   ILE  13           HA       ILE  13  -1.886 -12.109  -1.687
  103    HB   ILE  13           HB       ILE  13  -2.505  -9.232  -2.371
  104   1HG1  ILE  13          2HG1      ILE  13  -1.812 -10.518  -4.347
  105   2HG1  ILE  13          1HG1      ILE  13  -0.571  -9.364  -3.872
  106   1HG2  ILE  13          1HG2      ILE  13  -0.382 -10.558  -0.745
  107   2HG2  ILE  13          2HG2      ILE  13  -1.319  -9.105  -0.399
  108   3HG2  ILE  13          3HG2      ILE  13  -0.026  -9.056  -1.598
  109   1HD1  ILE  13          1HD1      ILE  13  -0.573 -12.334  -3.419
  110   2HD1  ILE  13          2HD1      ILE  13   0.607 -11.229  -2.713
  111   3HD1  ILE  13          3HD1      ILE  13   0.498 -11.401  -4.464
  112    H    THR  14           H        THR  14  -4.802 -10.118  -1.568
  113    HA   THR  14           HA       THR  14  -4.745  -9.392   1.117
  114    HB   THR  14           HB       THR  14  -7.060  -8.887   0.907
  115    HG1  THR  14           1HG      THR  14  -7.046 -10.807  -1.164
  116   1HG2  THR  14          1HG2      THR  14  -5.488  -7.644  -0.651
  117   2HG2  THR  14          2HG2      THR  14  -7.209  -7.599  -1.036
  118   3HG2  THR  14          3HG2      THR  14  -6.132  -8.671  -1.932
  119    H    SER  15           H        SER  15  -5.332 -12.473  -0.304
  120    HA   SER  15           HA       SER  15  -6.816 -13.571   1.890
  121   1HB   SER  15          2HB       SER  15  -6.580 -14.351  -0.651
  122   2HB   SER  15          1HB       SER  15  -5.300 -15.349   0.041
  123    HG   SER  15           HG       SER  15  -8.063 -15.371   0.575
  124    H    SER  16           H        SER  16  -3.446 -13.277   1.033
  125    HA   SER  16           HA       SER  16  -2.712 -14.879   3.391
  126   1HB   SER  16          2HB       SER  16  -0.699 -14.045   1.340
  127   2HB   SER  16          1HB       SER  16  -0.740 -15.493   2.346
  128    HG   SER  16           HG       SER  16  -2.502 -16.219   1.047
  129    H    LEU  17           H        LEU  17  -1.443 -12.072   1.587
  130    HA   LEU  17           HA       LEU  17   0.210 -10.966   3.440
  131   1HB   LEU  17          2HB       LEU  17  -0.088 -10.071   1.194
  132   2HB   LEU  17          1HB       LEU  17  -1.699  -9.518   1.601
  133    HG   LEU  17           HG       LEU  17   0.307  -7.844   1.530
  134   1HD1  LEU  17          1HD1      LEU  17  -0.826  -6.428   3.137
  135   2HD1  LEU  17          2HD1      LEU  17  -1.685  -7.824   3.787
  136   3HD1  LEU  17          3HD1      LEU  17  -1.993  -7.291   2.137
  137   1HD2  LEU  17          1HD2      LEU  17   1.415  -7.503   3.639
  138   2HD2  LEU  17          2HD2      LEU  17   1.712  -9.151   3.087
  139   3HD2  LEU  17          3HD2      LEU  17   0.534  -8.848   4.362
  140    H    SER  18           H        SER  18  -3.294 -10.332   3.215
  141    HA   SER  18           HA       SER  18  -3.524  -8.585   5.361
  142   1HB   SER  18          2HB       SER  18  -5.566 -10.680   4.588
  143   2HB   SER  18          1HB       SER  18  -5.872  -9.151   5.411
  144    HG   SER  18           HG       SER  18  -5.752  -8.123   3.563
  145    H    ALA  19           H        ALA  19  -3.461 -12.109   5.308
  146    HA   ALA  19           HA       ALA  19  -4.070 -12.491   8.050
  147   1HB   ALA  19          1HB       ALA  19  -4.114 -14.183   6.088
  148   2HB   ALA  19          2HB       ALA  19  -3.645 -14.743   7.694
  149   3HB   ALA  19          3HB       ALA  19  -2.410 -14.421   6.477
  150    H    ILE  20           H        ILE  20  -1.044 -12.177   6.251
  151    HA   ILE  20           HA       ILE  20   0.753 -12.798   8.287
  152    HB   ILE  20           HB       ILE  20   0.955 -11.049   5.858
  153   1HG1  ILE  20          2HG1      ILE  20   2.931 -13.082   6.047
  154   2HG1  ILE  20          1HG1      ILE  20   1.372 -13.786   6.462
  155   1HG2  ILE  20          1HG2      ILE  20   3.512 -11.121   6.483
  156   2HG2  ILE  20          2HG2      ILE  20   2.872 -11.190   8.125
  157   3HG2  ILE  20          3HG2      ILE  20   2.462  -9.833   7.076
  158   1HD1  ILE  20          1HD1      ILE  20   1.921 -12.206   3.965
  159   2HD1  ILE  20          2HD1      ILE  20   0.441 -13.072   4.371
  160   3HD1  ILE  20          3HD1      ILE  20   1.930 -13.966   4.071
  161    H    LEU  21           H        LEU  21  -0.127  -9.499   7.227
  162    HA   LEU  21           HA       LEU  21   1.021  -8.096   9.302
  163   1HB   LEU  21          2HB       LEU  21  -1.541  -7.516   7.827
  164   2HB   LEU  21          1HB       LEU  21  -0.689  -6.359   8.832
  165    HG   LEU  21           HG       LEU  21   1.066  -7.533   6.847
  166   1HD1  LEU  21          1HD1      LEU  21  -1.107  -7.681   5.639
  167   2HD1  LEU  21          2HD1      LEU  21   0.091  -6.636   4.874
  168   3HD1  LEU  21          3HD1      LEU  21  -1.244  -5.929   5.784
  169   1HD2  LEU  21          1HD2      LEU  21   1.212  -5.386   8.300
  170   2HD2  LEU  21          2HD2      LEU  21   0.262  -4.663   7.003
  171   3HD2  LEU  21          3HD2      LEU  21   1.839  -5.372   6.652
  172    H    GLU  22           H        GLU  22  -2.042  -9.801   9.198
  173    HA   GLU  22           HA       GLU  22  -3.073  -8.832  11.650
  174   1HB   GLU  22          2HB       GLU  22  -4.205 -10.138   9.670
  175   2HB   GLU  22          1HB       GLU  22  -3.774 -11.542  10.635
  176   1HG   GLU  22          2HG       GLU  22  -4.942  -9.746  12.420
  177   2HG   GLU  22          1HG       GLU  22  -5.937  -9.684  10.966
  178    H    GLU  23           H        GLU  23  -0.724 -11.248  10.852
  179    HA   GLU  23           HA       GLU  23  -0.906 -12.617  13.380
  180   1HB   GLU  23          2HB       GLU  23  -0.239 -13.973  11.560
  181   2HB   GLU  23          1HB       GLU  23   0.948 -12.798  11.013
  182   1HG   GLU  23          2HG       GLU  23   2.537 -13.623  12.329
  183   2HG   GLU  23          1HG       GLU  23   1.451 -13.756  13.711
  184    H    GLU  24           H        GLU  24   1.137 -10.174  11.870
  185    HA   GLU  24           HA       GLU  24   3.076 -10.090  13.936
  186   1HB   GLU  24          2HB       GLU  24   2.888  -9.019  11.433
  187   2HB   GLU  24          1HB       GLU  24   2.674  -7.603  12.451
  188   1HG   GLU  24          2HG       GLU  24   4.937  -9.504  12.907
  189   2HG   GLU  24          1HG       GLU  24   5.041  -8.232  11.693
  190    H    GLY  25           H        GLY  25   0.267  -8.056  13.195
  191   1HA   GLY  25          2HA       GLY  25  -0.997  -7.560  15.371
  192   2HA   GLY  25          1HA       GLY  25   0.525  -6.821  15.840
  193    H    TYR  26           H        TYR  26  -1.170  -6.767  12.732
  194    HA   TYR  26           HA       TYR  26  -1.223  -3.827  12.914
  195   1HB   TYR  26          2HB       TYR  26  -1.047  -5.616  10.485
  196   2HB   TYR  26          1HB       TYR  26  -1.217  -3.868  10.419
  197    HD1  TYR  26           1HD      TYR  26   0.633  -2.418  11.189
  198    HD2  TYR  26           2HD      TYR  26   1.059  -6.641  10.946
  199    HE1  TYR  26           1HE      TYR  26   3.075  -2.171  11.289
  200    HE2  TYR  26           2HE      TYR  26   3.503  -6.409  11.045
  201    HH   TYR  26           HH       TYR  26   5.035  -3.458  11.868
  202    H    HIS  27           H        HIS  27  -2.887  -3.200  10.891
  203    HA   HIS  27           HA       HIS  27  -5.397  -4.634  11.327
  204   1HB   HIS  27          2HB       HIS  27  -4.927  -2.388  12.755
  205   2HB   HIS  27          1HB       HIS  27  -5.598  -1.675  11.293
  206    HD1  HIS  27           1HD      HIS  27  -7.718  -0.933  12.602
  207    HD2  HIS  27           2HD      HIS  27  -7.115  -5.044  12.493
  208    HE1  HIS  27           1HE      HIS  27  -9.884  -1.951  13.374
  209    HE2  HIS  27           2HE      HIS  27  -9.526  -4.440  13.211
  210    HA   PRO  28           HA       PRO  28  -4.404  -3.651   6.857
  211   1HB   PRO  28          2HB       PRO  28  -5.753  -6.279   6.609
  212   2HB   PRO  28          1HB       PRO  28  -4.275  -5.694   5.839
  213   1HG   PRO  28          2HG       PRO  28  -4.165  -7.462   7.830
  214   2HG   PRO  28          1HG       PRO  28  -2.964  -6.164   7.691
  215   1HD   PRO  28          2HD       PRO  28  -5.317  -6.381   9.525
  216   2HD   PRO  28          1HD       PRO  28  -3.691  -5.746   9.848
  217    H    ASP  29           H        ASP  29  -5.799  -2.633   5.546
  218    HA   ASP  29           HA       ASP  29  -8.646  -2.967   6.114
  219   1HB   ASP  29          2HB       ASP  29  -7.527  -0.704   6.593
  220   2HB   ASP  29          1HB       ASP  29  -7.560  -0.496   4.844
  221    H    THR  30           H        THR  30  -6.356  -3.408   3.826
  222    HA   THR  30           HA       THR  30  -6.329  -3.828   1.590
  223    HB   THR  30           HB       THR  30  -7.968  -5.487   0.883
  224    HG1  THR  30           1HG      THR  30  -9.849  -4.719   1.762
  225   1HG2  THR  30          1HG2      THR  30  -6.492  -6.721   2.055
  226   2HG2  THR  30          2HG2      THR  30  -7.879  -6.928   3.124
  227   3HG2  THR  30          3HG2      THR  30  -6.642  -5.730   3.506
  228    H    ALA  31           H        ALA  31  -7.777  -3.925  -0.472
  229    HA   ALA  31           HA       ALA  31  -9.895  -2.001  -0.628
  230   1HB   ALA  31          1HB       ALA  31  -8.804  -0.190  -1.332
  231   2HB   ALA  31          2HB       ALA  31  -7.845  -1.126  -2.479
  232   3HB   ALA  31          3HB       ALA  31  -7.320  -0.983  -0.801
  233    H    LYS  32           H        LYS  32  -9.778  -1.454  -3.352
  234    HA   LYS  32           HA       LYS  32  -9.783  -4.143  -4.554
  235   1HB   LYS  32          2HB       LYS  32 -11.721  -2.003  -5.392
  236   2HB   LYS  32          1HB       LYS  32 -11.811  -3.736  -5.670
  237   1HG   LYS  32          2HG       LYS  32 -12.279  -4.118  -3.323
  238   2HG   LYS  32          1HG       LYS  32 -12.114  -2.392  -2.994
  239   1HD   LYS  32          2HD       LYS  32 -13.959  -2.189  -4.854
  240   2HD   LYS  32          1HD       LYS  32 -14.294  -3.861  -4.402
  241   1HE   LYS  32          2HE       LYS  32 -13.978  -2.185  -2.069
  242   2HE   LYS  32          1HE       LYS  32 -15.227  -1.557  -3.142
  243   1HZ   LYS  32          1HZ       LYS  32 -15.846  -4.141  -3.125
  244   2HZ   LYS  32          2HZ       LYS  32 -16.492  -3.026  -2.031
  245   3HZ   LYS  32          3HZ       LYS  32 -15.187  -3.999  -1.573
  246    H    THR  33           H        THR  33  -9.316  -0.699  -5.017
  247    HA   THR  33           HA       THR  33  -7.338  -1.129  -7.017
  248    HB   THR  33           HB       THR  33  -8.863   0.516  -8.564
  249    HG1  THR  33           1HG      THR  33 -10.920   0.097  -8.359
  250   1HG2  THR  33          1HG2      THR  33  -8.133  -2.286  -8.641
  251   2HG2  THR  33          2HG2      THR  33  -8.186  -1.088  -9.936
  252   3HG2  THR  33          3HG2      THR  33  -9.651  -1.956  -9.475
  253    H    LEU  34           H        LEU  34  -6.800   1.158  -8.050
  254    HA   LEU  34           HA       LEU  34  -6.043   2.816  -5.919
  255   1HB   LEU  34          2HB       LEU  34  -6.077   3.145  -8.895
  256   2HB   LEU  34          1HB       LEU  34  -5.664   4.506  -7.868
  257    HG   LEU  34           HG       LEU  34  -4.228   1.852  -7.859
  258   1HD1  LEU  34          1HD1      LEU  34  -2.929   2.564  -9.511
  259   2HD1  LEU  34          2HD1      LEU  34  -2.685   4.127  -8.732
  260   3HD1  LEU  34          3HD1      LEU  34  -4.085   3.869  -9.771
  261   1HD2  LEU  34          1HD2      LEU  34  -3.543   2.565  -5.857
  262   2HD2  LEU  34          2HD2      LEU  34  -4.179   4.188  -6.117
  263   3HD2  LEU  34          3HD2      LEU  34  -2.589   3.753  -6.744
  264    H    ARG  35           H        ARG  35  -8.792   2.932  -8.110
  265    HA   ARG  35           HA       ARG  35  -9.725   5.492  -7.314
  266   1HB   ARG  35          2HB       ARG  35 -10.418   4.236  -9.395
  267   2HB   ARG  35          1HB       ARG  35 -11.396   3.202  -8.363
  268   1HG   ARG  35          2HG       ARG  35 -12.165   5.752  -7.638
  269   2HG   ARG  35          1HG       ARG  35 -11.938   5.860  -9.384
  270   1HD   ARG  35          2HD       ARG  35 -13.472   4.073  -9.769
  271   2HD   ARG  35          1HD       ARG  35 -13.553   3.700  -8.047
  272    HE   ARG  35           HE       ARG  35 -15.073   5.657  -9.440
  273   1HH1  ARG  35          1HH1      ARG  35 -13.549   4.995  -6.370
  274   2HH1  ARG  35          2HH1      ARG  35 -14.629   6.011  -5.474
  275   1HH2  ARG  35          1HH2      ARG  35 -16.493   6.993  -8.262
  276   2HH2  ARG  35          2HH2      ARG  35 -16.300   7.144  -6.547
  277    H    GLU  36           H        GLU  36 -10.558   2.186  -6.342
  278    HA   GLU  36           HA       GLU  36 -12.466   2.913  -4.386
  279   1HB   GLU  36          2HB       GLU  36 -12.041   0.611  -5.487
  280   2HB   GLU  36          1HB       GLU  36 -10.801   0.409  -4.256
  281   1HG   GLU  36          2HG       GLU  36 -13.556   1.180  -3.432
  282   2HG   GLU  36          1HG       GLU  36 -13.219  -0.492  -3.879
  283    H    ALA  37           H        ALA  37  -8.982   2.598  -4.366
  284    HA   ALA  37           HA       ALA  37  -8.656   2.595  -1.541
  285   1HB   ALA  37          1HB       ALA  37  -6.562   3.666  -3.386
  286   2HB   ALA  37          2HB       ALA  37  -6.974   1.952  -3.430
  287   3HB   ALA  37          3HB       ALA  37  -6.382   2.679  -1.937
  288    H    GLU  38           H        GLU  38  -7.862   5.161  -3.891
  289    HA   GLU  38           HA       GLU  38  -7.404   7.252  -2.253
  290   1HB   GLU  38          2HB       GLU  38  -7.711   7.016  -4.905
  291   2HB   GLU  38          1HB       GLU  38  -9.192   7.880  -4.520
  292   1HG   GLU  38          2HG       GLU  38  -7.193   9.224  -3.131
  293   2HG   GLU  38          1HG       GLU  38  -6.487   8.847  -4.701
  294    H    LYS  39           H        LYS  39 -10.576   6.027  -3.180
  295    HA   LYS  39           HA       LYS  39 -12.090   8.031  -1.881
  296   1HB   LYS  39          2HB       LYS  39 -13.086   6.554  -3.549
  297   2HB   LYS  39          1HB       LYS  39 -12.794   5.158  -2.520
  298   1HG   LYS  39          2HG       LYS  39 -14.465   7.421  -1.518
  299   2HG   LYS  39          1HG       LYS  39 -15.156   6.227  -2.620
  300   1HD   LYS  39          2HD       LYS  39 -14.042   4.541  -0.908
  301   2HD   LYS  39          1HD       LYS  39 -14.220   5.914   0.187
  302   1HE   LYS  39          2HE       LYS  39 -16.630   6.025  -0.497
  303   2HE   LYS  39          1HE       LYS  39 -16.388   4.508  -1.363
  304   1HZ   LYS  39          1HZ       LYS  39 -16.293   5.002   1.547
  305   2HZ   LYS  39          2HZ       LYS  39 -15.549   3.642   0.871
  306   3HZ   LYS  39          3HZ       LYS  39 -17.216   3.869   0.695
  307    H    LYS  40           H        LYS  40 -11.060   4.790  -0.871
  308    HA   LYS  40           HA       LYS  40 -12.157   4.959   1.737
  309   1HB   LYS  40          2HB       LYS  40 -10.265   3.133   0.346
  310   2HB   LYS  40          1HB       LYS  40 -10.363   3.065   2.099
  311   1HG   LYS  40          2HG       LYS  40 -12.957   3.042   0.742
  312   2HG   LYS  40          1HG       LYS  40 -11.930   1.649   0.393
  313   1HD   LYS  40          2HD       LYS  40 -11.826   1.019   2.649
  314   2HD   LYS  40          1HD       LYS  40 -12.387   2.597   3.205
  315   1HE   LYS  40          2HE       LYS  40 -14.311   1.395   3.455
  316   2HE   LYS  40          1HE       LYS  40 -14.519   1.946   1.794
  317   1HZ   LYS  40          1HZ       LYS  40 -14.750  -0.590   2.523
  318   2HZ   LYS  40          2HZ       LYS  40 -13.100  -0.568   2.144
  319   3HZ   LYS  40          3HZ       LYS  40 -14.242  -0.122   0.979
  320    H    ILE  41           H        ILE  41  -9.166   6.061   0.342
  321    HA   ILE  41           HA       ILE  41  -7.942   6.439   2.963
  322    HB   ILE  41           HB       ILE  41  -6.843   7.204   0.263
  323   1HG1  ILE  41          2HG1      ILE  41  -5.840   4.819   1.727
  324   2HG1  ILE  41          1HG1      ILE  41  -7.398   4.665   0.921
  325   1HG2  ILE  41          1HG2      ILE  41  -5.845   7.345   3.029
  326   2HG2  ILE  41          2HG2      ILE  41  -5.439   8.329   1.622
  327   3HG2  ILE  41          3HG2      ILE  41  -4.702   6.740   1.830
  328   1HD1  ILE  41          1HD1      ILE  41  -5.664   3.894  -0.538
  329   2HD1  ILE  41          2HD1      ILE  41  -4.773   5.404  -0.346
  330   3HD1  ILE  41          3HD1      ILE  41  -6.326   5.397  -1.182
  331    H    LYS  42           H        LYS  42  -9.738   8.215   0.627
  332    HA   LYS  42           HA       LYS  42  -8.894  10.797   0.861
  333   1HB   LYS  42          2HB       LYS  42 -10.870   9.793  -0.456
  334   2HB   LYS  42          1HB       LYS  42 -11.817  10.151   0.981
  335   1HG   LYS  42          2HG       LYS  42 -10.638  12.526   0.635
  336   2HG   LYS  42          1HG       LYS  42 -10.670  11.966  -1.038
  337   1HD   LYS  42          2HD       LYS  42 -13.181  11.503   0.370
  338   2HD   LYS  42          1HD       LYS  42 -12.738  13.209   0.293
  339   1HE   LYS  42          2HE       LYS  42 -12.481  13.036  -2.131
  340   2HE   LYS  42          1HE       LYS  42 -12.909  11.326  -2.058
  341   1HZ   LYS  42          1HZ       LYS  42 -15.026  12.282  -0.886
  342   2HZ   LYS  42          2HZ       LYS  42 -14.914  12.249  -2.574
  343   3HZ   LYS  42          3HZ       LYS  42 -14.616  13.687  -1.735
  344    H    GLU  43           H        GLU  43 -10.466   8.879   3.297
  345    HA   GLU  43           HA       GLU  43 -10.485  11.220   5.075
  346   1HB   GLU  43          2HB       GLU  43 -12.294   8.805   5.217
  347   2HB   GLU  43          1HB       GLU  43 -12.335  10.192   6.295
  348   1HG   GLU  43          2HG       GLU  43 -13.534  11.413   4.869
  349   2HG   GLU  43          1HG       GLU  43 -12.572  10.908   3.480
  350    H    LEU  44           H        LEU  44 -10.218   7.670   5.053
  351    HA   LEU  44           HA       LEU  44  -9.227   7.363   7.641
  352   1HB   LEU  44          2HB       LEU  44  -9.759   5.710   5.454
  353   2HB   LEU  44          1HB       LEU  44  -8.058   5.460   5.794
  354    HG   LEU  44           HG       LEU  44  -9.383   3.812   6.968
  355   1HD1  LEU  44          1HD1      LEU  44  -7.420   4.390   8.132
  356   2HD1  LEU  44          2HD1      LEU  44  -8.706   4.386   9.339
  357   3HD1  LEU  44          3HD1      LEU  44  -8.107   5.914   8.693
  358   1HD2  LEU  44          1HD2      LEU  44 -11.148   4.279   8.398
  359   2HD2  LEU  44          2HD2      LEU  44 -11.398   5.425   7.080
  360   3HD2  LEU  44          3HD2      LEU  44 -10.674   5.965   8.595
  361    H    PHE  45           H        PHE  45  -7.326   7.756   8.574
  362    HA   PHE  45           HA       PHE  45  -5.194   8.919   6.991
  363   1HB   PHE  45          2HB       PHE  45  -6.001   9.774   9.273
  364   2HB   PHE  45          1HB       PHE  45  -5.128   8.410   9.961
  365    HD1  PHE  45           1HD      PHE  45  -4.515  11.124   7.469
  366    HD2  PHE  45           2HD      PHE  45  -3.024   8.849  10.741
  367    HE1  PHE  45           1HE      PHE  45  -2.440  12.447   7.439
  368    HE2  PHE  45           2HE      PHE  45  -0.947  10.166  10.717
  369    HZ   PHE  45           HZ       PHE  45  -0.652  11.968   9.063
  370    H    PHE  46           H        PHE  46  -4.971   6.743   5.896
  371    HA   PHE  46           HA       PHE  46  -3.874   4.532   7.255
  372   1HB   PHE  46          2HB       PHE  46  -4.015   5.377   4.386
  373   2HB   PHE  46          1HB       PHE  46  -3.022   3.995   4.837
  374    HD1  PHE  46           1HD      PHE  46  -6.130   4.919   3.668
  375    HD2  PHE  46           2HD      PHE  46  -4.321   2.319   6.509
  376    HE1  PHE  46           1HE      PHE  46  -8.123   3.478   3.609
  377    HE2  PHE  46           2HE      PHE  46  -6.311   0.873   6.456
  378    HZ   PHE  46           HZ       PHE  46  -8.215   1.453   5.005
  379    HA   PRO  47           HA       PRO  47   0.255   6.211   7.777
  380   1HB   PRO  47          2HB       PRO  47   1.293   4.161   9.168
  381   2HB   PRO  47          1HB       PRO  47   0.129   5.277   9.892
  382   1HG   PRO  47          2HG       PRO  47  -0.317   2.538   8.772
  383   2HG   PRO  47          1HG       PRO  47  -0.962   3.256  10.260
  384   1HD   PRO  47          2HD       PRO  47  -2.379   3.081   7.926
  385   2HD   PRO  47          1HD       PRO  47  -2.654   4.333   9.150
  386    H    VAL  48           H        VAL  48  -0.506   3.056   6.453
  387    HA   VAL  48           HA       VAL  48   1.817   3.256   4.683
  388    HB   VAL  48           HB       VAL  48   1.052   0.656   5.992
  389   1HG1  VAL  48          1HG1      VAL  48   2.557   1.116   3.785
  390   2HG1  VAL  48          2HG1      VAL  48   2.757  -0.270   4.858
  391   3HG1  VAL  48          3HG1      VAL  48   3.788   1.148   5.047
  392   1HG2  VAL  48          1HG2      VAL  48   1.747   1.756   7.857
  393   2HG2  VAL  48          2HG2      VAL  48   2.788   2.858   6.956
  394   3HG2  VAL  48          3HG2      VAL  48   3.302   1.195   7.242
  395    H    ILE  49           H        ILE  49   1.234   2.956   2.634
  396    HA   ILE  49           HA       ILE  49  -1.295   1.563   2.064
  397    HB   ILE  49           HB       ILE  49   0.111   3.447   0.180
  398   1HG1  ILE  49          2HG1      ILE  49  -0.389   4.640   2.289
  399   2HG1  ILE  49          1HG1      ILE  49  -1.368   5.227   0.947
  400   1HG2  ILE  49          1HG2      ILE  49  -2.448   1.981   0.235
  401   2HG2  ILE  49          2HG2      ILE  49  -1.434   2.450  -1.130
  402   3HG2  ILE  49          3HG2      ILE  49  -2.508   3.632  -0.382
  403   1HD1  ILE  49          1HD1      ILE  49  -2.268   3.338   3.108
  404   2HD1  ILE  49          2HD1      ILE  49  -3.252   3.891   1.752
  405   3HD1  ILE  49          3HD1      ILE  49  -2.689   5.044   2.962
  406    H    VAL  50           H        VAL  50  -1.377   0.077   0.323
  407    HA   VAL  50           HA       VAL  50   1.175  -0.667  -0.896
  408    HB   VAL  50           HB       VAL  50  -0.603  -2.628   0.558
  409   1HG1  VAL  50          1HG1      VAL  50   1.860  -3.785  -0.236
  410   2HG1  VAL  50          2HG1      VAL  50   1.147  -3.024  -1.657
  411   3HG1  VAL  50          3HG1      VAL  50   0.230  -4.224  -0.747
  412   1HG2  VAL  50          1HG2      VAL  50   1.217  -2.929   2.066
  413   2HG2  VAL  50          2HG2      VAL  50   0.908  -1.197   1.946
  414   3HG2  VAL  50          3HG2      VAL  50   2.272  -1.910   1.086
  415    H    LEU  51           H        LEU  51   0.542  -0.081  -2.899
  416    HA   LEU  51           HA       LEU  51  -1.999  -0.961  -3.975
  417   1HB   LEU  51          2HB       LEU  51  -1.280   1.222  -4.630
  418   2HB   LEU  51          1HB       LEU  51   0.278   0.619  -5.155
  419    HG   LEU  51           HG       LEU  51  -0.734  -0.516  -7.039
  420   1HD1  LEU  51          1HD1      LEU  51  -3.040  -0.584  -7.478
  421   2HD1  LEU  51          2HD1      LEU  51  -3.397   0.609  -6.229
  422   3HD1  LEU  51          3HD1      LEU  51  -2.878  -1.015  -5.775
  423   1HD2  LEU  51          1HD2      LEU  51  -1.187   2.370  -6.593
  424   2HD2  LEU  51          2HD2      LEU  51  -1.997   1.641  -7.981
  425   3HD2  LEU  51          3HD2      LEU  51  -0.242   1.544  -7.833
  426    H    ASP  52           H        ASP  52  -1.561  -3.239  -3.718
  427    HA   ASP  52           HA       ASP  52   0.510  -4.513  -5.213
  428   1HB   ASP  52          2HB       ASP  52  -0.890  -5.338  -3.124
  429   2HB   ASP  52          1HB       ASP  52  -1.943  -5.994  -4.374
  430    H    VAL  53           H        VAL  53   0.202  -3.620  -7.318
  431    HA   VAL  53           HA       VAL  53  -2.186  -3.849  -8.793
  432    HB   VAL  53           HB       VAL  53  -0.951  -3.212 -10.707
  433   1HG1  VAL  53          1HG1      VAL  53   0.274  -1.305  -9.988
  434   2HG1  VAL  53          2HG1      VAL  53   0.613  -2.039  -8.422
  435   3HG1  VAL  53          3HG1      VAL  53  -1.033  -1.559  -8.831
  436   1HG2  VAL  53          1HG2      VAL  53   0.799  -4.645 -11.042
  437   2HG2  VAL  53          2HG2      VAL  53   1.323  -4.575  -9.360
  438   3HG2  VAL  53          3HG2      VAL  53   1.677  -3.234 -10.450
  439    H    TRP  54           H        TRP  54  -3.182  -5.722  -9.184
  440    HA   TRP  54           HA       TRP  54  -1.538  -8.067  -9.866
  441   1HB   TRP  54          2HB       TRP  54  -2.959  -8.389  -7.900
  442   2HB   TRP  54          1HB       TRP  54  -4.383  -7.939  -8.831
  443    HD1  TRP  54           HD       TRP  54  -5.754 -10.052  -9.274
  444    HE1  TRP  54           1HE      TRP  54  -5.243 -12.478  -9.967
  445    HE3  TRP  54           3HE      TRP  54  -0.654  -9.809  -9.356
  446    HZ2  TRP  54           2HZ      TRP  54  -2.972 -14.078 -10.480
  447    HZ3  TRP  54           3HZ      TRP  54   0.618 -11.830  -9.958
  448    HH2  TRP  54           HH       TRP  54  -0.521 -13.920 -10.508
  449    H    MET  55           H        MET  55  -4.960  -7.531 -10.553
  450    HA   MET  55           HA       MET  55  -4.660  -8.437 -13.239
  451   1HB   MET  55          2HB       MET  55  -6.769  -8.160 -11.427
  452   2HB   MET  55          1HB       MET  55  -7.155  -7.047 -12.732
  453   1HG   MET  55          2HG       MET  55  -6.249  -9.597 -13.745
  454   2HG   MET  55          1HG       MET  55  -7.627  -9.778 -12.662
  455   1HE   MET  55          1HE       MET  55  -9.014 -10.776 -14.266
  456   2HE   MET  55          2HE       MET  55  -8.236 -10.617 -15.840
  457   3HE   MET  55          3HE       MET  55  -9.861  -9.978 -15.591
  458    HA   PRO  56           HA       PRO  56  -5.447  -3.790 -14.275
  459   1HB   PRO  56          2HB       PRO  56  -4.997  -1.945 -12.374
  460   2HB   PRO  56          1HB       PRO  56  -6.548  -2.783 -12.506
  461   1HG   PRO  56          2HG       PRO  56  -4.251  -3.331 -10.659
  462   2HG   PRO  56          1HG       PRO  56  -5.986  -3.265 -10.294
  463   1HD   PRO  56          2HD       PRO  56  -4.639  -5.589 -10.683
  464   2HD   PRO  56          1HD       PRO  56  -6.358  -5.395 -11.075
  465    H    ASP  57           H        ASP  57  -3.925  -1.608 -14.012
  466    HA   ASP  57           HA       ASP  57  -1.205  -2.645 -14.387
  467   1HB   ASP  57          2HB       ASP  57  -2.368  -0.007 -15.304
  468   2HB   ASP  57          1HB       ASP  57  -0.787  -0.657 -15.727
  469    H    GLY  58           H        GLY  58  -3.091  -0.283 -12.604
  470   1HA   GLY  58          2HA       GLY  58  -2.579   1.001 -10.774
  471   2HA   GLY  58          1HA       GLY  58  -1.282  -0.145 -10.467
  472    H    ASP  59           H        ASP  59  -1.866   2.210 -13.072
  473    HA   ASP  59           HA       ASP  59   0.883   3.153 -12.749
  474   1HB   ASP  59          2HB       ASP  59  -0.280   2.478 -15.006
  475   2HB   ASP  59          1HB       ASP  59  -0.943   4.108 -14.923
  476    H    GLY  60           H        GLY  60  -1.153   3.870 -10.813
  477   1HA   GLY  60          2HA       GLY  60  -2.024   6.547 -11.319
  478   2HA   GLY  60          1HA       GLY  60  -2.071   5.712  -9.774
  479    H    VAL  61           H        VAL  61   0.368   7.033 -12.020
  480    HA   VAL  61           HA       VAL  61   2.431   7.399 -10.241
  481    HB   VAL  61           HB       VAL  61   1.747   9.313 -12.471
  482   1HG1  VAL  61          1HG1      VAL  61   4.314   8.557 -11.102
  483   2HG1  VAL  61          2HG1      VAL  61   3.531  10.137 -11.138
  484   3HG1  VAL  61          3HG1      VAL  61   4.239   9.471 -12.609
  485   1HG2  VAL  61          1HG2      VAL  61   2.938   6.563 -12.534
  486   2HG2  VAL  61          2HG2      VAL  61   3.332   7.754 -13.773
  487   3HG2  VAL  61          3HG2      VAL  61   1.660   7.244 -13.540
  488    H    ASN  62           H        ASN  62  -0.236   9.622 -10.978
  489    HA   ASN  62           HA       ASN  62   0.634  11.684  -9.267
  490   1HB   ASN  62          2HB       ASN  62  -1.672  12.523  -9.661
  491   2HB   ASN  62          1HB       ASN  62  -0.802  12.153 -11.135
  492   1HD2  ASN  62          1HD2      ASN  62  -3.688  11.870  -9.608
  493   2HD2  ASN  62          2HD2      ASN  62  -4.337  10.515 -10.462
  494    H    PHE  63           H        PHE  63  -1.175   8.757  -8.782
  495    HA   PHE  63           HA       PHE  63  -2.683   9.403  -6.539
  496   1HB   PHE  63          2HB       PHE  63  -2.884   7.265  -7.765
  497   2HB   PHE  63          1HB       PHE  63  -1.329   6.758  -7.110
  498    HD1  PHE  63           1HD      PHE  63  -4.594   8.081  -5.892
  499    HD2  PHE  63           2HD      PHE  63  -1.359   5.388  -5.265
  500    HE1  PHE  63           1HE      PHE  63  -5.725   7.195  -3.897
  501    HE2  PHE  63           2HE      PHE  63  -2.485   4.498  -3.266
  502    HZ   PHE  63           HZ       PHE  63  -4.672   5.404  -2.581
  503    H    ILE  64           H        ILE  64   0.662   8.216  -6.707
  504    HA   ILE  64           HA       ILE  64   1.242   7.867  -4.058
  505    HB   ILE  64           HB       ILE  64   3.041   9.111  -6.143
  506   1HG1  ILE  64          2HG1      ILE  64   3.839   6.495  -5.652
  507   2HG1  ILE  64          1HG1      ILE  64   2.081   6.401  -5.643
  508   1HG2  ILE  64          1HG2      ILE  64   4.726   7.845  -4.469
  509   2HG2  ILE  64          2HG2      ILE  64   3.491   8.370  -3.323
  510   3HG2  ILE  64          3HG2      ILE  64   4.318   9.555  -4.334
  511   1HD1  ILE  64          1HD1      ILE  64   3.833   7.430  -7.856
  512   2HD1  ILE  64          2HD1      ILE  64   2.073   7.533  -7.850
  513   3HD1  ILE  64          3HD1      ILE  64   2.863   5.958  -7.849
  514    H    ASP  65           H        ASP  65   0.736  10.876  -5.741
  515    HA   ASP  65           HA       ASP  65   1.827  12.531  -3.669
  516   1HB   ASP  65          2HB       ASP  65   0.768  12.903  -6.321
  517   2HB   ASP  65          1HB       ASP  65   0.007  14.044  -5.216
  518    H    PHE  66           H        PHE  66  -1.367  11.342  -4.555
  519    HA   PHE  66           HA       PHE  66  -2.927  12.921  -2.869
  520   1HB   PHE  66          2HB       PHE  66  -4.226  11.653  -4.296
  521   2HB   PHE  66          1HB       PHE  66  -3.235  10.214  -4.094
  522    HD1  PHE  66           1HD      PHE  66  -3.887   8.518  -2.635
  523    HD2  PHE  66           2HD      PHE  66  -5.738  12.339  -2.369
  524    HE1  PHE  66           1HE      PHE  66  -5.520   7.610  -1.041
  525    HE2  PHE  66           2HE      PHE  66  -7.377  11.439  -0.771
  526    HZ   PHE  66           HZ       PHE  66  -7.271   9.070  -0.105
  527    H    ILE  67           H        ILE  67  -1.327   9.816  -2.245
  528    HA   ILE  67           HA       ILE  67  -2.184   9.407   0.366
  529    HB   ILE  67           HB       ILE  67   0.417   8.637  -0.961
  530   1HG1  ILE  67          2HG1      ILE  67  -0.875   6.334  -0.634
  531   2HG1  ILE  67          1HG1      ILE  67  -2.278   7.397  -0.642
  532   1HG2  ILE  67          1HG2      ILE  67   0.983   8.555   1.302
  533   2HG2  ILE  67          2HG2      ILE  67   0.475   6.906   0.935
  534   3HG2  ILE  67          3HG2      ILE  67  -0.622   8.000   1.779
  535   1HD1  ILE  67          1HD1      ILE  67  -0.549   8.079  -2.814
  536   2HD1  ILE  67          2HD1      ILE  67  -2.218   7.514  -2.847
  537   3HD1  ILE  67          3HD1      ILE  67  -0.894   6.349  -2.839
  538    H    LYS  68           H        LYS  68   0.583  11.273  -0.847
  539    HA   LYS  68           HA       LYS  68   1.435  12.013   1.803
  540   1HB   LYS  68          2HB       LYS  68   2.247  13.247  -0.836
  541   2HB   LYS  68          1HB       LYS  68   3.101  13.371   0.696
  542   1HG   LYS  68          2HG       LYS  68   2.945  10.658   0.314
  543   2HG   LYS  68          1HG       LYS  68   3.173  11.277  -1.324
  544   1HD   LYS  68          2HD       LYS  68   4.909  11.920   1.060
  545   2HD   LYS  68          1HD       LYS  68   5.314  10.787  -0.230
  546   1HE   LYS  68          2HE       LYS  68   5.878  12.427  -1.660
  547   2HE   LYS  68          1HE       LYS  68   4.543  13.462  -1.153
  548   1HZ   LYS  68          1HZ       LYS  68   6.349  14.633  -0.412
  549   2HZ   LYS  68          2HZ       LYS  68   7.255  13.252  -0.042
  550   3HZ   LYS  68          3HZ       LYS  68   5.988  13.729   0.972
  551    H    GLU  69           H        GLU  69  -0.774  13.222  -0.551
  552    HA   GLU  69           HA       GLU  69  -0.836  15.934   0.248
  553   1HB   GLU  69          2HB       GLU  69  -1.757  14.908  -1.893
  554   2HB   GLU  69          1HB       GLU  69  -3.147  14.417  -0.935
  555   1HG   GLU  69          2HG       GLU  69  -3.894  16.570  -0.662
  556   2HG   GLU  69          1HG       GLU  69  -2.294  17.268  -0.899
  557    H    ASN  70           H        ASN  70  -2.688  13.087   1.222
  558    HA   ASN  70           HA       ASN  70  -3.817  14.670   3.437
  559   1HB   ASN  70          2HB       ASN  70  -5.084  12.144   2.414
  560   2HB   ASN  70          1HB       ASN  70  -5.817  13.454   3.334
  561   1HD2  ASN  70          1HD2      ASN  70  -4.307  12.748   0.217
  562   2HD2  ASN  70          2HD2      ASN  70  -5.284  13.834  -0.702
  563    H    SER  71           H        SER  71  -1.348  12.781   3.007
  564    HA   SER  71           HA       SER  71  -1.393  11.743   5.675
  565   1HB   SER  71          2HB       SER  71  -2.131  10.002   3.467
  566   2HB   SER  71          1HB       SER  71  -0.701   9.405   4.308
  567    HG   SER  71           HG       SER  71  -1.841   9.252   6.164
  568    HA   PRO  72           HA       PRO  72   2.734  12.847   3.775
  569   1HB   PRO  72          2HB       PRO  72   2.990  14.601   6.105
  570   2HB   PRO  72          1HB       PRO  72   3.151  14.993   4.392
  571   1HG   PRO  72          2HG       PRO  72   1.058  15.833   5.879
  572   2HG   PRO  72          1HG       PRO  72   0.912  15.460   4.152
  573   1HD   PRO  72          2HD       PRO  72   0.122  13.813   6.522
  574   2HD   PRO  72          1HD       PRO  72  -0.727  14.052   4.980
  575    H    ASP  73           H        ASP  73   1.554  11.868   6.829
  576    HA   ASP  73           HA       ASP  73   4.195  10.986   7.719
  577   1HB   ASP  73          2HB       ASP  73   2.102  12.123   9.094
  578   2HB   ASP  73          1HB       ASP  73   1.974  10.416   9.510
  579    H    SER  74           H        SER  74   2.364   9.742   5.591
  580    HA   SER  74           HA       SER  74   2.012   7.082   6.763
  581   1HB   SER  74          2HB       SER  74   0.095   8.033   5.541
  582   2HB   SER  74          1HB       SER  74   1.089   8.166   4.090
  583    HG   SER  74           HG       SER  74  -0.345   6.122   4.796
  584    H    VAL  75           H        VAL  75   2.222   5.602   4.344
  585    HA   VAL  75           HA       VAL  75   4.882   6.109   3.309
  586    HB   VAL  75           HB       VAL  75   4.348   3.462   4.648
  587   1HG1  VAL  75          1HG1      VAL  75   6.771   4.713   3.346
  588   2HG1  VAL  75          2HG1      VAL  75   5.866   3.307   2.787
  589   3HG1  VAL  75          3HG1      VAL  75   6.809   3.214   4.275
  590   1HG2  VAL  75          1HG2      VAL  75   4.517   5.074   6.397
  591   2HG2  VAL  75          2HG2      VAL  75   5.882   5.872   5.614
  592   3HG2  VAL  75          3HG2      VAL  75   6.075   4.255   6.290
  593    H    VAL  76           H        VAL  76   5.170   5.418   1.331
  594    HA   VAL  76           HA       VAL  76   2.995   3.889   0.080
  595    HB   VAL  76           HB       VAL  76   5.147   5.384  -1.393
  596   1HG1  VAL  76          1HG1      VAL  76   3.915   3.824  -2.742
  597   2HG1  VAL  76          2HG1      VAL  76   3.407   5.460  -3.160
  598   3HG1  VAL  76          3HG1      VAL  76   2.380   4.452  -2.140
  599   1HG2  VAL  76          1HG2      VAL  76   2.456   6.477  -0.584
  600   2HG2  VAL  76          2HG2      VAL  76   3.708   7.312  -1.505
  601   3HG2  VAL  76          3HG2      VAL  76   3.984   6.903   0.188
  602    H    ILE  77           H        ILE  77   3.622   1.792   0.581
  603    HA   ILE  77           HA       ILE  77   6.226   0.896  -0.435
  604    HB   ILE  77           HB       ILE  77   4.269  -0.687   1.233
  605   1HG1  ILE  77          2HG1      ILE  77   5.064   1.352   2.417
  606   2HG1  ILE  77          1HG1      ILE  77   5.623  -0.138   3.169
  607   1HG2  ILE  77          1HG2      ILE  77   5.622  -2.320   0.471
  608   2HG2  ILE  77          2HG2      ILE  77   6.705  -1.727   1.730
  609   3HG2  ILE  77          3HG2      ILE  77   6.922  -1.200   0.062
  610   1HD1  ILE  77          1HD1      ILE  77   7.306   1.434   1.245
  611   2HD1  ILE  77          2HD1      ILE  77   7.812   0.161   2.355
  612   3HD1  ILE  77          3HD1      ILE  77   7.305   1.727   2.984
  613    H    VAL  78           H        VAL  78   4.184   1.598  -2.247
  614    HA   VAL  78           HA       VAL  78   2.483  -0.276  -3.229
  615    HB   VAL  78           HB       VAL  78   4.303   1.575  -4.780
  616   1HG1  VAL  78          1HG1      VAL  78   1.949  -0.039  -5.764
  617   2HG1  VAL  78          2HG1      VAL  78   3.627  -0.196  -6.275
  618   3HG1  VAL  78          3HG1      VAL  78   2.721   1.266  -6.663
  619   1HG2  VAL  78          1HG2      VAL  78   1.461   2.154  -4.757
  620   2HG2  VAL  78          2HG2      VAL  78   2.829   3.183  -4.336
  621   3HG2  VAL  78          3HG2      VAL  78   2.139   2.098  -3.130
  622    H    ILE  79           H        ILE  79   2.844  -2.390  -3.393
  623    HA   ILE  79           HA       ILE  79   5.373  -3.343  -4.542
  624    HB   ILE  79           HB       ILE  79   3.286  -5.146  -3.360
  625   1HG1  ILE  79          2HG1      ILE  79   5.422  -3.659  -1.817
  626   2HG1  ILE  79          1HG1      ILE  79   3.687  -3.393  -1.690
  627   1HG2  ILE  79          1HG2      ILE  79   5.707  -6.136  -2.668
  628   2HG2  ILE  79          2HG2      ILE  79   6.102  -5.320  -4.180
  629   3HG2  ILE  79          3HG2      ILE  79   4.848  -6.559  -4.148
  630   1HD1  ILE  79          1HD1      ILE  79   4.120  -4.712   0.141
  631   2HD1  ILE  79          2HD1      ILE  79   5.328  -5.677  -0.707
  632   3HD1  ILE  79          3HD1      ILE  79   3.615  -5.905  -1.055
  633    H    THR  80           H        THR  80   5.383  -4.796  -6.299
  634    HA   THR  80           HA       THR  80   2.896  -5.516  -7.578
  635    HB   THR  80           HB       THR  80   3.283  -4.359  -9.657
  636    HG1  THR  80           1HG      THR  80   5.723  -3.670  -8.449
  637   1HG2  THR  80          1HG2      THR  80   2.155  -3.069  -7.859
  638   2HG2  THR  80          2HG2      THR  80   2.970  -2.081  -9.070
  639   3HG2  THR  80          3HG2      THR  80   3.711  -2.328  -7.489
  640    H    GLY  81           H        GLY  81   3.158  -7.021  -9.307
  641   1HA   GLY  81          2HA       GLY  81   5.808  -7.966  -9.975
  642   2HA   GLY  81          1HA       GLY  81   4.891  -9.065  -8.956
  643    H    HIS  82           H        HIS  82   5.849  -8.984 -11.896
  644    HA   HIS  82           HA       HIS  82   5.142  -9.841 -13.879
  645   1HB   HIS  82          2HB       HIS  82   2.804 -10.816 -12.224
  646   2HB   HIS  82          1HB       HIS  82   3.186 -11.354 -13.855
  647    HD1  HIS  82           1HD      HIS  82   6.303 -10.989 -12.162
  648    HD2  HIS  82           2HD      HIS  82   3.300 -13.861 -12.181
  649    HE1  HIS  82           1HE      HIS  82   7.365 -13.079 -11.252
  650    HE2  HIS  82           2HE      HIS  82   5.506 -14.778 -11.192
  651    H    GLY  83           H        GLY  83   4.894  -7.545 -14.472
  652   1HA   GLY  83          2HA       GLY  83   2.773  -6.991 -16.056
  653   2HA   GLY  83          1HA       GLY  83   2.223  -6.439 -14.481
  654    H    SER  84           H        SER  84   5.220  -6.222 -16.405
  655    HA   SER  84           HA       SER  84   6.549  -4.459 -16.950
  656   1HB   SER  84          2HB       SER  84   3.853  -3.240 -16.732
  657   2HB   SER  84          1HB       SER  84   5.219  -2.126 -16.686
  658    HG   SER  84           HG       SER  84   5.045  -2.320 -18.787
  659    H    VAL  85           H        VAL  85   8.134  -3.497 -15.839
  660    HA   VAL  85           HA       VAL  85   7.614  -2.838 -13.016
  661    HB   VAL  85           HB       VAL  85  10.064  -3.112 -12.684
  662   1HG1  VAL  85          1HG1      VAL  85   8.213  -5.271 -13.463
  663   2HG1  VAL  85          2HG1      VAL  85   9.103  -5.023 -11.961
  664   3HG1  VAL  85          3HG1      VAL  85   9.918  -5.710 -13.366
  665   1HG2  VAL  85          1HG2      VAL  85  11.522  -3.596 -14.337
  666   2HG2  VAL  85          2HG2      VAL  85  10.292  -2.851 -15.358
  667   3HG2  VAL  85          3HG2      VAL  85  10.366  -4.606 -15.206
  668    H    ASP  86           H        ASP  86   7.124  -1.051 -15.277
  669    HA   ASP  86           HA       ASP  86   9.241   0.951 -15.019
  670   1HB   ASP  86          2HB       ASP  86   8.379   0.442 -17.272
  671   2HB   ASP  86          1HB       ASP  86   6.769   0.945 -16.767
  672    H    THR  87           H        THR  87   5.744   0.565 -14.355
  673    HA   THR  87           HA       THR  87   5.201   3.145 -13.500
  674    HB   THR  87           HB       THR  87   3.637   1.075 -13.759
  675    HG1  THR  87           1HG      THR  87   3.213   2.825 -11.574
  676   1HG2  THR  87          1HG2      THR  87   4.656  -0.339 -12.041
  677   2HG2  THR  87          2HG2      THR  87   2.965   0.016 -11.687
  678   3HG2  THR  87          3HG2      THR  87   4.244   0.863 -10.817
  679    H    ALA  88           H        ALA  88   6.914   0.551 -11.958
  680    HA   ALA  88           HA       ALA  88   6.931   1.402  -9.304
  681   1HB   ALA  88          1HB       ALA  88   9.239   0.092 -10.730
  682   2HB   ALA  88          2HB       ALA  88   7.794  -0.781 -10.221
  683   3HB   ALA  88          3HB       ALA  88   8.829  -0.011  -9.019
  684    H    VAL  89           H        VAL  89   9.433   1.889 -11.764
  685    HA   VAL  89           HA       VAL  89  10.940   3.739 -10.292
  686    HB   VAL  89           HB       VAL  89  12.065   4.236 -12.417
  687   1HG1  VAL  89          1HG1      VAL  89  12.886   2.302 -11.393
  688   2HG1  VAL  89          2HG1      VAL  89  12.576   1.809 -13.057
  689   3HG1  VAL  89          3HG1      VAL  89  11.438   1.374 -11.783
  690   1HG2  VAL  89          1HG2      VAL  89  11.309   3.558 -14.509
  691   2HG2  VAL  89          2HG2      VAL  89   9.838   4.119 -13.716
  692   3HG2  VAL  89          3HG2      VAL  89  10.176   2.391 -13.828
  693    H    LYS  90           H        LYS  90   8.088   4.113 -12.233
  694    HA   LYS  90           HA       LYS  90   8.396   6.975 -12.532
  695   1HB   LYS  90          2HB       LYS  90   7.298   5.590 -14.273
  696   2HB   LYS  90          1HB       LYS  90   6.010   5.223 -13.135
  697   1HG   LYS  90          2HG       LYS  90   5.278   7.480 -13.100
  698   2HG   LYS  90          1HG       LYS  90   6.707   8.021 -13.983
  699   1HD   LYS  90          2HD       LYS  90   4.727   6.066 -15.130
  700   2HD   LYS  90          1HD       LYS  90   4.564   7.812 -15.324
  701   1HE   LYS  90          2HE       LYS  90   7.204   6.680 -15.990
  702   2HE   LYS  90          1HE       LYS  90   5.879   6.221 -17.060
  703   1HZ   LYS  90          1HZ       LYS  90   7.099   8.263 -17.733
  704   2HZ   LYS  90          2HZ       LYS  90   6.512   9.030 -16.345
  705   3HZ   LYS  90          3HZ       LYS  90   5.435   8.491 -17.534
  706    H    ALA  91           H        ALA  91   6.768   4.734 -10.420
  707    HA   ALA  91           HA       ALA  91   5.163   6.812  -9.182
  708   1HB   ALA  91          1HB       ALA  91   4.534   4.833  -7.651
  709   2HB   ALA  91          2HB       ALA  91   5.374   3.845  -8.847
  710   3HB   ALA  91          3HB       ALA  91   3.983   4.817  -9.326
  711    H    ILE  92           H        ILE  92   7.960   4.799  -8.405
  712    HA   ILE  92           HA       ILE  92   8.167   5.703  -5.713
  713    HB   ILE  92           HB       ILE  92  10.190   4.503  -5.556
  714   1HG1  ILE  92          2HG1      ILE  92  10.289   4.560  -8.586
  715   2HG1  ILE  92          1HG1      ILE  92  11.379   5.395  -7.484
  716   1HG2  ILE  92          1HG2      ILE  92   9.497   2.427  -7.178
  717   2HG2  ILE  92          2HG2      ILE  92   7.980   3.316  -7.076
  718   3HG2  ILE  92          3HG2      ILE  92   8.775   2.762  -5.606
  719   1HD1  ILE  92          1HD1      ILE  92  12.311   3.321  -6.741
  720   2HD1  ILE  92          2HD1      ILE  92  12.332   3.348  -8.504
  721   3HD1  ILE  92          3HD1      ILE  92  11.111   2.404  -7.652
  722    H    LYS  93           H        LYS  93   8.859   7.203  -8.648
  723    HA   LYS  93           HA       LYS  93  11.066   8.803  -7.673
  724   1HB   LYS  93          2HB       LYS  93  10.126   8.086 -10.203
  725   2HB   LYS  93          1HB       LYS  93   9.784   9.805 -10.079
  726   1HG   LYS  93          2HG       LYS  93  12.144  10.199  -9.481
  727   2HG   LYS  93          1HG       LYS  93  12.462   8.479  -9.715
  728   1HD   LYS  93          2HD       LYS  93  12.989   9.120 -11.811
  729   2HD   LYS  93          1HD       LYS  93  11.242   9.080 -12.051
  730   1HE   LYS  93          2HE       LYS  93  11.314  11.532 -11.234
  731   2HE   LYS  93          1HE       LYS  93  13.036  11.436 -11.601
  732   1HZ   LYS  93          1HZ       LYS  93  12.648  11.279 -13.827
  733   2HZ   LYS  93          2HZ       LYS  93  11.310  12.216 -13.388
  734   3HZ   LYS  93          3HZ       LYS  93  11.131  10.555 -13.644
  735    H    LYS  94           H        LYS  94   7.608   9.095  -8.179
  736    HA   LYS  94           HA       LYS  94   7.341  11.863  -7.866
  737   1HB   LYS  94          2HB       LYS  94   5.432   9.635  -7.159
  738   2HB   LYS  94          1HB       LYS  94   5.000  11.340  -7.175
  739   1HG   LYS  94          2HG       LYS  94   6.237  10.335  -9.645
  740   2HG   LYS  94          1HG       LYS  94   4.651   9.662  -9.256
  741   1HD   LYS  94          2HD       LYS  94   3.604  11.577  -9.753
  742   2HD   LYS  94          1HD       LYS  94   4.786  12.548  -8.872
  743   1HE   LYS  94          2HE       LYS  94   6.315  11.980 -10.926
  744   2HE   LYS  94          1HE       LYS  94   4.773  11.695 -11.731
  745   1HZ   LYS  94          1HZ       LYS  94   5.955  14.081 -11.580
  746   2HZ   LYS  94          2HZ       LYS  94   4.951  14.165 -10.221
  747   3HZ   LYS  94          3HZ       LYS  94   4.284  13.873 -11.750
  748    H    GLY  95           H        GLY  95   6.721   9.343  -5.410
  749   1HA   GLY  95          2HA       GLY  95   8.177  10.659  -3.378
  750   2HA   GLY  95          1HA       GLY  95   6.478  11.083  -3.240
  751    H    ALA  96           H        ALA  96   7.502   7.936  -4.404
  752    HA   ALA  96           HA       ALA  96   6.161   6.728  -2.123
  753   1HB   ALA  96          1HB       ALA  96   5.681   4.997  -3.462
  754   2HB   ALA  96          2HB       ALA  96   7.327   4.904  -4.090
  755   3HB   ALA  96          3HB       ALA  96   6.186   6.062  -4.774
  756    H    TYR  97           H        TYR  97   7.254   4.530  -1.436
  757    HA   TYR  97           HA       TYR  97   9.961   5.248  -0.569
  758   1HB   TYR  97          2HB       TYR  97   8.127   4.687   1.093
  759   2HB   TYR  97          1HB       TYR  97   8.235   3.030   0.513
  760    HD1  TYR  97           1HD      TYR  97   9.741   1.562   1.504
  761    HD2  TYR  97           2HD      TYR  97  10.335   5.751   1.957
  762    HE1  TYR  97           1HE      TYR  97  11.575   1.125   3.082
  763    HE2  TYR  97           2HE      TYR  97  12.171   5.325   3.536
  764    HH   TYR  97           HH       TYR  97  13.532   2.212   3.980
  765    H    GLU  98           H        GLU  98   9.352   4.163  -3.197
  766    HA   GLU  98           HA       GLU  98  10.459   2.824  -4.673
  767   1HB   GLU  98          2HB       GLU  98  12.465   1.956  -4.117
  768   2HB   GLU  98          1HB       GLU  98  12.223   2.849  -2.627
  769   1HG   GLU  98          2HG       GLU  98  11.052   0.578  -1.902
  770   2HG   GLU  98          1HG       GLU  98  12.129  -0.068  -3.138
  771    H    PHE  99           H        PHE  99   9.843   1.015  -5.716
  772    HA   PHE  99           HA       PHE  99   7.602  -0.407  -4.753
  773   1HB   PHE  99          2HB       PHE  99   9.244  -0.341  -7.182
  774   2HB   PHE  99          1HB       PHE  99   8.563  -1.923  -6.838
  775    HD1  PHE  99           1HD      PHE  99   7.056   1.401  -6.153
  776    HD2  PHE  99           2HD      PHE  99   6.945  -2.151  -8.495
  777    HE1  PHE  99           1HE      PHE  99   4.919   2.121  -7.142
  778    HE2  PHE  99           2HE      PHE  99   4.810  -1.436  -9.488
  779    HZ   PHE  99           HZ       PHE  99   3.794   0.703  -8.810
  780    H    LEU 100           H        LEU 100   7.486  -2.169  -3.509
  781    HA   LEU 100           HA       LEU 100   9.817  -3.382  -2.439
  782   1HB   LEU 100          2HB       LEU 100   7.390  -3.119  -1.471
  783   2HB   LEU 100          1HB       LEU 100   7.115  -4.652  -2.273
  784    HG   LEU 100           HG       LEU 100   7.651  -5.235  -0.073
  785   1HD1  LEU 100          1HD1      LEU 100   8.895  -6.545  -1.704
  786   2HD1  LEU 100          2HD1      LEU 100   9.817  -6.353  -0.213
  787   3HD1  LEU 100          3HD1      LEU 100  10.224  -5.389  -1.634
  788   1HD2  LEU 100          1HD2      LEU 100  10.172  -3.651   0.008
  789   2HD2  LEU 100          2HD2      LEU 100   9.119  -4.168   1.326
  790   3HD2  LEU 100          3HD2      LEU 100   8.636  -2.829   0.285
  791    H    GLU 101           H        GLU 101  10.641  -3.863  -4.714
  792    HA   GLU 101           HA       GLU 101   9.729  -6.546  -5.522
  793   1HB   GLU 101          2HB       GLU 101  10.290  -4.133  -7.101
  794   2HB   GLU 101          1HB       GLU 101  11.042  -5.593  -7.727
  795   1HG   GLU 101          2HG       GLU 101   8.167  -5.678  -6.977
  796   2HG   GLU 101          1HG       GLU 101   8.635  -4.867  -8.470
  797    H    LYS 102           H        LYS 102  11.143  -8.001  -4.840
  798    HA   LYS 102           HA       LYS 102  13.842  -7.974  -5.701
  799   1HB   LYS 102          2HB       LYS 102  13.262  -6.842  -3.075
  800   2HB   LYS 102          1HB       LYS 102  14.395  -8.182  -2.992
  801   1HG   LYS 102          2HG       LYS 102  16.015  -7.070  -4.157
  802   2HG   LYS 102          1HG       LYS 102  14.853  -6.072  -5.033
  803   1HD   LYS 102          2HD       LYS 102  15.422  -4.441  -3.612
  804   2HD   LYS 102          1HD       LYS 102  14.463  -5.316  -2.416
  805   1HE   LYS 102          2HE       LYS 102  17.418  -5.684  -2.902
  806   2HE   LYS 102          1HE       LYS 102  16.710  -4.747  -1.586
  807   1HZ   LYS 102          1HZ       LYS 102  15.972  -7.575  -1.939
  808   2HZ   LYS 102          2HZ       LYS 102  15.952  -6.634  -0.535
  809   3HZ   LYS 102          3HZ       LYS 102  17.424  -7.176  -1.170
  810    HA   PRO 103           HA       PRO 103  13.088 -11.968  -3.236
  811   1HB   PRO 103          2HB       PRO 103  11.252 -12.120  -1.305
  812   2HB   PRO 103          1HB       PRO 103  12.806 -11.326  -1.020
  813   1HG   PRO 103          2HG       PRO 103  10.135 -10.108  -1.606
  814   2HG   PRO 103          1HG       PRO 103  11.363  -9.601  -0.432
  815   1HD   PRO 103          2HD       PRO 103  11.021  -8.462  -2.919
  816   2HD   PRO 103          1HD       PRO 103  12.535  -8.422  -1.995
  817    H    PHE 104           H        PHE 104  11.036 -13.578  -2.623
  818    HA   PHE 104           HA       PHE 104   9.012 -13.165  -4.719
  819   1HB   PHE 104          2HB       PHE 104  11.030 -14.972  -4.991
  820   2HB   PHE 104          1HB       PHE 104   9.803 -15.964  -4.210
  821    HD1  PHE 104           1HD      PHE 104  10.699 -14.095  -7.216
  822    HD2  PHE 104           2HD      PHE 104   7.719 -16.476  -5.328
  823    HE1  PHE 104           1HE      PHE 104   9.575 -14.398  -9.383
  824    HE2  PHE 104           2HE      PHE 104   6.589 -16.784  -7.492
  825    HZ   PHE 104           HZ       PHE 104   7.517 -15.745  -9.523
  826    H    SER 105           H        SER 105   8.899 -12.694  -1.855
  827    HA   SER 105           HA       SER 105   6.514 -14.240  -1.297
  828   1HB   SER 105          2HB       SER 105   8.315 -15.645  -0.359
  829   2HB   SER 105          1HB       SER 105   8.856 -14.283   0.620
  830    HG   SER 105           HG       SER 105   7.294 -15.965   1.517
  831    H    VAL 106           H        VAL 106   6.113 -13.546   1.329
  832    HA   VAL 106           HA       VAL 106   5.928 -10.615   1.140
  833    HB   VAL 106           HB       VAL 106   3.774 -11.807   1.251
  834   1HG1  VAL 106          1HG1      VAL 106   4.014 -12.517   4.078
  835   2HG1  VAL 106          2HG1      VAL 106   5.009 -13.494   2.999
  836   3HG1  VAL 106          3HG1      VAL 106   3.268 -13.395   2.743
  837   1HG2  VAL 106          1HG2      VAL 106   3.000 -10.615   3.461
  838   2HG2  VAL 106          2HG2      VAL 106   3.510  -9.677   2.057
  839   3HG2  VAL 106          3HG2      VAL 106   4.624  -9.929   3.401
  840    H    GLU 107           H        GLU 107   6.963 -13.275   3.175
  841    HA   GLU 107           HA       GLU 107   7.313 -12.251   5.634
  842   1HB   GLU 107          2HB       GLU 107   8.103 -14.489   4.656
  843   2HB   GLU 107          1HB       GLU 107   9.609 -13.651   4.305
  844   1HG   GLU 107          2HG       GLU 107   8.447 -13.615   7.056
  845   2HG   GLU 107          1HG       GLU 107   9.394 -14.991   6.491
  846    H    ARG 108           H        ARG 108   9.412 -11.549   2.863
  847    HA   ARG 108           HA       ARG 108  11.256  -9.943   4.292
  848   1HB   ARG 108          2HB       ARG 108  11.251 -10.995   1.816
  849   2HB   ARG 108          1HB       ARG 108  10.764  -9.351   1.427
  850   1HG   ARG 108          2HG       ARG 108  12.949  -8.919   1.352
  851   2HG   ARG 108          1HG       ARG 108  12.868  -8.931   3.115
  852   1HD   ARG 108          2HD       ARG 108  13.649 -11.201   1.295
  853   2HD   ARG 108          1HD       ARG 108  14.675 -10.346   2.447
  854    HE   ARG 108           HE       ARG 108  12.403 -11.622   3.655
  855   1HH1  ARG 108          1HH1      ARG 108  15.696 -12.064   2.590
  856   2HH1  ARG 108          2HH1      ARG 108  15.996 -13.391   3.661
  857   1HH2  ARG 108          1HH2      ARG 108  12.796 -13.368   5.063
  858   2HH2  ARG 108          2HH2      ARG 108  14.349 -14.133   5.064
  859    H    PHE 109           H        PHE 109   8.313  -9.230   2.481
  860    HA   PHE 109           HA       PHE 109   8.437  -6.436   2.543
  861   1HB   PHE 109          2HB       PHE 109   6.836  -7.493   1.113
  862   2HB   PHE 109          1HB       PHE 109   6.097  -8.348   2.462
  863    HD1  PHE 109           1HD      PHE 109   7.035  -4.767   2.363
  864    HD2  PHE 109           2HD      PHE 109   3.877  -7.618   2.290
  865    HE1  PHE 109           1HE      PHE 109   5.396  -2.951   2.618
  866    HE2  PHE 109           2HE      PHE 109   2.231  -5.807   2.542
  867    HZ   PHE 109           HZ       PHE 109   2.991  -3.469   2.706
  868    H    LEU 110           H        LEU 110   7.552  -8.758   4.983
  869    HA   LEU 110           HA       LEU 110   6.162  -7.026   6.721
  870   1HB   LEU 110          2HB       LEU 110   6.896  -9.719   6.676
  871   2HB   LEU 110          1HB       LEU 110   7.588  -9.059   8.146
  872    HG   LEU 110           HG       LEU 110   4.684  -8.793   7.380
  873   1HD1  LEU 110          1HD1      LEU 110   6.094 -10.777   9.140
  874   2HD1  LEU 110          2HD1      LEU 110   5.066 -11.096   7.745
  875   3HD1  LEU 110          3HD1      LEU 110   4.362 -10.460   9.231
  876   1HD2  LEU 110          1HD2      LEU 110   5.377  -7.029   8.848
  877   2HD2  LEU 110          2HD2      LEU 110   6.212  -8.170   9.902
  878   3HD2  LEU 110          3HD2      LEU 110   4.453  -8.201   9.787
  879    H    LEU 111           H        LEU 111   9.571  -7.839   6.380
  880    HA   LEU 111           HA       LEU 111  10.543  -6.651   8.709
  881   1HB   LEU 111          2HB       LEU 111  11.720  -7.250   6.039
  882   2HB   LEU 111          1HB       LEU 111  12.636  -6.288   7.183
  883    HG   LEU 111           HG       LEU 111  12.392  -8.159   8.838
  884   1HD1  LEU 111          1HD1      LEU 111  11.491  -9.754   6.449
  885   2HD1  LEU 111          2HD1      LEU 111  10.407  -9.174   7.714
  886   3HD1  LEU 111          3HD1      LEU 111  11.691 -10.317   8.109
  887   1HD2  LEU 111          1HD2      LEU 111  14.253  -7.762   6.928
  888   2HD2  LEU 111          2HD2      LEU 111  13.729  -9.398   6.525
  889   3HD2  LEU 111          3HD2      LEU 111  14.344  -9.041   8.140
  890    H    THR 112           H        THR 112  10.387  -5.255   5.430
  891    HA   THR 112           HA       THR 112  11.254  -2.692   6.135
  892    HB   THR 112           HB       THR 112   9.445  -3.574   3.877
  893    HG1  THR 112           1HG      THR 112  12.224  -3.024   3.882
  894   1HG2  THR 112          1HG2      THR 112  10.653  -1.480   2.821
  895   2HG2  THR 112          2HG2      THR 112  10.639  -0.934   4.498
  896   3HG2  THR 112          3HG2      THR 112   9.125  -1.336   3.689
  897    H    ILE 113           H        ILE 113   7.999  -4.063   5.959
  898    HA   ILE 113           HA       ILE 113   6.395  -1.895   6.262
  899    HB   ILE 113           HB       ILE 113   6.202  -4.686   7.291
  900   1HG1  ILE 113          2HG1      ILE 113   5.652  -4.104   4.953
  901   2HG1  ILE 113          1HG1      ILE 113   4.266  -4.755   5.822
  902   1HG2  ILE 113          1HG2      ILE 113   5.244  -3.539   9.146
  903   2HG2  ILE 113          2HG2      ILE 113   3.916  -4.179   8.179
  904   3HG2  ILE 113          3HG2      ILE 113   4.329  -2.466   8.087
  905   1HD1  ILE 113          1HD1      ILE 113   4.349  -1.891   6.048
  906   2HD1  ILE 113          2HD1      ILE 113   3.080  -2.936   5.408
  907   3HD1  ILE 113          3HD1      ILE 113   4.390  -2.394   4.358
  908    H    LYS 114           H        LYS 114   7.778  -3.683   9.034
  909    HA   LYS 114           HA       LYS 114   6.862  -2.097  11.076
  910   1HB   LYS 114          2HB       LYS 114   8.203  -4.205  11.311
  911   2HB   LYS 114          1HB       LYS 114   9.644  -3.264  10.950
  912   1HG   LYS 114          2HG       LYS 114   7.907  -2.313  13.153
  913   2HG   LYS 114          1HG       LYS 114   8.859  -3.773  13.429
  914   1HD   LYS 114          2HD       LYS 114   9.949  -1.111  12.515
  915   2HD   LYS 114          1HD       LYS 114  10.048  -1.751  14.156
  916   1HE   LYS 114          2HE       LYS 114  11.062  -3.791  12.589
  917   2HE   LYS 114          1HE       LYS 114  11.685  -2.329  11.825
  918   1HZ   LYS 114          1HZ       LYS 114  11.873  -2.483  14.731
  919   2HZ   LYS 114          2HZ       LYS 114  12.956  -1.827  13.609
  920   3HZ   LYS 114          3HZ       LYS 114  12.897  -3.499  13.849
  921    H    HIS 115           H        HIS 115  10.028  -1.775   9.492
  922    HA   HIS 115           HA       HIS 115  10.792   0.629  10.617
  923   1HB   HIS 115          2HB       HIS 115  12.092  -0.982   9.074
  924   2HB   HIS 115          1HB       HIS 115  11.422  -0.024   7.759
  925    HD1  HIS 115           1HD      HIS 115  11.703   2.760   9.239
  926    HD2  HIS 115           2HD      HIS 115  14.690  -0.098   8.818
  927    HE1  HIS 115           1HE      HIS 115  13.870   4.014   9.464
  928    HE2  HIS 115           2HE      HIS 115  15.661   2.252   9.288
  929    H    ALA 116           H        ALA 116   8.464   0.017   8.096
  930    HA   ALA 116           HA       ALA 116   8.395   2.637   7.004
  931   1HB   ALA 116          1HB       ALA 116   5.848   1.319   6.812
  932   2HB   ALA 116          2HB       ALA 116   7.153   0.180   6.479
  933   3HB   ALA 116          3HB       ALA 116   7.023   1.671   5.546
  934    H    PHE 117           H        PHE 117   6.605   1.028   9.591
  935    HA   PHE 117           HA       PHE 117   4.809   3.165  10.086
  936   1HB   PHE 117          2HB       PHE 117   5.593   0.660  11.502
  937   2HB   PHE 117          1HB       PHE 117   4.712   1.889  12.404
  938    HD1  PHE 117           1HD      PHE 117   2.443   2.503  11.771
  939    HD2  PHE 117           2HD      PHE 117   4.537  -0.615   9.772
  940    HE1  PHE 117           1HE      PHE 117   0.321   1.695  10.824
  941    HE2  PHE 117           2HE      PHE 117   2.418  -1.431   8.820
  942    HZ   PHE 117           HZ       PHE 117   0.307  -0.273   9.347
  943    H    GLU 118           H        GLU 118   8.078   2.536  11.054
  944    HA   GLU 118           HA       GLU 118   8.299   3.937  13.421
  945   1HB   GLU 118          2HB       GLU 118  10.212   3.548  11.146
  946   2HB   GLU 118          1HB       GLU 118  10.662   4.492  12.559
  947   1HG   GLU 118          2HG       GLU 118   9.774   2.319  13.802
  948   2HG   GLU 118          1HG       GLU 118  10.244   1.578  12.273
  949    H    GLU 119           H        GLU 119   7.773   5.166  10.226
  950    HA   GLU 119           HA       GLU 119   8.594   7.851  10.800
  951   1HB   GLU 119          2HB       GLU 119   6.873   6.781   8.559
  952   2HB   GLU 119          1HB       GLU 119   7.564   8.396   8.634
  953   1HG   GLU 119          2HG       GLU 119   9.817   7.406   8.620
  954   2HG   GLU 119          1HG       GLU 119   9.090   5.808   8.464
  955    H    TYR 120           H        TYR 120   5.978   6.069  11.804
  956    HA   TYR 120           HA       TYR 120   4.408   8.511  12.276
  957   1HB   TYR 120          2HB       TYR 120   3.331   7.110  10.539
  958   2HB   TYR 120          1HB       TYR 120   3.282   5.766  11.676
  959    HD1  TYR 120           1HD      TYR 120   1.140   5.363  12.410
  960    HD2  TYR 120           2HD      TYR 120   2.388   9.396  11.891
  961    HE1  TYR 120           1HE      TYR 120  -1.042   6.139  13.237
  962    HE2  TYR 120           2HE      TYR 120   0.211  10.183  12.718
  963    HH   TYR 120           HH       TYR 120  -1.636   9.363  14.114
  964    H    SER 121           H        SER 121   6.392   7.170  13.944
  965    HA   SER 121           HA       SER 121   4.905   7.115  16.380
  966   1HB   SER 121          2HB       SER 121   6.087   4.518  15.370
  967   2HB   SER 121          1HB       SER 121   5.546   4.787  17.027
  968    HG   SER 121           HG       SER 121   4.092   4.227  14.802
  Start of MODEL   33
    1   1H    MET   1          1HT       MET   1  -1.258   3.799  17.289
    2   2H    MET   1          2HT       MET   1  -0.205   2.539  16.791
    3   3H    MET   1          3HT       MET   1  -1.874   2.470  16.399
    4    HA   MET   1           HA       MET   1  -1.724   4.178  14.893
    5   1HB   MET   1          2HB       MET   1  -0.343   5.623  16.340
    6   2HB   MET   1          1HB       MET   1   1.066   4.635  15.977
    7   1HG   MET   1          2HG       MET   1   1.298   5.484  13.877
    8   2HG   MET   1          1HG       MET   1  -0.423   5.826  13.704
    9   1HE   MET   1          1HE       MET   1   0.330   8.934  12.881
   10   2HE   MET   1          2HE       MET   1   1.254   7.483  12.493
   11   3HE   MET   1          3HE       MET   1   2.046   8.849  13.279
   12    H    LYS   2           H        LYS   2  -1.448   1.448  14.671
   13    HA   LYS   2           HA       LYS   2   0.568   1.232  12.539
   14   1HB   LYS   2          2HB       LYS   2  -0.179  -1.060  14.348
   15   2HB   LYS   2          1HB       LYS   2   1.141  -0.984  13.190
   16   1HG   LYS   2          2HG       LYS   2   1.272   1.086  15.242
   17   2HG   LYS   2          1HG       LYS   2   1.356  -0.557  15.878
   18   1HD   LYS   2          2HD       LYS   2   3.049  -0.779  13.798
   19   2HD   LYS   2          1HD       LYS   2   3.269   0.929  14.186
   20   1HE   LYS   2          2HE       LYS   2   4.889  -0.296  15.427
   21   2HE   LYS   2          1HE       LYS   2   3.656   0.246  16.564
   22   1HZ   LYS   2          1HZ       LYS   2   2.671  -1.939  16.522
   23   2HZ   LYS   2          2HZ       LYS   2   4.308  -2.068  16.928
   24   3HZ   LYS   2          3HZ       LYS   2   3.791  -2.469  15.368
   25    H    ARG   3           H        ARG   3  -0.885   1.531  10.885
   26    HA   ARG   3           HA       ARG   3  -2.658  -0.723  10.354
   27   1HB   ARG   3          2HB       ARG   3  -3.720   2.050   9.919
   28   2HB   ARG   3          1HB       ARG   3  -4.602   0.532  10.009
   29   1HG   ARG   3          2HG       ARG   3  -5.146   1.463  12.022
   30   2HG   ARG   3          1HG       ARG   3  -3.722   0.523  12.477
   31   1HD   ARG   3          2HD       ARG   3  -2.395   2.385  12.696
   32   2HD   ARG   3          1HD       ARG   3  -3.357   3.335  11.564
   33    HE   ARG   3           HE       ARG   3  -3.769   3.069  14.402
   34   1HH1  ARG   3          1HH1      ARG   3  -5.252   3.869  11.345
   35   2HH1  ARG   3          2HH1      ARG   3  -6.500   4.832  12.062
   36   1HH2  ARG   3          1HH2      ARG   3  -5.409   4.334  15.345
   37   2HH2  ARG   3          2HH2      ARG   3  -6.590   5.095  14.332
   38    H    VAL   4           H        VAL   4  -1.867  -1.448   8.468
   39    HA   VAL   4           HA       VAL   4  -0.865   0.476   6.508
   40    HB   VAL   4           HB       VAL   4  -0.752  -2.531   6.293
   41   1HG1  VAL   4          1HG1      VAL   4   0.500  -0.233   4.859
   42   2HG1  VAL   4          2HG1      VAL   4  -0.227  -1.702   4.210
   43   3HG1  VAL   4          3HG1      VAL   4   1.366  -1.765   4.965
   44   1HG2  VAL   4          1HG2      VAL   4   1.446  -0.773   7.375
   45   2HG2  VAL   4          2HG2      VAL   4   1.377  -2.535   7.344
   46   3HG2  VAL   4          3HG2      VAL   4   0.306  -1.629   8.413
   47    H    LEU   5           H        LEU   5  -1.608   0.531   4.348
   48    HA   LEU   5           HA       LEU   5  -4.322  -0.556   4.004
   49   1HB   LEU   5          2HB       LEU   5  -4.245   1.879   4.032
   50   2HB   LEU   5          1HB       LEU   5  -3.038   1.876   2.759
   51    HG   LEU   5           HG       LEU   5  -4.718   0.842   1.233
   52   1HD1  LEU   5          1HD1      LEU   5  -6.778   0.239   1.877
   53   2HD1  LEU   5          2HD1      LEU   5  -6.968   1.639   2.933
   54   3HD1  LEU   5          3HD1      LEU   5  -6.082   0.225   3.497
   55   1HD2  LEU   5          1HD2      LEU   5  -6.050   3.297   2.188
   56   2HD2  LEU   5          2HD2      LEU   5  -5.465   2.872   0.579
   57   3HD2  LEU   5          3HD2      LEU   5  -4.333   3.437   1.809
   58    H    VAL   6           H        VAL   6  -4.815  -1.769   2.259
   59    HA   VAL   6           HA       VAL   6  -2.648  -2.282   0.323
   60    HB   VAL   6           HB       VAL   6  -4.803  -4.232   1.140
   61   1HG1  VAL   6          1HG1      VAL   6  -2.584  -4.268  -0.805
   62   2HG1  VAL   6          2HG1      VAL   6  -4.128  -5.122  -0.824
   63   3HG1  VAL   6          3HG1      VAL   6  -2.796  -5.729   0.159
   64   1HG2  VAL   6          1HG2      VAL   6  -3.533  -5.040   2.812
   65   2HG2  VAL   6          2HG2      VAL   6  -2.830  -3.423   2.799
   66   3HG2  VAL   6          3HG2      VAL   6  -2.024  -4.742   1.951
   67    H    VAL   7           H        VAL   7  -3.114  -2.251  -1.821
   68    HA   VAL   7           HA       VAL   7  -5.924  -1.878  -2.615
   69    HB   VAL   7           HB       VAL   7  -3.656  -0.410  -3.953
   70   1HG1  VAL   7          1HG1      VAL   7  -5.906  -0.860  -5.088
   71   2HG1  VAL   7          2HG1      VAL   7  -5.305   0.799  -5.078
   72   3HG1  VAL   7          3HG1      VAL   7  -6.566   0.310  -3.945
   73   1HG2  VAL   7          1HG2      VAL   7  -5.535   0.770  -1.916
   74   2HG2  VAL   7          2HG2      VAL   7  -4.159   1.550  -2.696
   75   3HG2  VAL   7          3HG2      VAL   7  -3.894   0.245  -1.540
   76    H    ASP   8           H        ASP   8  -6.489  -3.511  -3.901
   77    HA   ASP   8           HA       ASP   8  -4.792  -4.263  -6.118
   78   1HB   ASP   8          2HB       ASP   8  -3.883  -5.654  -4.327
   79   2HB   ASP   8          1HB       ASP   8  -5.489  -6.264  -3.952
   80    H    ASP   9           H        ASP   9  -5.959  -4.929  -7.828
   81    HA   ASP   9           HA       ASP   9  -8.854  -5.015  -7.514
   82   1HB   ASP   9          2HB       ASP   9  -7.807  -3.585  -9.268
   83   2HB   ASP   9          1HB       ASP   9  -7.209  -5.044 -10.052
   84    H    GLU  10           H        GLU  10  -7.847  -7.220  -6.373
   85    HA   GLU  10           HA       GLU  10  -8.070  -9.369  -8.361
   86   1HB   GLU  10          2HB       GLU  10  -7.197 -10.833  -6.538
   87   2HB   GLU  10          1HB       GLU  10  -6.089  -9.556  -7.019
   88   1HG   GLU  10          2HG       GLU  10  -6.738  -8.243  -5.073
   89   2HG   GLU  10          1HG       GLU  10  -7.875  -9.503  -4.596
   90    H    GLU  11           H        GLU  11  -9.342  -8.351  -5.210
   91    HA   GLU  11           HA       GLU  11 -11.979  -9.037  -5.719
   92   1HB   GLU  11          2HB       GLU  11 -11.914 -11.068  -3.972
   93   2HB   GLU  11          1HB       GLU  11 -11.800 -11.306  -5.709
   94   1HG   GLU  11          2HG       GLU  11  -9.640 -11.952  -5.618
   95   2HG   GLU  11          1HG       GLU  11  -9.255 -10.867  -4.285
   96    H    SER  12           H        SER  12 -10.195  -9.969  -2.798
   97    HA   SER  12           HA       SER  12 -11.305  -7.608  -1.441
   98   1HB   SER  12          2HB       SER  12 -11.509  -9.140   0.610
   99   2HB   SER  12          1HB       SER  12 -12.704  -9.352  -0.668
  100    HG   SER  12           HG       SER  12 -11.302 -11.228   0.334
  101    H    ILE  13           H        ILE  13  -9.348 -10.269  -0.161
  102    HA   ILE  13           HA       ILE  13  -7.290  -8.305   0.567
  103    HB   ILE  13           HB       ILE  13  -7.358 -11.142   1.537
  104   1HG1  ILE  13          2HG1      ILE  13  -9.571 -10.114   2.002
  105   2HG1  ILE  13          1HG1      ILE  13  -8.661 -10.460   3.469
  106   1HG2  ILE  13          1HG2      ILE  13  -5.392 -10.353   2.291
  107   2HG2  ILE  13          2HG2      ILE  13  -6.399  -9.668   3.566
  108   3HG2  ILE  13          3HG2      ILE  13  -5.907  -8.669   2.198
  109   1HD1  ILE  13          1HD1      ILE  13  -8.456  -8.283   4.013
  110   2HD1  ILE  13          2HD1      ILE  13  -9.917  -8.152   3.034
  111   3HD1  ILE  13          3HD1      ILE  13  -8.348  -7.760   2.333
  112    H    THR  14           H        THR  14  -5.033  -8.990   0.436
  113    HA   THR  14           HA       THR  14  -4.536 -10.361  -2.082
  114    HB   THR  14           HB       THR  14  -2.397  -9.368  -2.094
  115    HG1  THR  14           1HG      THR  14  -1.292  -9.006  -0.353
  116   1HG2  THR  14          1HG2      THR  14  -3.950  -7.637  -2.525
  117   2HG2  THR  14          2HG2      THR  14  -2.730  -6.979  -1.433
  118   3HG2  THR  14          3HG2      THR  14  -4.313  -7.446  -0.810
  119    H    SER  15           H        SER  15  -3.521 -12.290  -2.267
  120    HA   SER  15           HA       SER  15  -3.648 -14.164  -0.262
  121   1HB   SER  15          2HB       SER  15  -1.553 -14.312  -2.419
  122   2HB   SER  15          1HB       SER  15  -2.468 -15.628  -1.684
  123    HG   SER  15           HG       SER  15  -4.364 -14.522  -2.651
  124    H    SER  16           H        SER  16  -2.463 -14.755   1.428
  125    HA   SER  16           HA       SER  16  -0.640 -15.093   2.779
  126   1HB   SER  16          2HB       SER  16   1.064 -13.163   1.253
  127   2HB   SER  16          1HB       SER  16   1.530 -14.628   2.119
  128    HG   SER  16           HG       SER  16   0.851 -15.849   0.453
  129    H    LEU  17           H        LEU  17  -1.517 -11.845   1.763
  130    HA   LEU  17           HA       LEU  17  -0.310 -10.379   3.793
  131   1HB   LEU  17          2HB       LEU  17  -2.244  -9.936   1.764
  132   2HB   LEU  17          1HB       LEU  17  -2.913  -9.306   3.248
  133    HG   LEU  17           HG       LEU  17  -0.912  -8.163   1.502
  134   1HD1  LEU  17          1HD1      LEU  17  -2.535  -6.690   1.978
  135   2HD1  LEU  17          2HD1      LEU  17  -1.450  -6.267   3.302
  136   3HD1  LEU  17          3HD1      LEU  17  -2.819  -7.343   3.590
  137   1HD2  LEU  17          1HD2      LEU  17   0.516  -7.232   3.345
  138   2HD2  LEU  17          2HD2      LEU  17   0.789  -8.933   2.974
  139   3HD2  LEU  17          3HD2      LEU  17  -0.144  -8.483   4.399
  140    H    SER  18           H        SER  18  -3.715 -11.447   3.722
  141    HA   SER  18           HA       SER  18  -4.535 -10.734   6.207
  142   1HB   SER  18          2HB       SER  18  -5.640 -12.208   4.239
  143   2HB   SER  18          1HB       SER  18  -5.337 -13.478   5.423
  144    HG   SER  18           HG       SER  18  -6.633 -11.055   6.093
  145    H    ALA  19           H        ALA  19  -3.328 -14.031   5.551
  146    HA   ALA  19           HA       ALA  19  -3.127 -14.917   8.146
  147   1HB   ALA  19          1HB       ALA  19  -2.793 -16.302   6.120
  148   2HB   ALA  19          2HB       ALA  19  -1.561 -16.566   7.354
  149   3HB   ALA  19          3HB       ALA  19  -1.192 -15.588   5.934
  150    H    ILE  20           H        ILE  20  -0.799 -13.011   6.306
  151    HA   ILE  20           HA       ILE  20   1.267 -13.080   8.243
  152    HB   ILE  20           HB       ILE  20   0.717 -11.207   5.948
  153   1HG1  ILE  20          2HG1      ILE  20   3.017 -13.103   6.233
  154   2HG1  ILE  20          1HG1      ILE  20   1.443 -13.686   5.705
  155   1HG2  ILE  20          1HG2      ILE  20   2.802 -11.071   8.062
  156   2HG2  ILE  20          2HG2      ILE  20   1.974  -9.770   7.206
  157   3HG2  ILE  20          3HG2      ILE  20   3.260 -10.673   6.405
  158   1HD1  ILE  20          1HD1      ILE  20   3.454 -12.126   4.274
  159   2HD1  ILE  20          2HD1      ILE  20   1.798 -11.553   4.073
  160   3HD1  ILE  20          3HD1      ILE  20   2.211 -13.219   3.665
  161    H    LEU  21           H        LEU  21  -0.645 -10.199   7.303
  162    HA   LEU  21           HA       LEU  21  -0.025  -8.626   9.467
  163   1HB   LEU  21          2HB       LEU  21  -2.730  -8.785   8.148
  164   2HB   LEU  21          1HB       LEU  21  -2.088  -7.422   9.047
  165    HG   LEU  21           HG       LEU  21  -0.343  -8.218   6.860
  166   1HD1  LEU  21          1HD1      LEU  21  -1.864  -8.586   5.290
  167   2HD1  LEU  21          2HD1      LEU  21  -2.293  -6.883   5.426
  168   3HD1  LEU  21          3HD1      LEU  21  -3.186  -8.094   6.345
  169   1HD2  LEU  21          1HD2      LEU  21  -1.548  -5.744   7.992
  170   2HD2  LEU  21          2HD2      LEU  21  -0.871  -5.696   6.364
  171   3HD2  LEU  21          3HD2      LEU  21   0.145  -6.159   7.730
  172    H    GLU  22           H        GLU  22  -2.219 -11.325   9.291
  173    HA   GLU  22           HA       GLU  22  -3.642 -10.892  11.683
  174   1HB   GLU  22          2HB       GLU  22  -3.132 -13.225   9.916
  175   2HB   GLU  22          1HB       GLU  22  -3.752 -13.534  11.532
  176   1HG   GLU  22          2HG       GLU  22  -5.373 -11.512  10.622
  177   2HG   GLU  22          1HG       GLU  22  -5.098 -12.487   9.180
  178    H    GLU  23           H        GLU  23  -0.487 -12.213  10.987
  179    HA   GLU  23           HA       GLU  23  -0.108 -13.341  13.600
  180   1HB   GLU  23          2HB       GLU  23   1.107 -14.379  11.842
  181   2HB   GLU  23          1HB       GLU  23   1.699 -12.838  11.240
  182   1HG   GLU  23          2HG       GLU  23   3.486 -12.925  12.537
  183   2HG   GLU  23          1HG       GLU  23   2.515 -13.267  13.968
  184    H    GLU  24           H        GLU  24   0.764 -10.389  11.881
  185    HA   GLU  24           HA       GLU  24   2.275  -9.336  14.088
  186   1HB   GLU  24          2HB       GLU  24   1.268  -7.989  11.576
  187   2HB   GLU  24          1HB       GLU  24   2.378  -7.267  12.733
  188   1HG   GLU  24          2HG       GLU  24   2.973  -9.821  11.271
  189   2HG   GLU  24          1HG       GLU  24   3.413  -8.228  10.658
  190    H    GLY  25           H        GLY  25   1.543  -6.786  14.444
  191   1HA   GLY  25          2HA       GLY  25  -1.212  -7.009  15.487
  192   2HA   GLY  25          1HA       GLY  25   0.067  -6.100  16.279
  193    H    TYR  26           H        TYR  26  -0.831  -6.179  12.858
  194    HA   TYR  26           HA       TYR  26  -1.104  -3.261  12.936
  195   1HB   TYR  26          2HB       TYR  26  -0.805  -5.144  10.589
  196   2HB   TYR  26          1HB       TYR  26  -0.919  -3.393  10.472
  197    HD1  TYR  26           1HD      TYR  26   1.317  -5.308   9.512
  198    HD2  TYR  26           2HD      TYR  26   0.852  -2.891  12.979
  199    HE1  TYR  26           1HE      TYR  26   3.758  -5.141   9.712
  200    HE2  TYR  26           2HE      TYR  26   3.292  -2.713  13.190
  201    HH   TYR  26           HH       TYR  26   5.303  -4.019  12.484
  202    H    HIS  27           H        HIS  27  -2.625  -2.512  11.064
  203    HA   HIS  27           HA       HIS  27  -5.181  -3.956  11.222
  204   1HB   HIS  27          2HB       HIS  27  -4.720  -1.563  12.497
  205   2HB   HIS  27          1HB       HIS  27  -5.375  -1.028  10.954
  206    HD1  HIS  27           1HD      HIS  27  -7.844  -0.927  10.843
  207    HD2  HIS  27           2HD      HIS  27  -6.533  -3.555  13.782
  208    HE1  HIS  27           1HE      HIS  27  -9.924  -1.725  12.010
  209    HE2  HIS  27           2HE      HIS  27  -9.113  -3.395  13.712
  210    HA   PRO  28           HA       PRO  28  -4.009  -3.249   6.861
  211   1HB   PRO  28          2HB       PRO  28  -4.651  -5.684   5.943
  212   2HB   PRO  28          1HB       PRO  28  -3.142  -5.374   6.809
  213   1HG   PRO  28          2HG       PRO  28  -5.682  -6.597   7.804
  214   2HG   PRO  28          1HG       PRO  28  -4.007  -7.069   8.137
  215   1HD   PRO  28          2HD       PRO  28  -5.561  -5.564   9.836
  216   2HD   PRO  28          1HD       PRO  28  -3.788  -5.535   9.820
  217    H    ASP  29           H        ASP  29  -5.302  -2.237   5.529
  218    HA   ASP  29           HA       ASP  29  -8.127  -3.051   5.348
  219   1HB   ASP  29          2HB       ASP  29  -7.971  -0.847   6.388
  220   2HB   ASP  29          1HB       ASP  29  -6.933  -0.278   5.089
  221    H    THR  30           H        THR  30  -8.526  -3.973   3.433
  222    HA   THR  30           HA       THR  30  -6.753  -3.309   1.192
  223    HB   THR  30           HB       THR  30  -7.345  -5.425   0.230
  224    HG1  THR  30           1HG      THR  30  -9.298  -5.499   2.270
  225   1HG2  THR  30          1HG2      THR  30  -6.235  -6.802   1.625
  226   2HG2  THR  30          2HG2      THR  30  -7.176  -6.319   3.035
  227   3HG2  THR  30          3HG2      THR  30  -5.878  -5.283   2.445
  228    H    ALA  31           H        ALA  31  -7.494  -2.708  -0.783
  229    HA   ALA  31           HA       ALA  31 -10.349  -1.999  -0.954
  230   1HB   ALA  31          1HB       ALA  31  -8.513  -0.153  -0.905
  231   2HB   ALA  31          2HB       ALA  31  -9.831  -0.039  -2.071
  232   3HB   ALA  31          3HB       ALA  31  -8.250  -0.626  -2.583
  233    H    LYS  32           H        LYS  32 -10.468  -1.408  -3.655
  234    HA   LYS  32           HA       LYS  32  -9.639  -3.911  -4.952
  235   1HB   LYS  32          2HB       LYS  32 -12.227  -2.778  -5.825
  236   2HB   LYS  32          1HB       LYS  32 -11.728  -4.456  -5.664
  237   1HG   LYS  32          2HG       LYS  32 -12.194  -4.485  -3.364
  238   2HG   LYS  32          1HG       LYS  32 -12.288  -2.727  -3.280
  239   1HD   LYS  32          2HD       LYS  32 -14.278  -2.873  -4.822
  240   2HD   LYS  32          1HD       LYS  32 -14.238  -4.621  -4.578
  241   1HE   LYS  32          2HE       LYS  32 -15.015  -4.478  -2.454
  242   2HE   LYS  32          1HE       LYS  32 -14.188  -2.952  -2.141
  243   1HZ   LYS  32          1HZ       LYS  32 -16.777  -3.398  -3.492
  244   2HZ   LYS  32          2HZ       LYS  32 -15.911  -1.962  -3.716
  245   3HZ   LYS  32          3HZ       LYS  32 -16.433  -2.403  -2.168
  246    H    THR  33           H        THR  33  -9.568  -0.584  -5.035
  247    HA   THR  33           HA       THR  33  -8.283  -0.501  -7.543
  248    HB   THR  33           HB       THR  33 -10.233  -0.512  -8.753
  249    HG1  THR  33           1HG      THR  33 -10.635   1.543  -9.410
  250   1HG2  THR  33          1HG2      THR  33 -12.184   1.081  -7.697
  251   2HG2  THR  33          2HG2      THR  33 -11.496   0.310  -6.267
  252   3HG2  THR  33          3HG2      THR  33 -12.119  -0.677  -7.589
  253    H    LEU  34           H        LEU  34  -8.031   1.936  -8.221
  254    HA   LEU  34           HA       LEU  34  -6.864   3.253  -6.003
  255   1HB   LEU  34          2HB       LEU  34  -7.522   4.293  -8.762
  256   2HB   LEU  34          1HB       LEU  34  -6.539   5.144  -7.586
  257    HG   LEU  34           HG       LEU  34  -5.837   2.439  -8.725
  258   1HD1  LEU  34          1HD1      LEU  34  -4.378   4.928  -9.450
  259   2HD1  LEU  34          2HD1      LEU  34  -5.899   4.567 -10.269
  260   3HD1  LEU  34          3HD1      LEU  34  -4.561   3.420 -10.347
  261   1HD2  LEU  34          1HD2      LEU  34  -4.949   3.564  -6.427
  262   2HD2  LEU  34          2HD2      LEU  34  -3.781   4.200  -7.584
  263   3HD2  LEU  34          3HD2      LEU  34  -4.004   2.458  -7.424
  264    H    ARG  35           H        ARG  35  -9.958   3.495  -7.604
  265    HA   ARG  35           HA       ARG  35 -10.778   5.925  -6.364
  266   1HB   ARG  35          2HB       ARG  35 -12.564   3.725  -7.415
  267   2HB   ARG  35          1HB       ARG  35 -12.973   5.423  -7.211
  268   1HG   ARG  35          2HG       ARG  35 -11.812   6.072  -9.080
  269   2HG   ARG  35          1HG       ARG  35 -10.725   4.683  -9.019
  270   1HD   ARG  35          2HD       ARG  35 -12.259   3.270 -10.006
  271   2HD   ARG  35          1HD       ARG  35 -13.637   4.254  -9.514
  272    HE   ARG  35           HE       ARG  35 -12.290   5.850 -11.250
  273   1HH1  ARG  35          1HH1      ARG  35 -13.544   2.599 -11.433
  274   2HH1  ARG  35          2HH1      ARG  35 -13.835   2.672 -13.138
  275   1HH2  ARG  35          1HH2      ARG  35 -12.672   5.949 -13.494
  276   2HH2  ARG  35          2HH2      ARG  35 -13.340   4.575 -14.308
  277    H    GLU  36           H        GLU  36 -11.137   2.498  -5.609
  278    HA   GLU  36           HA       GLU  36 -12.837   2.851  -3.364
  279   1HB   GLU  36          2HB       GLU  36 -11.089   0.598  -4.326
  280   2HB   GLU  36          1HB       GLU  36 -11.910   0.502  -2.774
  281   1HG   GLU  36          2HG       GLU  36 -13.251   0.912  -5.437
  282   2HG   GLU  36          1HG       GLU  36 -13.156  -0.612  -4.557
  283    H    ALA  37           H        ALA  37  -9.345   2.765  -3.812
  284    HA   ALA  37           HA       ALA  37  -8.735   2.730  -1.015
  285   1HB   ALA  37          1HB       ALA  37  -6.786   3.798  -2.994
  286   2HB   ALA  37          2HB       ALA  37  -7.267   2.106  -3.126
  287   3HB   ALA  37          3HB       ALA  37  -6.533   2.700  -1.637
  288    H    GLU  38           H        GLU  38  -8.675   5.263  -3.523
  289    HA   GLU  38           HA       GLU  38  -7.833   7.401  -2.044
  290   1HB   GLU  38          2HB       GLU  38  -8.881   7.088  -4.542
  291   2HB   GLU  38          1HB       GLU  38 -10.124   8.046  -3.751
  292   1HG   GLU  38          2HG       GLU  38  -8.619   9.801  -3.299
  293   2HG   GLU  38          1HG       GLU  38  -7.223   8.806  -3.707
  294    H    LYS  39           H        LYS  39 -11.141   6.134  -2.251
  295    HA   LYS  39           HA       LYS  39 -12.342   8.038  -0.576
  296   1HB   LYS  39          2HB       LYS  39 -13.637   6.465  -1.949
  297   2HB   LYS  39          1HB       LYS  39 -13.061   5.124  -0.968
  298   1HG   LYS  39          2HG       LYS  39 -14.331   7.231   0.595
  299   2HG   LYS  39          1HG       LYS  39 -15.401   6.495  -0.599
  300   1HD   LYS  39          2HD       LYS  39 -14.187   4.301   0.457
  301   2HD   LYS  39          1HD       LYS  39 -14.251   5.370   1.859
  302   1HE   LYS  39          2HE       LYS  39 -16.556   5.425   1.880
  303   2HE   LYS  39          1HE       LYS  39 -16.685   5.032   0.166
  304   1HZ   LYS  39          1HZ       LYS  39 -15.522   3.010   1.924
  305   2HZ   LYS  39          2HZ       LYS  39 -16.510   2.821   0.565
  306   3HZ   LYS  39          3HZ       LYS  39 -17.189   3.274   2.047
  307    H    LYS  40           H        LYS  40 -11.095   4.786   0.162
  308    HA   LYS  40           HA       LYS  40 -11.455   4.876   2.927
  309   1HB   LYS  40          2HB       LYS  40  -9.242   3.448   1.445
  310   2HB   LYS  40          1HB       LYS  40  -9.847   3.060   3.049
  311   1HG   LYS  40          2HG       LYS  40 -11.847   3.062   0.884
  312   2HG   LYS  40          1HG       LYS  40 -10.620   1.795   0.814
  313   1HD   LYS  40          2HD       LYS  40 -11.175   1.125   3.097
  314   2HD   LYS  40          1HD       LYS  40 -12.388   2.403   3.183
  315   1HE   LYS  40          2HE       LYS  40 -13.750   0.685   2.591
  316   2HE   LYS  40          1HE       LYS  40 -13.248   1.189   0.978
  317   1HZ   LYS  40          1HZ       LYS  40 -12.732  -0.974   0.781
  318   2HZ   LYS  40          2HZ       LYS  40 -12.603  -1.225   2.449
  319   3HZ   LYS  40          3HZ       LYS  40 -11.315  -0.538   1.596
  320    H    ILE  41           H        ILE  41  -9.078   6.408   0.920
  321    HA   ILE  41           HA       ILE  41  -7.411   7.054   3.243
  322    HB   ILE  41           HB       ILE  41  -6.906   7.712   0.346
  323   1HG1  ILE  41          2HG1      ILE  41  -5.476   5.552   1.857
  324   2HG1  ILE  41          1HG1      ILE  41  -7.038   5.209   1.118
  325   1HG2  ILE  41          1HG2      ILE  41  -5.293   7.969   2.856
  326   2HG2  ILE  41          2HG2      ILE  41  -5.595   9.169   1.599
  327   3HG2  ILE  41          3HG2      ILE  41  -4.507   7.818   1.284
  328   1HD1  ILE  41          1HD1      ILE  41  -5.671   4.582  -0.577
  329   2HD1  ILE  41          2HD1      ILE  41  -4.413   5.740  -0.142
  330   3HD1  ILE  41          3HD1      ILE  41  -5.860   6.286  -0.990
  331    H    LYS  42           H        LYS  42  -9.955   8.378   1.454
  332    HA   LYS  42           HA       LYS  42  -9.218  11.129   1.583
  333   1HB   LYS  42          2HB       LYS  42 -11.639   9.596   0.852
  334   2HB   LYS  42          1HB       LYS  42 -11.869  11.272   1.330
  335   1HG   LYS  42          2HG       LYS  42  -9.894  11.648  -0.390
  336   2HG   LYS  42          1HG       LYS  42 -10.530  10.145  -1.060
  337   1HD   LYS  42          2HD       LYS  42 -12.287  11.194  -1.946
  338   2HD   LYS  42          1HD       LYS  42 -12.664  11.986  -0.415
  339   1HE   LYS  42          2HE       LYS  42 -10.428  13.337  -1.275
  340   2HE   LYS  42          1HE       LYS  42 -11.294  13.017  -2.777
  341   1HZ   LYS  42          1HZ       LYS  42 -12.003  14.751  -0.563
  342   2HZ   LYS  42          2HZ       LYS  42 -13.282  13.857  -1.218
  343   3HZ   LYS  42          3HZ       LYS  42 -12.375  14.887  -2.206
  344    H    GLU  43           H        GLU  43 -10.194   8.942   3.941
  345    HA   GLU  43           HA       GLU  43 -10.821  11.151   5.758
  346   1HB   GLU  43          2HB       GLU  43 -12.335   8.538   5.642
  347   2HB   GLU  43          1HB       GLU  43 -12.577   9.811   6.832
  348   1HG   GLU  43          2HG       GLU  43 -13.099  11.326   4.846
  349   2HG   GLU  43          1HG       GLU  43 -13.223   9.839   3.907
  350    H    LEU  44           H        LEU  44  -9.998   7.715   5.473
  351    HA   LEU  44           HA       LEU  44  -8.993   7.533   8.147
  352   1HB   LEU  44          2HB       LEU  44  -9.676   5.741   6.109
  353   2HB   LEU  44          1HB       LEU  44  -7.956   5.511   6.358
  354    HG   LEU  44           HG       LEU  44  -9.270   3.954   7.703
  355   1HD1  LEU  44          1HD1      LEU  44  -7.254   4.325   8.737
  356   2HD1  LEU  44          2HD1      LEU  44  -8.380   4.795  10.011
  357   3HD1  LEU  44          3HD1      LEU  44  -7.594   6.031   9.029
  358   1HD2  LEU  44          1HD2      LEU  44 -11.270   5.338   7.968
  359   2HD2  LEU  44          2HD2      LEU  44 -10.378   6.419   9.039
  360   3HD2  LEU  44          3HD2      LEU  44 -10.677   4.749   9.521
  361    H    PHE  45           H        PHE  45  -7.154   8.399   8.805
  362    HA   PHE  45           HA       PHE  45  -5.152   9.325   6.987
  363   1HB   PHE  45          2HB       PHE  45  -5.743  10.357   9.239
  364   2HB   PHE  45          1HB       PHE  45  -4.847   9.033   9.977
  365    HD1  PHE  45           1HD      PHE  45  -4.188  11.197   7.010
  366    HD2  PHE  45           2HD      PHE  45  -2.861   9.819  10.811
  367    HE1  PHE  45           1HE      PHE  45  -2.098  12.468   6.737
  368    HE2  PHE  45           2HE      PHE  45  -0.769  11.088  10.546
  369    HZ   PHE  45           HZ       PHE  45  -0.385  12.414   8.506
  370    H    PHE  46           H        PHE  46  -5.081   6.993   6.090
  371    HA   PHE  46           HA       PHE  46  -3.811   4.927   7.452
  372   1HB   PHE  46          2HB       PHE  46  -4.175   5.611   4.568
  373   2HB   PHE  46          1HB       PHE  46  -3.065   4.311   4.995
  374    HD1  PHE  46           1HD      PHE  46  -6.353   5.051   4.138
  375    HD2  PHE  46           2HD      PHE  46  -4.077   2.592   6.761
  376    HE1  PHE  46           1HE      PHE  46  -8.258   3.502   4.332
  377    HE2  PHE  46           2HE      PHE  46  -5.976   1.039   6.961
  378    HZ   PHE  46           HZ       PHE  46  -8.069   1.495   5.746
  379    HA   PRO  47           HA       PRO  47   0.276   6.738   7.836
  380   1HB   PRO  47          2HB       PRO  47   1.426   4.597   9.058
  381   2HB   PRO  47          1HB       PRO  47   0.395   5.751   9.912
  382   1HG   PRO  47          2HG       PRO  47  -0.282   3.053   8.816
  383   2HG   PRO  47          1HG       PRO  47  -0.750   3.782  10.363
  384   1HD   PRO  47          2HD       PRO  47  -2.421   3.687   8.236
  385   2HD   PRO  47          1HD       PRO  47  -2.448   5.014   9.411
  386    H    VAL  48           H        VAL  48  -0.147   3.348   6.840
  387    HA   VAL  48           HA       VAL  48   2.030   3.742   4.905
  388    HB   VAL  48           HB       VAL  48   1.194   1.112   6.118
  389   1HG1  VAL  48          1HG1      VAL  48   3.180   1.949   4.102
  390   2HG1  VAL  48          2HG1      VAL  48   2.308   0.426   4.277
  391   3HG1  VAL  48          3HG1      VAL  48   3.719   0.756   5.283
  392   1HG2  VAL  48          1HG2      VAL  48   2.120   2.733   7.781
  393   2HG2  VAL  48          2HG2      VAL  48   3.612   2.752   6.841
  394   3HG2  VAL  48          3HG2      VAL  48   3.060   1.254   7.591
  395    H    ILE  49           H        ILE  49   1.497   3.607   2.831
  396    HA   ILE  49           HA       ILE  49  -1.072   2.348   2.129
  397    HB   ILE  49           HB       ILE  49   0.434   4.267   0.366
  398   1HG1  ILE  49          2HG1      ILE  49   0.039   5.388   2.519
  399   2HG1  ILE  49          1HG1      ILE  49  -0.967   6.075   1.248
  400   1HG2  ILE  49          1HG2      ILE  49  -2.511   4.103   0.393
  401   2HG2  ILE  49          2HG2      ILE  49  -1.655   2.682  -0.207
  402   3HG2  ILE  49          3HG2      ILE  49  -1.392   4.255  -0.961
  403   1HD1  ILE  49          1HD1      ILE  49  -1.866   5.389   3.686
  404   2HD1  ILE  49          2HD1      ILE  49  -2.201   3.904   2.795
  405   3HD1  ILE  49          3HD1      ILE  49  -2.875   5.437   2.240
  406    H    VAL  50           H        VAL  50  -1.083   0.586   0.887
  407    HA   VAL  50           HA       VAL  50   1.371  -0.093  -0.601
  408    HB   VAL  50           HB       VAL  50  -0.491  -2.034   0.774
  409   1HG1  VAL  50          1HG1      VAL  50   2.129  -2.554  -0.627
  410   2HG1  VAL  50          2HG1      VAL  50   0.541  -2.879  -1.318
  411   3HG1  VAL  50          3HG1      VAL  50   1.070  -3.750   0.120
  412   1HG2  VAL  50          1HG2      VAL  50   1.360  -2.443   2.294
  413   2HG2  VAL  50          2HG2      VAL  50   0.882  -0.746   2.341
  414   3HG2  VAL  50          3HG2      VAL  50   2.331  -1.230   1.459
  415    H    LEU  51           H        LEU  51   0.871   0.351  -2.639
  416    HA   LEU  51           HA       LEU  51  -1.757  -0.342  -3.701
  417   1HB   LEU  51          2HB       LEU  51  -0.901   1.849  -4.261
  418   2HB   LEU  51          1HB       LEU  51   0.569   1.148  -4.910
  419    HG   LEU  51           HG       LEU  51  -0.659   0.157  -6.751
  420   1HD1  LEU  51          1HD1      LEU  51  -2.735  -0.403  -5.735
  421   2HD1  LEU  51          2HD1      LEU  51  -3.080   0.736  -7.036
  422   3HD1  LEU  51          3HD1      LEU  51  -3.077   1.286  -5.360
  423   1HD2  LEU  51          1HD2      LEU  51  -0.854   3.062  -6.198
  424   2HD2  LEU  51          2HD2      LEU  51  -1.757   2.433  -7.577
  425   3HD2  LEU  51          3HD2      LEU  51  -0.010   2.206  -7.487
  426    H    ASP  52           H        ASP  52  -1.515  -2.624  -3.632
  427    HA   ASP  52           HA       ASP  52   0.585  -3.959  -5.021
  428   1HB   ASP  52          2HB       ASP  52  -1.221  -4.735  -3.148
  429   2HB   ASP  52          1HB       ASP  52  -1.942  -5.425  -4.599
  430    H    VAL  53           H        VAL  53   0.390  -2.719  -7.045
  431    HA   VAL  53           HA       VAL  53  -1.790  -2.776  -8.765
  432    HB   VAL  53           HB       VAL  53   0.060  -1.337  -9.274
  433   1HG1  VAL  53          1HG1      VAL  53   2.254  -1.973  -9.624
  434   2HG1  VAL  53          2HG1      VAL  53   1.821  -3.641  -9.995
  435   3HG1  VAL  53          3HG1      VAL  53   1.747  -3.061  -8.333
  436   1HG2  VAL  53          1HG2      VAL  53   0.271  -1.667 -11.596
  437   2HG2  VAL  53          2HG2      VAL  53  -1.286  -2.373 -11.160
  438   3HG2  VAL  53          3HG2      VAL  53   0.108  -3.416 -11.443
  439    H    TRP  54           H        TRP  54  -2.737  -4.872  -8.593
  440    HA   TRP  54           HA       TRP  54  -1.239  -7.148  -9.586
  441   1HB   TRP  54          2HB       TRP  54  -2.740  -7.493  -7.701
  442   2HB   TRP  54          1HB       TRP  54  -4.104  -6.901  -8.641
  443    HD1  TRP  54           HD       TRP  54  -5.605  -8.914  -9.116
  444    HE1  TRP  54           1HE      TRP  54  -5.254 -11.319  -9.959
  445    HE3  TRP  54           3HE      TRP  54  -0.495  -8.969  -9.312
  446    HZ2  TRP  54           2HZ      TRP  54  -3.097 -13.017 -10.617
  447    HZ3  TRP  54           3HZ      TRP  54   0.633 -11.023 -10.058
  448    HH2  TRP  54           HH       TRP  54  -0.641 -13.005 -10.696
  449    H    MET  55           H        MET  55  -4.601  -6.372 -10.411
  450    HA   MET  55           HA       MET  55  -3.862  -6.119 -13.223
  451   1HB   MET  55          2HB       MET  55  -5.447  -7.771 -13.967
  452   2HB   MET  55          1HB       MET  55  -4.356  -8.519 -12.811
  453   1HG   MET  55          2HG       MET  55  -5.992  -8.938 -11.338
  454   2HG   MET  55          1HG       MET  55  -6.814  -7.413 -11.652
  455   1HE   MET  55          1HE       MET  55  -9.278  -8.138 -14.426
  456   2HE   MET  55          2HE       MET  55  -7.794  -7.186 -14.442
  457   3HE   MET  55          3HE       MET  55  -8.857  -7.138 -13.035
  458    HA   PRO  56           HA       PRO  56  -7.476  -3.456 -11.714
  459   1HB   PRO  56          2HB       PRO  56  -6.249  -1.086 -11.380
  460   2HB   PRO  56          1HB       PRO  56  -6.303  -2.298 -10.094
  461   1HG   PRO  56          2HG       PRO  56  -4.086  -1.652 -11.998
  462   2HG   PRO  56          1HG       PRO  56  -4.005  -1.981 -10.258
  463   1HD   PRO  56          2HD       PRO  56  -3.424  -3.840 -12.174
  464   2HD   PRO  56          1HD       PRO  56  -4.039  -4.252 -10.562
  465    H    ASP  57           H        ASP  57  -7.773  -0.977 -12.660
  466    HA   ASP  57           HA       ASP  57  -6.926  -0.987 -15.467
  467   1HB   ASP  57          2HB       ASP  57  -9.785  -0.569 -14.566
  468   2HB   ASP  57          1HB       ASP  57  -9.193  -0.469 -16.223
  469    H    GLY  58           H        GLY  58  -6.100   0.576 -13.151
  470   1HA   GLY  58          2HA       GLY  58  -6.889   3.243 -14.144
  471   2HA   GLY  58          1HA       GLY  58  -6.744   2.911 -12.425
  472    H    ASP  59           H        ASP  59  -5.315   4.958 -13.213
  473    HA   ASP  59           HA       ASP  59  -2.604   4.000 -13.795
  474   1HB   ASP  59          2HB       ASP  59  -3.772   6.790 -13.865
  475   2HB   ASP  59          1HB       ASP  59  -2.088   6.403 -14.204
  476    H    GLY  60           H        GLY  60  -1.932   3.245 -11.809
  477   1HA   GLY  60          2HA       GLY  60  -2.346   4.529  -9.343
  478   2HA   GLY  60          1HA       GLY  60  -1.086   3.353  -9.679
  479    H    VAL  61           H        VAL  61  -0.038   5.143 -11.865
  480    HA   VAL  61           HA       VAL  61   2.027   6.362 -10.498
  481    HB   VAL  61           HB       VAL  61   0.913   7.277 -13.149
  482   1HG1  VAL  61          1HG1      VAL  61   3.761   7.308 -12.203
  483   2HG1  VAL  61          2HG1      VAL  61   2.662   8.670 -11.980
  484   3HG1  VAL  61          3HG1      VAL  61   3.065   8.120 -13.605
  485   1HG2  VAL  61          1HG2      VAL  61   2.650   4.935 -12.436
  486   2HG2  VAL  61          2HG2      VAL  61   2.688   5.666 -14.041
  487   3HG2  VAL  61          3HG2      VAL  61   1.190   4.968 -13.426
  488    H    ASN  62           H        ASN  62  -1.028   7.773 -11.615
  489    HA   ASN  62           HA       ASN  62  -0.363  10.371 -10.548
  490   1HB   ASN  62          2HB       ASN  62  -2.194   9.369 -12.454
  491   2HB   ASN  62          1HB       ASN  62  -3.157  10.107 -11.178
  492   1HD2  ASN  62          1HD2      ASN  62   0.014  10.924 -12.531
  493   2HD2  ASN  62          2HD2      ASN  62  -0.404  12.538 -12.984
  494    H    PHE  63           H        PHE  63  -1.184   7.613  -9.031
  495    HA   PHE  63           HA       PHE  63  -3.137   8.747  -7.202
  496   1HB   PHE  63          2HB       PHE  63  -3.185   6.334  -8.035
  497   2HB   PHE  63          1HB       PHE  63  -1.816   6.047  -6.965
  498    HD1  PHE  63           1HD      PHE  63  -5.155   7.704  -6.771
  499    HD2  PHE  63           2HD      PHE  63  -2.323   5.109  -4.940
  500    HE1  PHE  63           1HE      PHE  63  -6.705   7.342  -4.898
  501    HE2  PHE  63           2HE      PHE  63  -3.871   4.743  -3.062
  502    HZ   PHE  63           HZ       PHE  63  -6.065   5.860  -3.039
  503    H    ILE  64           H        ILE  64   0.212   7.592  -7.157
  504    HA   ILE  64           HA       ILE  64   0.855   7.728  -4.514
  505    HB   ILE  64           HB       ILE  64   2.629   8.829  -6.693
  506   1HG1  ILE  64          2HG1      ILE  64   3.316   6.159  -6.136
  507   2HG1  ILE  64          1HG1      ILE  64   1.563   6.168  -6.309
  508   1HG2  ILE  64          1HG2      ILE  64   4.428   7.906  -5.211
  509   2HG2  ILE  64          2HG2      ILE  64   3.190   7.642  -3.983
  510   3HG2  ILE  64          3HG2      ILE  64   3.544   9.277  -4.542
  511   1HD1  ILE  64          1HD1      ILE  64   3.374   7.435  -8.334
  512   2HD1  ILE  64          2HD1      ILE  64   1.681   6.971  -8.506
  513   3HD1  ILE  64          3HD1      ILE  64   2.927   5.730  -8.392
  514    H    ASP  65           H        ASP  65   0.189  10.413  -6.639
  515    HA   ASP  65           HA       ASP  65   1.309  12.437  -4.985
  516   1HB   ASP  65          2HB       ASP  65   0.791  12.676  -7.440
  517   2HB   ASP  65          1HB       ASP  65  -0.913  12.766  -7.007
  518    H    PHE  66           H        PHE  66  -2.095  11.480  -5.559
  519    HA   PHE  66           HA       PHE  66  -3.328  13.134  -3.755
  520   1HB   PHE  66          2HB       PHE  66  -4.838  11.918  -5.003
  521   2HB   PHE  66          1HB       PHE  66  -3.938  10.417  -4.830
  522    HD1  PHE  66           1HD      PHE  66  -4.238   9.005  -2.885
  523    HD2  PHE  66           2HD      PHE  66  -6.460  12.603  -3.355
  524    HE1  PHE  66           1HE      PHE  66  -5.791   8.269  -1.128
  525    HE2  PHE  66           2HE      PHE  66  -8.020  11.873  -1.597
  526    HZ   PHE  66           HZ       PHE  66  -7.686   9.704  -0.479
  527    H    ILE  67           H        ILE  67  -1.618  10.119  -3.129
  528    HA   ILE  67           HA       ILE  67  -2.361   9.787  -0.443
  529    HB   ILE  67           HB       ILE  67  -0.088   8.814  -2.117
  530   1HG1  ILE  67          2HG1      ILE  67  -0.993   6.623  -1.087
  531   2HG1  ILE  67          1HG1      ILE  67  -2.340   7.608  -0.527
  532   1HG2  ILE  67          1HG2      ILE  67   1.239   9.144  -0.260
  533   2HG2  ILE  67          2HG2      ILE  67   0.624   7.516   0.028
  534   3HG2  ILE  67          3HG2      ILE  67  -0.093   8.890   0.869
  535   1HD1  ILE  67          1HD1      ILE  67  -2.041   8.213  -3.238
  536   2HD1  ILE  67          2HD1      ILE  67  -3.312   7.256  -2.480
  537   3HD1  ILE  67          3HD1      ILE  67  -1.868   6.464  -3.110
  538    H    LYS  68           H        LYS  68   0.394  11.496  -1.913
  539    HA   LYS  68           HA       LYS  68   1.361  12.424   0.634
  540   1HB   LYS  68          2HB       LYS  68   2.069  13.231  -2.195
  541   2HB   LYS  68          1HB       LYS  68   2.899  13.816  -0.759
  542   1HG   LYS  68          2HG       LYS  68   2.739  10.914  -0.863
  543   2HG   LYS  68          1HG       LYS  68   3.586  11.612  -2.245
  544   1HD   LYS  68          2HD       LYS  68   4.208  12.423   0.581
  545   2HD   LYS  68          1HD       LYS  68   4.979  11.032  -0.182
  546   1HE   LYS  68          2HE       LYS  68   6.318  12.319  -1.435
  547   2HE   LYS  68          1HE       LYS  68   5.016  13.437  -1.837
  548   1HZ   LYS  68          1HZ       LYS  68   5.405  14.079   0.698
  549   2HZ   LYS  68          2HZ       LYS  68   6.256  14.810  -0.570
  550   3HZ   LYS  68          3HZ       LYS  68   6.969  13.558   0.319
  551    H    GLU  69           H        GLU  69  -0.964  13.465  -1.671
  552    HA   GLU  69           HA       GLU  69  -0.952  16.240  -1.157
  553   1HB   GLU  69          2HB       GLU  69  -2.045  15.191  -3.116
  554   2HB   GLU  69          1HB       GLU  69  -3.256  14.500  -2.044
  555   1HG   GLU  69          2HG       GLU  69  -3.654  16.967  -1.337
  556   2HG   GLU  69          1HG       GLU  69  -2.854  17.338  -2.864
  557    H    ASN  70           H        ASN  70  -2.974  13.615   0.129
  558    HA   ASN  70           HA       ASN  70  -3.773  15.408   2.321
  559   1HB   ASN  70          2HB       ASN  70  -5.215  12.882   1.537
  560   2HB   ASN  70          1HB       ASN  70  -5.817  14.231   2.497
  561   1HD2  ASN  70          1HD2      ASN  70  -4.650  13.407  -0.736
  562   2HD2  ASN  70          2HD2      ASN  70  -5.654  14.527  -1.580
  563    H    SER  71           H        SER  71  -1.434  13.355   1.882
  564    HA   SER  71           HA       SER  71  -1.373  12.521   4.633
  565   1HB   SER  71          2HB       SER  71  -2.226  10.665   2.569
  566   2HB   SER  71          1HB       SER  71  -0.769  10.094   3.381
  567    HG   SER  71           HG       SER  71  -2.896   9.541   4.344
  568    HA   PRO  72           HA       PRO  72   2.707  13.369   2.532
  569   1HB   PRO  72          2HB       PRO  72   3.102  15.411   4.566
  570   2HB   PRO  72          1HB       PRO  72   3.096  15.583   2.810
  571   1HG   PRO  72          2HG       PRO  72   1.142  16.590   4.407
  572   2HG   PRO  72          1HG       PRO  72   0.862  16.077   2.734
  573   1HD   PRO  72          2HD       PRO  72   0.251  14.640   5.288
  574   2HD   PRO  72          1HD       PRO  72  -0.710  14.752   3.798
  575    H    ASP  73           H        ASP  73   1.596  12.727   5.688
  576    HA   ASP  73           HA       ASP  73   4.275  11.972   6.612
  577   1HB   ASP  73          2HB       ASP  73   2.706  13.462   7.995
  578   2HB   ASP  73          1HB       ASP  73   1.796  11.988   8.308
  579    H    SER  74           H        SER  74   2.688  10.435   4.664
  580    HA   SER  74           HA       SER  74   2.259   7.965   6.210
  581   1HB   SER  74          2HB       SER  74   0.236   8.673   5.072
  582   2HB   SER  74          1HB       SER  74   1.104   8.815   3.544
  583    HG   SER  74           HG       SER  74  -0.177   6.795   4.066
  584    H    VAL  75           H        VAL  75   2.467   6.009   4.491
  585    HA   VAL  75           HA       VAL  75   5.121   6.311   3.249
  586    HB   VAL  75           HB       VAL  75   4.039   3.745   4.419
  587   1HG1  VAL  75          1HG1      VAL  75   6.616   4.593   3.168
  588   2HG1  VAL  75          2HG1      VAL  75   5.686   3.114   2.935
  589   3HG1  VAL  75          3HG1      VAL  75   6.629   3.339   4.407
  590   1HG2  VAL  75          1HG2      VAL  75   4.276   5.232   6.263
  591   2HG2  VAL  75          2HG2      VAL  75   5.825   5.826   5.665
  592   3HG2  VAL  75          3HG2      VAL  75   5.686   4.174   6.265
  593    H    VAL  76           H        VAL  76   5.548   4.754   1.501
  594    HA   VAL  76           HA       VAL  76   3.139   3.864   0.084
  595    HB   VAL  76           HB       VAL  76   5.292   5.143  -1.536
  596   1HG1  VAL  76          1HG1      VAL  76   3.798   4.318  -3.010
  597   2HG1  VAL  76          2HG1      VAL  76   2.945   5.820  -2.664
  598   3HG1  VAL  76          3HG1      VAL  76   2.476   4.332  -1.844
  599   1HG2  VAL  76          1HG2      VAL  76   3.319   6.583   0.182
  600   2HG2  VAL  76          2HG2      VAL  76   3.758   7.254  -1.388
  601   3HG2  VAL  76          3HG2      VAL  76   5.002   6.977  -0.169
  602    H    ILE  77           H        ILE  77   3.806   1.762   0.732
  603    HA   ILE  77           HA       ILE  77   6.325   0.754  -0.330
  604    HB   ILE  77           HB       ILE  77   4.240  -0.820   1.172
  605   1HG1  ILE  77          2HG1      ILE  77   4.937   1.191   2.465
  606   2HG1  ILE  77          1HG1      ILE  77   5.427  -0.320   3.225
  607   1HG2  ILE  77          1HG2      ILE  77   5.697  -2.368   0.319
  608   2HG2  ILE  77          2HG2      ILE  77   6.486  -1.992   1.852
  609   3HG2  ILE  77          3HG2      ILE  77   7.069  -1.261   0.357
  610   1HD1  ILE  77          1HD1      ILE  77   7.199   1.477   1.589
  611   2HD1  ILE  77          2HD1      ILE  77   7.688  -0.019   2.382
  612   3HD1  ILE  77          3HD1      ILE  77   7.177   1.366   3.348
  613    H    VAL  78           H        VAL  78   4.763   1.500  -2.403
  614    HA   VAL  78           HA       VAL  78   2.949  -0.358  -3.422
  615    HB   VAL  78           HB       VAL  78   4.858   1.320  -5.060
  616   1HG1  VAL  78          1HG1      VAL  78   2.134   0.189  -5.698
  617   2HG1  VAL  78          2HG1      VAL  78   3.671  -0.387  -6.339
  618   3HG1  VAL  78          3HG1      VAL  78   3.092   1.225  -6.754
  619   1HG2  VAL  78          1HG2      VAL  78   2.137   2.315  -4.635
  620   2HG2  VAL  78          2HG2      VAL  78   3.677   3.173  -4.610
  621   3HG2  VAL  78          3HG2      VAL  78   3.134   2.294  -3.180
  622    H    ILE  79           H        ILE  79   3.131  -2.248  -4.511
  623    HA   ILE  79           HA       ILE  79   5.819  -3.192  -5.238
  624    HB   ILE  79           HB       ILE  79   3.909  -5.170  -4.076
  625   1HG1  ILE  79          2HG1      ILE  79   5.731  -3.497  -2.343
  626   2HG1  ILE  79          1HG1      ILE  79   3.999  -3.218  -2.485
  627   1HG2  ILE  79          1HG2      ILE  79   5.684  -6.477  -4.342
  628   2HG2  ILE  79          2HG2      ILE  79   6.583  -5.484  -3.195
  629   3HG2  ILE  79          3HG2      ILE  79   6.627  -5.102  -4.916
  630   1HD1  ILE  79          1HD1      ILE  79   3.601  -4.735  -0.938
  631   2HD1  ILE  79          2HD1      ILE  79   5.339  -4.952  -0.735
  632   3HD1  ILE  79          3HD1      ILE  79   4.451  -5.963  -1.875
  633    H    THR  80           H        THR  80   4.593  -5.876  -5.885
  634    HA   THR  80           HA       THR  80   3.754  -6.932  -7.709
  635    HB   THR  80           HB       THR  80   1.757  -5.046  -8.558
  636    HG1  THR  80           1HG      THR  80   1.713  -4.041  -6.655
  637   1HG2  THR  80          1HG2      THR  80   0.241  -6.770  -7.424
  638   2HG2  THR  80          2HG2      THR  80   1.722  -7.696  -7.178
  639   3HG2  THR  80          3HG2      THR  80   1.203  -7.280  -8.811
  640    H    GLY  81           H        GLY  81   2.800  -6.225 -10.118
  641   1HA   GLY  81          2HA       GLY  81   3.224  -4.969 -12.069
  642   2HA   GLY  81          1HA       GLY  81   4.539  -4.157 -11.232
  643    H    HIS  82           H        HIS  82   3.600  -6.902 -13.127
  644    HA   HIS  82           HA       HIS  82   6.126  -8.256 -12.925
  645   1HB   HIS  82          2HB       HIS  82   3.713  -9.156 -13.571
  646   2HB   HIS  82          1HB       HIS  82   4.260  -8.765 -15.198
  647    HD1  HIS  82           1HD      HIS  82   6.171 -10.381 -12.331
  648    HD2  HIS  82           2HD      HIS  82   4.987 -11.157 -16.237
  649    HE1  HIS  82           1HE      HIS  82   7.221 -12.587 -12.926
  650    HE2  HIS  82           2HE      HIS  82   6.561 -12.994 -15.323
  651    H    GLY  83           H        GLY  83   7.224  -8.853 -15.116
  652   1HA   GLY  83          2HA       GLY  83   8.227  -8.185 -17.103
  653   2HA   GLY  83          1HA       GLY  83   7.244  -6.728 -17.078
  654    H    SER  84           H        SER  84   9.194  -5.620 -17.743
  655    HA   SER  84           HA       SER  84  11.544  -5.542 -16.211
  656   1HB   SER  84          2HB       SER  84  10.501  -4.215 -18.522
  657   2HB   SER  84          1HB       SER  84  11.177  -3.001 -17.437
  658    HG   SER  84           HG       SER  84  13.126  -3.804 -17.726
  659    H    VAL  85           H        VAL  85  12.334  -3.458 -15.139
  660    HA   VAL  85           HA       VAL  85  10.378  -2.743 -13.097
  661    HB   VAL  85           HB       VAL  85  13.303  -2.002 -13.175
  662   1HG1  VAL  85          1HG1      VAL  85  11.851  -0.696 -11.661
  663   2HG1  VAL  85          2HG1      VAL  85  13.054  -1.656 -10.799
  664   3HG1  VAL  85          3HG1      VAL  85  11.376  -2.195 -10.864
  665   1HG2  VAL  85          1HG2      VAL  85  11.964  -4.540 -12.469
  666   2HG2  VAL  85          2HG2      VAL  85  13.211  -3.973 -11.359
  667   3HG2  VAL  85          3HG2      VAL  85  13.600  -4.244 -13.057
  668    H    ASP  86           H        ASP  86   9.349  -1.503 -15.034
  669    HA   ASP  86           HA       ASP  86  10.496   1.207 -15.167
  670   1HB   ASP  86          2HB       ASP  86   9.076   1.496 -17.195
  671   2HB   ASP  86          1HB       ASP  86  10.266   0.208 -17.362
  672    H    THR  87           H        THR  87   7.730  -0.666 -14.201
  673    HA   THR  87           HA       THR  87   5.965   1.580 -13.916
  674    HB   THR  87           HB       THR  87   5.419  -1.008 -14.105
  675    HG1  THR  87           1HG      THR  87   3.404  -0.537 -13.134
  676   1HG2  THR  87          1HG2      THR  87   6.575  -1.309 -11.761
  677   2HG2  THR  87          2HG2      THR  87   5.130  -2.221 -12.201
  678   3HG2  THR  87          3HG2      THR  87   4.993  -0.793 -11.176
  679    H    ALA  88           H        ALA  88   8.298  -0.099 -11.965
  680    HA   ALA  88           HA       ALA  88   7.641   0.885  -9.429
  681   1HB   ALA  88          1HB       ALA  88  10.211   0.588  -9.087
  682   2HB   ALA  88          2HB       ALA  88  10.153  -0.122 -10.700
  683   3HB   ALA  88          3HB       ALA  88   9.202  -0.826  -9.394
  684    H    VAL  89           H        VAL  89  10.136   2.030 -11.681
  685    HA   VAL  89           HA       VAL  89  10.773   4.373 -10.301
  686    HB   VAL  89           HB       VAL  89  11.833   5.138 -12.354
  687   1HG1  VAL  89          1HG1      VAL  89  12.148   2.359 -11.404
  688   2HG1  VAL  89          2HG1      VAL  89  13.313   3.682 -11.454
  689   3HG1  VAL  89          3HG1      VAL  89  12.951   2.769 -12.920
  690   1HG2  VAL  89          1HG2      VAL  89  11.147   4.598 -14.408
  691   2HG2  VAL  89          2HG2      VAL  89   9.755   3.829 -13.647
  692   3HG2  VAL  89          3HG2      VAL  89  11.182   2.873 -14.045
  693    H    LYS  90           H        LYS  90   8.084   3.598 -12.329
  694    HA   LYS  90           HA       LYS  90   7.356   6.389 -12.735
  695   1HB   LYS  90          2HB       LYS  90   7.068   4.604 -14.503
  696   2HB   LYS  90          1HB       LYS  90   5.781   3.939 -13.508
  697   1HG   LYS  90          2HG       LYS  90   4.595   6.105 -13.673
  698   2HG   LYS  90          1HG       LYS  90   5.856   6.669 -14.772
  699   1HD   LYS  90          2HD       LYS  90   4.330   4.140 -15.309
  700   2HD   LYS  90          1HD       LYS  90   3.694   5.715 -15.788
  701   1HE   LYS  90          2HE       LYS  90   6.321   5.749 -16.674
  702   2HE   LYS  90          1HE       LYS  90   5.778   4.104 -17.003
  703   1HZ   LYS  90          1HZ       LYS  90   5.389   5.910 -18.764
  704   2HZ   LYS  90          2HZ       LYS  90   4.112   6.410 -17.775
  705   3HZ   LYS  90          3HZ       LYS  90   4.122   4.844 -18.414
  706    H    ALA  91           H        ALA  91   7.485   5.622 -10.057
  707    HA   ALA  91           HA       ALA  91   4.930   6.427  -9.128
  708   1HB   ALA  91          1HB       ALA  91   4.336   4.415  -7.864
  709   2HB   ALA  91          2HB       ALA  91   5.696   3.558  -8.591
  710   3HB   ALA  91          3HB       ALA  91   4.357   4.106  -9.600
  711    H    ILE  92           H        ILE  92   8.019   4.887  -8.374
  712    HA   ILE  92           HA       ILE  92   8.017   5.741  -5.642
  713    HB   ILE  92           HB       ILE  92  10.151   4.772  -5.428
  714   1HG1  ILE  92          2HG1      ILE  92  10.384   4.877  -8.447
  715   2HG1  ILE  92          1HG1      ILE  92  11.269   5.882  -7.306
  716   1HG2  ILE  92          1HG2      ILE  92   9.871   2.630  -6.967
  717   2HG2  ILE  92          2HG2      ILE  92   8.276   3.332  -7.223
  718   3HG2  ILE  92          3HG2      ILE  92   8.814   2.940  -5.592
  719   1HD1  ILE  92          1HD1      ILE  92  12.534   4.047  -6.530
  720   2HD1  ILE  92          2HD1      ILE  92  12.534   3.948  -8.291
  721   3HD1  ILE  92          3HD1      ILE  92  11.486   2.888  -7.348
  722    H    LYS  93           H        LYS  93   9.113   7.050  -8.666
  723    HA   LYS  93           HA       LYS  93  10.894   8.994  -7.604
  724   1HB   LYS  93          2HB       LYS  93  10.131   8.116 -10.151
  725   2HB   LYS  93          1HB       LYS  93   9.646   9.805 -10.093
  726   1HG   LYS  93          2HG       LYS  93  11.772  10.035 -10.862
  727   2HG   LYS  93          1HG       LYS  93  12.075  10.120  -9.126
  728   1HD   LYS  93          2HD       LYS  93  12.237   7.465  -9.475
  729   2HD   LYS  93          1HD       LYS  93  12.752   8.001 -11.076
  730   1HE   LYS  93          2HE       LYS  93  14.714   7.791  -9.756
  731   2HE   LYS  93          1HE       LYS  93  14.394   9.516  -9.927
  732   1HZ   LYS  93          1HZ       LYS  93  14.965   9.052  -7.670
  733   2HZ   LYS  93          2HZ       LYS  93  13.803   7.827  -7.559
  734   3HZ   LYS  93          3HZ       LYS  93  13.320   9.439  -7.720
  735    H    LYS  94           H        LYS  94   7.447   8.875  -8.154
  736    HA   LYS  94           HA       LYS  94   6.894  11.628  -7.978
  737   1HB   LYS  94          2HB       LYS  94   5.386   9.612  -8.666
  738   2HB   LYS  94          1HB       LYS  94   4.978   9.579  -6.957
  739   1HG   LYS  94          2HG       LYS  94   3.352  10.991  -7.580
  740   2HG   LYS  94          1HG       LYS  94   4.634  12.199  -7.482
  741   1HD   LYS  94          2HD       LYS  94   4.996  12.141  -9.821
  742   2HD   LYS  94          1HD       LYS  94   4.023  10.680 -10.006
  743   1HE   LYS  94          2HE       LYS  94   2.631  12.973  -8.801
  744   2HE   LYS  94          1HE       LYS  94   3.126  13.195 -10.479
  745   1HZ   LYS  94          1HZ       LYS  94   2.062  10.753 -10.580
  746   2HZ   LYS  94          2HZ       LYS  94   1.186  12.166 -10.884
  747   3HZ   LYS  94          3HZ       LYS  94   1.110  11.435  -9.359
  748    H    GLY  95           H        GLY  95   7.494   9.186  -5.564
  749   1HA   GLY  95          2HA       GLY  95   8.401  10.511  -3.503
  750   2HA   GLY  95          1HA       GLY  95   6.728  11.037  -3.420
  751    H    ALA  96           H        ALA  96   7.583   7.789  -4.426
  752    HA   ALA  96           HA       ALA  96   6.138   6.748  -2.124
  753   1HB   ALA  96          1HB       ALA  96   5.548   5.050  -3.451
  754   2HB   ALA  96          2HB       ALA  96   7.214   4.755  -3.949
  755   3HB   ALA  96          3HB       ALA  96   6.249   5.979  -4.775
  756    H    TYR  97           H        TYR  97   7.140   4.475  -1.391
  757    HA   TYR  97           HA       TYR  97   9.817   5.141  -0.420
  758   1HB   TYR  97          2HB       TYR  97   7.956   4.540   1.163
  759   2HB   TYR  97          1HB       TYR  97   8.011   2.910   0.506
  760    HD1  TYR  97           1HD      TYR  97   9.549   1.341   1.338
  761    HD2  TYR  97           2HD      TYR  97  10.065   5.463   2.258
  762    HE1  TYR  97           1HE      TYR  97  11.322   0.757   2.938
  763    HE2  TYR  97           2HE      TYR  97  11.839   4.890   3.860
  764    HH   TYR  97           HH       TYR  97  12.289   2.076   5.178
  765    H    GLU  98           H        GLU  98   9.299   4.141  -3.114
  766    HA   GLU  98           HA       GLU  98  10.579   2.934  -4.579
  767   1HB   GLU  98          2HB       GLU  98  12.442   1.810  -3.934
  768   2HB   GLU  98          1HB       GLU  98  12.157   2.689  -2.443
  769   1HG   GLU  98          2HG       GLU  98  10.720   0.481  -1.929
  770   2HG   GLU  98          1HG       GLU  98  11.920  -0.197  -3.029
  771    H    PHE  99           H        PHE  99  10.592   0.755  -5.530
  772    HA   PHE  99           HA       PHE  99   8.028  -0.539  -5.026
  773   1HB   PHE  99          2HB       PHE  99   9.576   0.037  -7.340
  774   2HB   PHE  99          1HB       PHE  99   9.431  -1.712  -7.224
  775    HD1  PHE  99           1HD      PHE  99   7.773  -2.536  -8.562
  776    HD2  PHE  99           2HD      PHE  99   7.150   1.175  -6.574
  777    HE1  PHE  99           1HE      PHE  99   5.514  -2.404  -9.530
  778    HE2  PHE  99           2HE      PHE  99   4.891   1.315  -7.539
  779    HZ   PHE  99           HZ       PHE  99   4.070  -0.475  -9.017
  780    H    LEU 100           H        LEU 100   8.313  -1.877  -3.296
  781    HA   LEU 100           HA       LEU 100  10.541  -3.404  -2.675
  782   1HB   LEU 100          2HB       LEU 100   8.439  -2.904  -1.312
  783   2HB   LEU 100          1HB       LEU 100   7.711  -4.260  -2.146
  784    HG   LEU 100           HG       LEU 100   9.439  -5.747  -1.224
  785   1HD1  LEU 100          1HD1      LEU 100  10.859  -4.884   0.618
  786   2HD1  LEU 100          2HD1      LEU 100  10.348  -3.249   0.198
  787   3HD1  LEU 100          3HD1      LEU 100  11.270  -4.209  -0.960
  788   1HD2  LEU 100          1HD2      LEU 100   8.336  -4.278   1.109
  789   2HD2  LEU 100          2HD2      LEU 100   8.358  -6.009   0.768
  790   3HD2  LEU 100          3HD2      LEU 100   7.214  -4.958  -0.069
  791    H    GLU 101           H        GLU 101  10.786  -5.763  -2.762
  792    HA   GLU 101           HA       GLU 101   9.967  -6.788  -5.387
  793   1HB   GLU 101          2HB       GLU 101  12.216  -7.521  -3.517
  794   2HB   GLU 101          1HB       GLU 101  11.774  -8.528  -4.890
  795   1HG   GLU 101          2HG       GLU 101  13.239  -7.312  -6.036
  796   2HG   GLU 101          1HG       GLU 101  12.005  -6.053  -6.030
  797    H    LYS 102           H        LYS 102   9.968  -7.542  -1.958
  798    HA   LYS 102           HA       LYS 102   9.148  -9.363  -0.799
  799   1HB   LYS 102          2HB       LYS 102   6.659  -9.407  -0.955
  800   2HB   LYS 102          1HB       LYS 102   7.345  -7.813  -0.693
  801   1HG   LYS 102          2HG       LYS 102   5.967  -7.183  -2.327
  802   2HG   LYS 102          1HG       LYS 102   7.166  -7.886  -3.408
  803   1HD   LYS 102          2HD       LYS 102   5.440  -9.954  -2.439
  804   2HD   LYS 102          1HD       LYS 102   4.464  -8.631  -3.080
  805   1HE   LYS 102          2HE       LYS 102   6.783  -9.818  -4.583
  806   2HE   LYS 102          1HE       LYS 102   5.139 -10.440  -4.724
  807   1HZ   LYS 102          1HZ       LYS 102   4.617  -7.942  -5.206
  808   2HZ   LYS 102          2HZ       LYS 102   5.191  -8.952  -6.436
  809   3HZ   LYS 102          3HZ       LYS 102   6.248  -7.888  -5.651
  810    HA   PRO 103           HA       PRO 103   8.924 -12.421  -4.326
  811   1HB   PRO 103          2HB       PRO 103  11.386 -13.455  -4.247
  812   2HB   PRO 103          1HB       PRO 103  11.061 -11.936  -5.092
  813   1HG   PRO 103          2HG       PRO 103  12.251 -12.380  -2.382
  814   2HG   PRO 103          1HG       PRO 103  12.737 -11.232  -3.642
  815   1HD   PRO 103          2HD       PRO 103  11.177 -10.585  -1.461
  816   2HD   PRO 103          1HD       PRO 103  11.188  -9.687  -2.989
  817    H    PHE 104           H        PHE 104   7.832 -12.735  -1.794
  818    HA   PHE 104           HA       PHE 104   7.995 -15.515  -1.415
  819   1HB   PHE 104          2HB       PHE 104   9.816 -13.862   0.213
  820   2HB   PHE 104          1HB       PHE 104   8.860 -15.028   1.120
  821    HD1  PHE 104           1HD      PHE 104  11.944 -14.617  -0.136
  822    HD2  PHE 104           2HD      PHE 104   8.711 -17.368  -0.432
  823    HE1  PHE 104           1HE      PHE 104  13.520 -16.395  -0.774
  824    HE2  PHE 104           2HE      PHE 104  10.282 -19.153  -1.069
  825    HZ   PHE 104           HZ       PHE 104  12.689 -18.667  -1.240
  826    H    SER 105           H        SER 105   5.939 -13.643  -1.751
  827    HA   SER 105           HA       SER 105   3.825 -13.269  -0.989
  828   1HB   SER 105          2HB       SER 105   4.160 -14.683   1.587
  829   2HB   SER 105          1HB       SER 105   2.902 -14.845   0.364
  830    HG   SER 105           HG       SER 105   4.084 -16.297  -0.694
  831    H    VAL 106           H        VAL 106   4.958 -11.113  -0.740
  832    HA   VAL 106           HA       VAL 106   5.523  -9.230   0.426
  833    HB   VAL 106           HB       VAL 106   3.742  -8.286   1.620
  834   1HG1  VAL 106          1HG1      VAL 106   2.764 -10.284  -0.397
  835   2HG1  VAL 106          2HG1      VAL 106   3.077  -8.562  -0.614
  836   3HG1  VAL 106          3HG1      VAL 106   1.696  -9.094   0.347
  837   1HG2  VAL 106          1HG2      VAL 106   1.937 -10.430   2.109
  838   2HG2  VAL 106          2HG2      VAL 106   2.691  -9.335   3.266
  839   3HG2  VAL 106          3HG2      VAL 106   3.496 -10.836   2.822
  840    H    GLU 107           H        GLU 107   6.729 -11.719   1.569
  841    HA   GLU 107           HA       GLU 107   6.718 -11.536   4.388
  842   1HB   GLU 107          2HB       GLU 107   7.616 -13.399   2.751
  843   2HB   GLU 107          1HB       GLU 107   9.126 -12.515   2.927
  844   1HG   GLU 107          2HG       GLU 107   8.297 -12.757   5.514
  845   2HG   GLU 107          1HG       GLU 107   7.742 -14.270   4.799
  846    H    ARG 108           H        ARG 108   9.029 -10.367   1.943
  847    HA   ARG 108           HA       ARG 108  10.729  -9.009   3.723
  848   1HB   ARG 108          2HB       ARG 108  10.267  -9.044   0.809
  849   2HB   ARG 108          1HB       ARG 108  10.935  -7.540   1.428
  850   1HG   ARG 108          2HG       ARG 108  12.776  -8.856   0.805
  851   2HG   ARG 108          1HG       ARG 108  12.702  -8.944   2.565
  852   1HD   ARG 108          2HD       ARG 108  11.660 -11.113   2.458
  853   2HD   ARG 108          1HD       ARG 108  11.545 -11.013   0.702
  854    HE   ARG 108           HE       ARG 108  14.199 -10.767   1.164
  855   1HH1  ARG 108          1HH1      ARG 108  11.804 -13.094   2.177
  856   2HH1  ARG 108          2HH1      ARG 108  12.933 -14.405   2.261
  857   1HH2  ARG 108          1HH2      ARG 108  15.685 -12.490   1.276
  858   2HH2  ARG 108          2HH2      ARG 108  15.135 -14.062   1.751
  859    H    PHE 109           H        PHE 109   7.728  -8.151   2.162
  860    HA   PHE 109           HA       PHE 109   7.698  -5.390   2.652
  861   1HB   PHE 109          2HB       PHE 109   6.039  -6.139   1.183
  862   2HB   PHE 109          1HB       PHE 109   5.591  -7.487   2.215
  863    HD1  PHE 109           1HD      PHE 109   5.298  -3.844   1.756
  864    HD2  PHE 109           2HD      PHE 109   3.880  -7.273   3.839
  865    HE1  PHE 109           1HE      PHE 109   3.406  -2.532   2.619
  866    HE2  PHE 109           2HE      PHE 109   1.984  -5.967   4.703
  867    HZ   PHE 109           HZ       PHE 109   1.744  -3.593   4.094
  868    H    LEU 110           H        LEU 110   6.992  -8.163   4.652
  869    HA   LEU 110           HA       LEU 110   5.732  -6.851   6.801
  870   1HB   LEU 110          2HB       LEU 110   6.316  -9.427   6.158
  871   2HB   LEU 110          1HB       LEU 110   7.413  -9.132   7.493
  872    HG   LEU 110           HG       LEU 110   4.426  -8.719   7.590
  873   1HD1  LEU 110          1HD1      LEU 110   4.471 -10.700   9.067
  874   2HD1  LEU 110          2HD1      LEU 110   6.166 -10.937   8.639
  875   3HD1  LEU 110          3HD1      LEU 110   4.918 -11.056   7.399
  876   1HD2  LEU 110          1HD2      LEU 110   6.556  -7.802   9.268
  877   2HD2  LEU 110          2HD2      LEU 110   5.572  -8.971  10.151
  878   3HD2  LEU 110          3HD2      LEU 110   4.819  -7.547   9.434
  879    H    LEU 111           H        LEU 111   9.116  -7.662   6.167
  880    HA   LEU 111           HA       LEU 111  10.150  -6.681   8.602
  881   1HB   LEU 111          2HB       LEU 111  11.426  -7.137   5.918
  882   2HB   LEU 111          1HB       LEU 111  12.328  -6.626   7.332
  883    HG   LEU 111           HG       LEU 111  11.034  -8.826   8.296
  884   1HD1  LEU 111          1HD1      LEU 111  10.443  -9.062   5.695
  885   2HD1  LEU 111          2HD1      LEU 111  10.697 -10.444   6.759
  886   3HD1  LEU 111          3HD1      LEU 111  12.004  -9.882   5.717
  887   1HD2  LEU 111          1HD2      LEU 111  13.550  -8.026   8.148
  888   2HD2  LEU 111          2HD2      LEU 111  13.614  -9.260   6.891
  889   3HD2  LEU 111          3HD2      LEU 111  13.129  -9.694   8.530
  890    H    THR 112           H        THR 112   9.882  -5.198   5.381
  891    HA   THR 112           HA       THR 112  11.089  -2.742   6.130
  892    HB   THR 112           HB       THR 112   9.175  -3.339   3.863
  893    HG1  THR 112           1HG      THR 112  12.008  -3.242   3.881
  894   1HG2  THR 112          1HG2      THR 112   9.886  -1.393   2.784
  895   2HG2  THR 112          2HG2      THR 112  11.202  -1.135   3.930
  896   3HG2  THR 112          3HG2      THR 112   9.529  -0.895   4.437
  897    H    ILE 113           H        ILE 113   7.752  -3.874   5.961
  898    HA   ILE 113           HA       ILE 113   6.323  -1.581   6.362
  899    HB   ILE 113           HB       ILE 113   5.912  -4.414   7.126
  900   1HG1  ILE 113          2HG1      ILE 113   5.279  -3.430   4.924
  901   2HG1  ILE 113          1HG1      ILE 113   3.928  -4.168   5.779
  902   1HG2  ILE 113          1HG2      ILE 113   4.425  -2.154   8.417
  903   2HG2  ILE 113          2HG2      ILE 113   5.129  -3.590   9.162
  904   3HG2  ILE 113          3HG2      ILE 113   3.677  -3.733   8.172
  905   1HD1  ILE 113          1HD1      ILE 113   4.391  -1.261   6.145
  906   2HD1  ILE 113          2HD1      ILE 113   2.886  -2.177   6.129
  907   3HD1  ILE 113          3HD1      ILE 113   3.716  -1.819   4.615
  908    H    LYS 114           H        LYS 114   7.699  -3.626   8.938
  909    HA   LYS 114           HA       LYS 114   6.917  -2.243  11.160
  910   1HB   LYS 114          2HB       LYS 114   8.342  -4.364  10.988
  911   2HB   LYS 114          1HB       LYS 114   9.723  -3.283  10.879
  912   1HG   LYS 114          2HG       LYS 114   7.781  -3.029  13.136
  913   2HG   LYS 114          1HG       LYS 114   9.046  -4.258  13.175
  914   1HD   LYS 114          2HD       LYS 114   9.458  -1.282  12.875
  915   2HD   LYS 114          1HD       LYS 114   9.770  -2.236  14.324
  916   1HE   LYS 114          2HE       LYS 114  11.231  -3.601  12.505
  917   2HE   LYS 114          1HE       LYS 114  11.346  -1.968  11.851
  918   1HZ   LYS 114          1HZ       LYS 114  12.470  -1.215  13.679
  919   2HZ   LYS 114          2HZ       LYS 114  13.047  -2.804  13.612
  920   3HZ   LYS 114          3HZ       LYS 114  11.834  -2.391  14.715
  921    H    HIS 115           H        HIS 115   9.881  -1.665   9.279
  922    HA   HIS 115           HA       HIS 115  10.784   0.571  10.669
  923   1HB   HIS 115          2HB       HIS 115  11.110  -0.210   7.773
  924   2HB   HIS 115          1HB       HIS 115  11.964   1.139   8.515
  925    HD1  HIS 115           1HD      HIS 115  13.497   0.398  10.667
  926    HD2  HIS 115           2HD      HIS 115  12.405  -2.581   7.983
  927    HE1  HIS 115           1HE      HIS 115  15.094  -1.500  11.083
  928    HE2  HIS 115           2HE      HIS 115  14.364  -3.321   9.501
  929    H    ALA 116           H        ALA 116   8.496   0.307   7.994
  930    HA   ALA 116           HA       ALA 116   8.183   2.988   7.340
  931   1HB   ALA 116          1HB       ALA 116   5.728   1.343   7.385
  932   2HB   ALA 116          2HB       ALA 116   7.080   0.718   6.442
  933   3HB   ALA 116          3HB       ALA 116   6.422   2.315   6.088
  934    H    PHE 117           H        PHE 117   6.966   1.171  10.061
  935    HA   PHE 117           HA       PHE 117   5.242   3.344  10.928
  936   1HB   PHE 117          2HB       PHE 117   5.759   0.551  11.925
  937   2HB   PHE 117          1HB       PHE 117   4.829   1.711  12.869
  938    HD1  PHE 117           1HD      PHE 117   2.874   2.867  11.598
  939    HD2  PHE 117           2HD      PHE 117   4.658  -0.810  10.418
  940    HE1  PHE 117           1HE      PHE 117   0.846   2.294  10.339
  941    HE2  PHE 117           2HE      PHE 117   2.627  -1.391   9.152
  942    HZ   PHE 117           HZ       PHE 117   0.718   0.171   9.112
  943    H    GLU 118           H        GLU 118   7.939   1.466  12.320
  944    HA   GLU 118           HA       GLU 118   8.307   3.133  14.554
  945   1HB   GLU 118          2HB       GLU 118  10.080   1.142  13.178
  946   2HB   GLU 118          1HB       GLU 118  10.627   2.048  14.580
  947   1HG   GLU 118          2HG       GLU 118   8.234   1.097  15.449
  948   2HG   GLU 118          1HG       GLU 118   8.777  -0.210  14.399
  949    H    GLU 119           H        GLU 119  10.093   2.998  11.472
  950    HA   GLU 119           HA       GLU 119  11.748   5.223  12.138
  951   1HB   GLU 119          2HB       GLU 119  11.214   4.072   9.400
  952   2HB   GLU 119          1HB       GLU 119  12.580   5.070   9.876
  953   1HG   GLU 119          2HG       GLU 119  12.744   2.994  11.643
  954   2HG   GLU 119          1HG       GLU 119  12.150   2.203  10.184
  955    H    TYR 120           H        TYR 120   8.532   5.090  11.298
  956    HA   TYR 120           HA       TYR 120   8.605   7.884  10.388
  957   1HB   TYR 120          2HB       TYR 120   7.859   5.778   8.774
  958   2HB   TYR 120          1HB       TYR 120   6.314   6.355   9.391
  959    HD1  TYR 120           1HD      TYR 120   5.674   8.756   9.021
  960    HD2  TYR 120           2HD      TYR 120   9.043   6.984   7.120
  961    HE1  TYR 120           1HE      TYR 120   5.692  10.576   7.366
  962    HE2  TYR 120           2HE      TYR 120   9.069   8.799   5.461
  963    HH   TYR 120           HH       TYR 120   6.539  10.860   4.951
  964    H    SER 121           H        SER 121   8.349   7.234  13.029
  965    HA   SER 121           HA       SER 121   5.478   7.610  13.574
  966   1HB   SER 121          2HB       SER 121   5.834   6.641  15.754
  967   2HB   SER 121          1HB       SER 121   6.544   5.558  14.556
  968    HG   SER 121           HG       SER 121   8.573   6.360  15.084
  Start of MODEL   34
    1   1H    MET   1          1HT       MET   1   1.095   0.531  18.386
    2   2H    MET   1          2HT       MET   1   0.071  -0.535  17.516
    3   3H    MET   1          3HT       MET   1  -0.544   0.348  18.853
    4    HA   MET   1           HA       MET   1  -1.333   1.467  17.045
    5   1HB   MET   1          2HB       MET   1   0.303   2.642  18.841
    6   2HB   MET   1          1HB       MET   1   1.150   3.058  17.358
    7   1HG   MET   1          2HG       MET   1  -0.315   4.643  16.873
    8   2HG   MET   1          1HG       MET   1  -1.672   3.538  17.082
    9   1HE   MET   1          1HE       MET   1  -2.537   2.833  19.469
   10   2HE   MET   1          2HE       MET   1  -2.329   3.795  20.932
   11   3HE   MET   1          3HE       MET   1  -1.006   2.788  20.343
   12    H    LYS   2           H        LYS   2  -1.072   0.017  15.236
   13    HA   LYS   2           HA       LYS   2   0.662   1.131  13.217
   14   1HB   LYS   2          2HB       LYS   2   1.399  -1.254  14.622
   15   2HB   LYS   2          1HB       LYS   2   1.104  -1.625  12.930
   16   1HG   LYS   2          2HG       LYS   2   3.239  -1.023  12.658
   17   2HG   LYS   2          1HG       LYS   2   2.603   0.621  12.715
   18   1HD   LYS   2          2HD       LYS   2   3.364   0.988  14.843
   19   2HD   LYS   2          1HD       LYS   2   3.273  -0.718  15.285
   20   1HE   LYS   2          2HE       LYS   2   5.356   0.632  13.579
   21   2HE   LYS   2          1HE       LYS   2   5.581  -0.108  15.163
   22   1HZ   LYS   2          1HZ       LYS   2   4.713  -2.212  13.926
   23   2HZ   LYS   2          2HZ       LYS   2   6.335  -1.753  13.790
   24   3HZ   LYS   2          3HZ       LYS   2   5.247  -1.392  12.546
   25    H    ARG   3           H        ARG   3  -0.360   1.152  11.321
   26    HA   ARG   3           HA       ARG   3  -2.301  -0.933  10.682
   27   1HB   ARG   3          2HB       ARG   3  -3.098   1.926  10.247
   28   2HB   ARG   3          1HB       ARG   3  -4.113   0.493  10.315
   29   1HG   ARG   3          2HG       ARG   3  -4.610   1.499  12.313
   30   2HG   ARG   3          1HG       ARG   3  -3.322   0.394  12.799
   31   1HD   ARG   3          2HD       ARG   3  -1.861   2.068  13.215
   32   2HD   ARG   3          1HD       ARG   3  -2.462   3.066  11.892
   33    HE   ARG   3           HE       ARG   3  -4.284   2.845  14.108
   34   1HH1  ARG   3          1HH1      ARG   3  -1.572   4.603  12.789
   35   2HH1  ARG   3          2HH1      ARG   3  -1.904   6.041  13.694
   36   1HH2  ARG   3          1HH2      ARG   3  -4.720   4.736  15.301
   37   2HH2  ARG   3          2HH2      ARG   3  -3.689   6.116  15.121
   38    H    VAL   4           H        VAL   4  -2.334  -1.441   8.548
   39    HA   VAL   4           HA       VAL   4  -0.934   0.364   6.693
   40    HB   VAL   4           HB       VAL   4  -0.703  -2.647   6.654
   41   1HG1  VAL   4          1HG1      VAL   4   0.161  -0.472   4.857
   42   2HG1  VAL   4          2HG1      VAL   4  -0.231  -2.154   4.499
   43   3HG1  VAL   4          3HG1      VAL   4   1.346  -1.740   5.171
   44   1HG2  VAL   4          1HG2      VAL   4   1.720  -2.108   7.274
   45   2HG2  VAL   4          2HG2      VAL   4   0.514  -1.983   8.554
   46   3HG2  VAL   4          3HG2      VAL   4   1.116  -0.526   7.766
   47    H    LEU   5           H        LEU   5  -1.643   0.320   4.517
   48    HA   LEU   5           HA       LEU   5  -4.321  -0.860   4.175
   49   1HB   LEU   5          2HB       LEU   5  -4.330   1.579   4.205
   50   2HB   LEU   5          1HB       LEU   5  -3.142   1.613   2.918
   51    HG   LEU   5           HG       LEU   5  -4.878   0.385   1.495
   52   1HD1  LEU   5          1HD1      LEU   5  -7.211   1.353   2.551
   53   2HD1  LEU   5          2HD1      LEU   5  -6.358   0.771   3.979
   54   3HD1  LEU   5          3HD1      LEU   5  -6.667  -0.322   2.630
   55   1HD2  LEU   5          1HD2      LEU   5  -6.250   2.759   1.564
   56   2HD2  LEU   5          2HD2      LEU   5  -4.767   2.456   0.660
   57   3HD2  LEU   5          3HD2      LEU   5  -4.688   3.195   2.259
   58    H    VAL   6           H        VAL   6  -4.830  -1.951   2.332
   59    HA   VAL   6           HA       VAL   6  -2.606  -2.527   0.483
   60    HB   VAL   6           HB       VAL   6  -4.914  -4.361   1.119
   61   1HG1  VAL   6          1HG1      VAL   6  -3.769  -4.610  -1.090
   62   2HG1  VAL   6          2HG1      VAL   6  -3.690  -6.037  -0.056
   63   3HG1  VAL   6          3HG1      VAL   6  -2.285  -4.982  -0.213
   64   1HG2  VAL   6          1HG2      VAL   6  -3.409  -5.634   2.515
   65   2HG2  VAL   6          2HG2      VAL   6  -3.503  -3.974   3.103
   66   3HG2  VAL   6          3HG2      VAL   6  -2.097  -4.503   2.181
   67    H    VAL   7           H        VAL   7  -3.012  -2.579  -1.704
   68    HA   VAL   7           HA       VAL   7  -5.733  -1.931  -2.598
   69    HB   VAL   7           HB       VAL   7  -3.275  -0.624  -3.766
   70   1HG1  VAL   7          1HG1      VAL   7  -6.222  -0.117  -4.118
   71   2HG1  VAL   7          2HG1      VAL   7  -5.110  -0.784  -5.313
   72   3HG1  VAL   7          3HG1      VAL   7  -4.937   0.890  -4.785
   73   1HG2  VAL   7          1HG2      VAL   7  -5.272   0.640  -1.897
   74   2HG2  VAL   7          2HG2      VAL   7  -3.818   1.377  -2.570
   75   3HG2  VAL   7          3HG2      VAL   7  -3.681   0.064  -1.402
   76    H    ASP   8           H        ASP   8  -6.398  -3.420  -4.016
   77    HA   ASP   8           HA       ASP   8  -4.609  -4.348  -6.094
   78   1HB   ASP   8          2HB       ASP   8  -3.980  -5.925  -4.420
   79   2HB   ASP   8          1HB       ASP   8  -5.650  -6.183  -3.930
   80    H    ASP   9           H        ASP   9  -5.773  -5.767  -7.659
   81    HA   ASP   9           HA       ASP   9  -8.452  -4.744  -8.051
   82   1HB   ASP   9          2HB       ASP   9  -6.885  -4.755  -9.934
   83   2HB   ASP   9          1HB       ASP   9  -6.733  -6.505  -9.816
   84    H    GLU  10           H        GLU  10  -8.541  -6.307  -5.879
   85    HA   GLU  10           HA       GLU  10  -9.937  -8.716  -6.830
   86   1HB   GLU  10          2HB       GLU  10  -7.833  -8.437  -4.777
   87   2HB   GLU  10          1HB       GLU  10  -9.208  -9.428  -4.310
   88   1HG   GLU  10          2HG       GLU  10  -7.888  -9.900  -6.940
   89   2HG   GLU  10          1HG       GLU  10  -7.133 -10.498  -5.463
   90    H    GLU  11           H        GLU  11 -11.160  -9.587  -4.622
   91    HA   GLU  11           HA       GLU  11 -13.047  -7.439  -4.066
   92   1HB   GLU  11          2HB       GLU  11 -13.129 -10.391  -4.055
   93   2HB   GLU  11          1HB       GLU  11 -14.098  -9.607  -2.816
   94   1HG   GLU  11          2HG       GLU  11 -14.432  -8.393  -5.433
   95   2HG   GLU  11          1HG       GLU  11 -14.860 -10.103  -5.409
   96    H    SER  12           H        SER  12 -12.081 -10.107  -1.938
   97    HA   SER  12           HA       SER  12 -11.923  -8.216   0.281
   98   1HB   SER  12          2HB       SER  12 -11.550 -10.576   1.491
   99   2HB   SER  12          1HB       SER  12 -13.156  -9.980   1.071
  100    HG   SER  12           HG       SER  12 -12.624 -12.195   0.405
  101    H    ILE  13           H        ILE  13 -10.191  -8.961   1.994
  102    HA   ILE  13           HA       ILE  13  -7.770  -8.079   1.477
  103    HB   ILE  13           HB       ILE  13  -7.825 -10.697   2.918
  104   1HG1  ILE  13          2HG1      ILE  13  -9.790  -9.617   3.776
  105   2HG1  ILE  13          1HG1      ILE  13  -8.513  -9.407   4.969
  106   1HG2  ILE  13          1HG2      ILE  13  -5.679  -9.762   2.805
  107   2HG2  ILE  13          2HG2      ILE  13  -6.269  -9.393   4.426
  108   3HG2  ILE  13          3HG2      ILE  13  -6.274  -8.145   3.180
  109   1HD1  ILE  13          1HD1      ILE  13  -8.238  -7.144   4.429
  110   2HD1  ILE  13          2HD1      ILE  13  -9.981  -7.407   4.485
  111   3HD1  ILE  13          3HD1      ILE  13  -9.154  -7.305   2.931
  112    H    THR  14           H        THR  14  -5.691  -8.912   1.004
  113    HA   THR  14           HA       THR  14  -5.725 -10.756  -1.247
  114    HB   THR  14           HB       THR  14  -3.601  -9.902  -1.831
  115    HG1  THR  14           1HG      THR  14  -3.405  -8.703   0.726
  116   1HG2  THR  14          1HG2      THR  14  -3.751  -7.420  -1.584
  117   2HG2  THR  14          2HG2      THR  14  -5.194  -7.672  -0.600
  118   3HG2  THR  14          3HG2      THR  14  -5.175  -8.188  -2.286
  119    H    SER  15           H        SER  15  -5.128 -12.823  -1.083
  120    HA   SER  15           HA       SER  15  -4.699 -14.182   1.239
  121   1HB   SER  15          2HB       SER  15  -4.895 -14.932  -1.336
  122   2HB   SER  15          1HB       SER  15  -3.169 -15.196  -1.092
  123    HG   SER  15           HG       SER  15  -5.218 -16.237   0.573
  124    H    SER  16           H        SER  16  -2.993 -14.830   2.478
  125    HA   SER  16           HA       SER  16  -0.821 -15.052   3.210
  126   1HB   SER  16          2HB       SER  16   0.235 -13.116   1.180
  127   2HB   SER  16          1HB       SER  16   1.031 -14.503   1.924
  128    HG   SER  16           HG       SER  16   0.523 -15.384   0.066
  129    H    LEU  17           H        LEU  17  -2.045 -11.868   2.285
  130    HA   LEU  17           HA       LEU  17  -0.449 -10.434   4.162
  131   1HB   LEU  17          2HB       LEU  17  -2.465  -9.843   2.175
  132   2HB   LEU  17          1HB       LEU  17  -2.786  -8.952   3.645
  133    HG   LEU  17           HG       LEU  17  -1.070  -8.225   1.573
  134   1HD1  LEU  17          1HD1      LEU  17  -1.067  -6.232   2.631
  135   2HD1  LEU  17          2HD1      LEU  17  -0.708  -6.939   4.206
  136   3HD1  LEU  17          3HD1      LEU  17  -2.350  -7.002   3.565
  137   1HD2  LEU  17          1HD2      LEU  17   1.128  -8.124   2.442
  138   2HD2  LEU  17          2HD2      LEU  17   0.602  -9.800   2.598
  139   3HD2  LEU  17          3HD2      LEU  17   0.613  -8.743   4.011
  140    H    SER  18           H        SER  18  -3.826 -11.526   4.151
  141    HA   SER  18           HA       SER  18  -4.671 -10.500   6.562
  142   1HB   SER  18          2HB       SER  18  -6.086 -12.707   6.639
  143   2HB   SER  18          1HB       SER  18  -6.356 -11.539   5.345
  144    HG   SER  18           HG       SER  18  -6.152 -13.690   4.565
  145    H    ALA  19           H        ALA  19  -3.536 -13.863   6.156
  146    HA   ALA  19           HA       ALA  19  -3.335 -14.559   8.805
  147   1HB   ALA  19          1HB       ALA  19  -2.904 -15.913   6.608
  148   2HB   ALA  19          2HB       ALA  19  -2.151 -16.407   8.125
  149   3HB   ALA  19          3HB       ALA  19  -1.219 -15.505   6.930
  150    H    ILE  20           H        ILE  20  -0.925 -12.881   6.827
  151    HA   ILE  20           HA       ILE  20   1.141 -12.861   8.740
  152    HB   ILE  20           HB       ILE  20   0.560 -11.081   6.379
  153   1HG1  ILE  20          2HG1      ILE  20   2.817 -13.027   6.817
  154   2HG1  ILE  20          1HG1      ILE  20   1.279 -13.495   6.102
  155   1HG2  ILE  20          1HG2      ILE  20   2.633 -10.787   8.481
  156   2HG2  ILE  20          2HG2      ILE  20   1.810  -9.558   7.521
  157   3HG2  ILE  20          3HG2      ILE  20   3.114 -10.507   6.808
  158   1HD1  ILE  20          1HD1      ILE  20   3.539 -12.363   4.843
  159   2HD1  ILE  20          2HD1      ILE  20   2.219 -11.198   4.736
  160   3HD1  ILE  20          3HD1      ILE  20   2.002 -12.838   4.125
  161    H    LEU  21           H        LEU  21  -0.781 -10.028   7.726
  162    HA   LEU  21           HA       LEU  21  -0.121  -8.346   9.789
  163   1HB   LEU  21          2HB       LEU  21  -2.839  -8.559   8.504
  164   2HB   LEU  21          1HB       LEU  21  -2.175  -7.149   9.312
  165    HG   LEU  21           HG       LEU  21  -0.450  -8.097   7.171
  166   1HD1  LEU  21          1HD1      LEU  21  -1.845  -8.334   5.474
  167   2HD1  LEU  21          2HD1      LEU  21  -2.617  -6.790   5.835
  168   3HD1  LEU  21          3HD1      LEU  21  -3.191  -8.266   6.610
  169   1HD2  LEU  21          1HD2      LEU  21  -1.584  -5.565   8.205
  170   2HD2  LEU  21          2HD2      LEU  21  -1.038  -5.590   6.529
  171   3HD2  LEU  21          3HD2      LEU  21   0.084  -5.994   7.828
  172    H    GLU  22           H        GLU  22  -2.372 -11.017   9.807
  173    HA   GLU  22           HA       GLU  22  -3.659 -10.376  12.254
  174   1HB   GLU  22          2HB       GLU  22  -4.335 -12.029  10.344
  175   2HB   GLU  22          1HB       GLU  22  -3.391 -13.182  11.276
  176   1HG   GLU  22          2HG       GLU  22  -5.066 -11.867  13.100
  177   2HG   GLU  22          1HG       GLU  22  -6.058 -12.258  11.695
  178    H    GLU  23           H        GLU  23  -0.710 -12.036  11.405
  179    HA   GLU  23           HA       GLU  23  -0.341 -13.185  14.024
  180   1HB   GLU  23          2HB       GLU  23   0.606 -14.451  12.279
  181   2HB   GLU  23          1HB       GLU  23   1.317 -13.036  11.518
  182   1HG   GLU  23          2HG       GLU  23   3.185 -13.194  12.710
  183   2HG   GLU  23          1HG       GLU  23   2.311 -13.496  14.210
  184    H    GLU  24           H        GLU  24   0.714 -10.365  12.239
  185    HA   GLU  24           HA       GLU  24   2.656  -9.552  14.181
  186   1HB   GLU  24          2HB       GLU  24   1.403  -8.094  11.856
  187   2HB   GLU  24          1HB       GLU  24   2.684  -7.428  12.859
  188   1HG   GLU  24          2HG       GLU  24   2.836  -9.851  11.085
  189   2HG   GLU  24          1HG       GLU  24   3.645  -8.302  10.855
  190    H    GLY  25           H        GLY  25  -0.691  -8.730  13.448
  191   1HA   GLY  25          2HA       GLY  25  -2.242  -8.017  15.086
  192   2HA   GLY  25          1HA       GLY  25  -0.898  -7.477  16.079
  193    H    TYR  26           H        TYR  26  -1.610  -6.791  12.686
  194    HA   TYR  26           HA       TYR  26  -1.471  -3.924  13.296
  195   1HB   TYR  26          2HB       TYR  26  -1.024  -5.549  10.812
  196   2HB   TYR  26          1HB       TYR  26  -1.356  -3.828  10.698
  197    HD1  TYR  26           1HD      TYR  26   0.487  -2.511  10.425
  198    HD2  TYR  26           2HD      TYR  26   0.853  -6.046  12.759
  199    HE1  TYR  26           1HE      TYR  26   2.867  -2.020  10.777
  200    HE2  TYR  26           2HE      TYR  26   3.236  -5.563  13.121
  201    HH   TYR  26           HH       TYR  26   5.007  -3.587  11.345
  202    H    HIS  27           H        HIS  27  -2.743  -2.743  11.344
  203    HA   HIS  27           HA       HIS  27  -5.514  -3.733  11.431
  204   1HB   HIS  27          2HB       HIS  27  -4.477  -1.274  12.392
  205   2HB   HIS  27          1HB       HIS  27  -5.385  -0.897  10.932
  206    HD1  HIS  27           1HD      HIS  27  -7.930  -1.156  11.020
  207    HD2  HIS  27           2HD      HIS  27  -6.018  -2.280  14.534
  208    HE1  HIS  27           1HE      HIS  27  -9.758  -1.415  12.727
  209    HE2  HIS  27           2HE      HIS  27  -8.568  -2.006  14.868
  210    HA   PRO  28           HA       PRO  28  -4.177  -3.432   7.057
  211   1HB   PRO  28          2HB       PRO  28  -4.826  -5.908   6.290
  212   2HB   PRO  28          1HB       PRO  28  -3.345  -5.573   7.193
  213   1HG   PRO  28          2HG       PRO  28  -5.929  -6.715   8.149
  214   2HG   PRO  28          1HG       PRO  28  -4.273  -7.142   8.612
  215   1HD   PRO  28          2HD       PRO  28  -5.976  -5.486  10.059
  216   2HD   PRO  28          1HD       PRO  28  -4.213  -5.544  10.236
  217    H    ASP  29           H        ASP  29  -5.404  -2.601   5.545
  218    HA   ASP  29           HA       ASP  29  -8.215  -3.423   5.318
  219   1HB   ASP  29          2HB       ASP  29  -8.144  -1.211   6.401
  220   2HB   ASP  29          1HB       ASP  29  -7.143  -0.598   5.090
  221    H    THR  30           H        THR  30  -8.784  -3.940   3.239
  222    HA   THR  30           HA       THR  30  -6.811  -3.268   1.157
  223    HB   THR  30           HB       THR  30  -7.164  -5.382   0.127
  224    HG1  THR  30           1HG      THR  30  -9.333  -5.601   1.920
  225   1HG2  THR  30          1HG2      THR  30  -6.083  -6.704   1.575
  226   2HG2  THR  30          2HG2      THR  30  -7.245  -6.420   2.870
  227   3HG2  THR  30          3HG2      THR  30  -5.990  -5.229   2.537
  228    H    ALA  31           H        ALA  31  -7.487  -2.519  -0.760
  229    HA   ALA  31           HA       ALA  31 -10.372  -2.007  -1.055
  230   1HB   ALA  31          1HB       ALA  31  -9.918   0.087  -1.714
  231   2HB   ALA  31          2HB       ALA  31  -8.583  -0.429  -2.744
  232   3HB   ALA  31          3HB       ALA  31  -8.321  -0.184  -1.017
  233    H    LYS  32           H        LYS  32 -10.366  -1.294  -3.749
  234    HA   LYS  32           HA       LYS  32  -9.589  -3.831  -5.028
  235   1HB   LYS  32          2HB       LYS  32 -11.833  -2.158  -6.089
  236   2HB   LYS  32          1HB       LYS  32 -11.563  -3.888  -6.249
  237   1HG   LYS  32          2HG       LYS  32 -12.224  -4.261  -3.974
  238   2HG   LYS  32          1HG       LYS  32 -12.325  -2.524  -3.679
  239   1HD   LYS  32          2HD       LYS  32 -14.211  -2.300  -5.091
  240   2HD   LYS  32          1HD       LYS  32 -13.987  -3.915  -5.767
  241   1HE   LYS  32          2HE       LYS  32 -14.668  -4.954  -3.752
  242   2HE   LYS  32          1HE       LYS  32 -14.577  -3.436  -2.857
  243   1HZ   LYS  32          1HZ       LYS  32 -16.597  -4.281  -4.840
  244   2HZ   LYS  32          2HZ       LYS  32 -16.379  -2.649  -4.451
  245   3HZ   LYS  32          3HZ       LYS  32 -16.833  -3.750  -3.251
  246    H    THR  33           H        THR  33  -9.547  -0.374  -5.204
  247    HA   THR  33           HA       THR  33  -7.532  -0.419  -7.225
  248    HB   THR  33           HB       THR  33  -9.902   1.182  -8.072
  249    HG1  THR  33           1HG      THR  33  -9.629  -1.568  -8.694
  250   1HG2  THR  33          1HG2      THR  33  -7.436   0.226  -9.256
  251   2HG2  THR  33          2HG2      THR  33  -8.498   1.544  -9.750
  252   3HG2  THR  33          3HG2      THR  33  -8.850  -0.107 -10.256
  253    H    LEU  34           H        LEU  34  -7.064   1.969  -7.914
  254    HA   LEU  34           HA       LEU  34  -6.426   3.400  -5.600
  255   1HB   LEU  34          2HB       LEU  34  -6.701   4.524  -8.388
  256   2HB   LEU  34          1HB       LEU  34  -5.755   5.200  -7.074
  257    HG   LEU  34           HG       LEU  34  -5.171   2.466  -8.181
  258   1HD1  LEU  34          1HD1      LEU  34  -3.311   3.746  -9.425
  259   2HD1  LEU  34          2HD1      LEU  34  -4.373   5.142  -9.250
  260   3HD1  LEU  34          3HD1      LEU  34  -4.932   3.712 -10.119
  261   1HD2  LEU  34          1HD2      LEU  34  -4.228   3.800  -5.975
  262   2HD2  LEU  34          2HD2      LEU  34  -3.003   4.150  -7.195
  263   3HD2  LEU  34          3HD2      LEU  34  -3.409   2.478  -6.807
  264    H    ARG  35           H        ARG  35  -9.273   3.429  -7.598
  265    HA   ARG  35           HA       ARG  35 -10.340   5.896  -6.670
  266   1HB   ARG  35          2HB       ARG  35 -11.374   3.541  -8.172
  267   2HB   ARG  35          1HB       ARG  35 -12.557   4.584  -7.394
  268   1HG   ARG  35          2HG       ARG  35 -10.436   5.614  -9.258
  269   2HG   ARG  35          1HG       ARG  35 -12.039   5.107  -9.795
  270   1HD   ARG  35          2HD       ARG  35 -12.408   6.839  -7.594
  271   2HD   ARG  35          1HD       ARG  35 -11.225   7.599  -8.657
  272    HE   ARG  35           HE       ARG  35 -13.171   6.826 -10.364
  273   1HH1  ARG  35          1HH1      ARG  35 -13.198   8.665  -7.398
  274   2HH1  ARG  35          2HH1      ARG  35 -14.570   9.618  -7.854
  275   1HH2  ARG  35          1HH2      ARG  35 -14.976   8.079 -10.966
  276   2HH2  ARG  35          2HH2      ARG  35 -15.580   9.285  -9.879
  277    H    GLU  36           H        GLU  36 -10.859   2.504  -5.764
  278    HA   GLU  36           HA       GLU  36 -12.707   3.014  -3.692
  279   1HB   GLU  36          2HB       GLU  36 -11.675   0.757  -4.909
  280   2HB   GLU  36          1HB       GLU  36 -11.013   0.661  -3.283
  281   1HG   GLU  36          2HG       GLU  36 -12.938  -0.369  -2.814
  282   2HG   GLU  36          1HG       GLU  36 -13.588   1.267  -2.737
  283    H    ALA  37           H        ALA  37  -9.197   2.907  -3.818
  284    HA   ALA  37           HA       ALA  37  -8.719   2.901  -1.033
  285   1HB   ALA  37          1HB       ALA  37  -6.779   4.338  -2.722
  286   2HB   ALA  37          2HB       ALA  37  -7.137   2.682  -3.214
  287   3HB   ALA  37          3HB       ALA  37  -6.535   3.008  -1.589
  288    H    GLU  38           H        GLU  38  -8.743   5.591  -3.385
  289    HA   GLU  38           HA       GLU  38  -8.291   7.683  -1.647
  290   1HB   GLU  38          2HB       GLU  38 -10.096   7.620  -4.068
  291   2HB   GLU  38          1HB       GLU  38  -9.572   9.089  -3.257
  292   1HG   GLU  38          2HG       GLU  38  -7.378   8.851  -3.962
  293   2HG   GLU  38          1HG       GLU  38  -7.569   7.130  -4.294
  294    H    LYS  39           H        LYS  39 -11.301   5.981  -2.327
  295    HA   LYS  39           HA       LYS  39 -13.046   7.670  -0.915
  296   1HB   LYS  39          2HB       LYS  39 -13.877   5.929  -2.402
  297   2HB   LYS  39          1HB       LYS  39 -13.185   4.682  -1.373
  298   1HG   LYS  39          2HG       LYS  39 -15.090   6.543  -0.096
  299   2HG   LYS  39          1HG       LYS  39 -15.751   5.407  -1.273
  300   1HD   LYS  39          2HD       LYS  39 -14.672   3.557  -0.035
  301   2HD   LYS  39          1HD       LYS  39 -14.118   4.720   1.171
  302   1HE   LYS  39          2HE       LYS  39 -17.020   4.563   0.485
  303   2HE   LYS  39          1HE       LYS  39 -16.313   3.362   1.563
  304   1HZ   LYS  39          1HZ       LYS  39 -16.045   4.862   3.205
  305   2HZ   LYS  39          2HZ       LYS  39 -17.302   5.668   2.410
  306   3HZ   LYS  39          3HZ       LYS  39 -15.698   6.142   2.154
  307    H    LYS  40           H        LYS  40 -11.111   4.893   0.098
  308    HA   LYS  40           HA       LYS  40 -11.993   4.955   2.814
  309   1HB   LYS  40          2HB       LYS  40  -9.923   3.490   1.265
  310   2HB   LYS  40          1HB       LYS  40  -9.759   3.548   3.015
  311   1HG   LYS  40          2HG       LYS  40 -12.418   2.809   1.981
  312   2HG   LYS  40          1HG       LYS  40 -11.120   1.643   1.718
  313   1HD   LYS  40          2HD       LYS  40 -10.959   1.137   3.913
  314   2HD   LYS  40          1HD       LYS  40 -11.253   2.801   4.421
  315   1HE   LYS  40          2HE       LYS  40 -13.647   2.502   3.911
  316   2HE   LYS  40          1HE       LYS  40 -13.328   0.821   3.490
  317   1HZ   LYS  40          1HZ       LYS  40 -14.097   1.560   5.898
  318   2HZ   LYS  40          2HZ       LYS  40 -12.426   1.716   6.114
  319   3HZ   LYS  40          3HZ       LYS  40 -13.086   0.229   5.644
  320    H    ILE  41           H        ILE  41  -9.057   6.009   1.131
  321    HA   ILE  41           HA       ILE  41  -7.748   7.027   3.423
  322    HB   ILE  41           HB       ILE  41  -7.351   7.879   0.555
  323   1HG1  ILE  41          2HG1      ILE  41  -5.882   5.731   2.097
  324   2HG1  ILE  41          1HG1      ILE  41  -7.175   5.404   0.948
  325   1HG2  ILE  41          1HG2      ILE  41  -5.949   8.443   3.087
  326   2HG2  ILE  41          2HG2      ILE  41  -6.066   9.404   1.613
  327   3HG2  ILE  41          3HG2      ILE  41  -4.926   8.061   1.702
  328   1HD1  ILE  41          1HD1      ILE  41  -5.827   6.463  -0.819
  329   2HD1  ILE  41          2HD1      ILE  41  -5.043   5.056  -0.100
  330   3HD1  ILE  41          3HD1      ILE  41  -4.520   6.681   0.346
  331    H    LYS  42           H        LYS  42 -10.332   8.245   1.526
  332    HA   LYS  42           HA       LYS  42  -9.953  11.006   1.799
  333   1HB   LYS  42          2HB       LYS  42 -11.972   9.273   0.837
  334   2HB   LYS  42          1HB       LYS  42 -12.731  10.415   1.937
  335   1HG   LYS  42          2HG       LYS  42 -10.844  11.508  -0.064
  336   2HG   LYS  42          1HG       LYS  42 -12.401  10.917  -0.648
  337   1HD   LYS  42          2HD       LYS  42 -13.566  12.571   0.379
  338   2HD   LYS  42          1HD       LYS  42 -12.460  12.643   1.752
  339   1HE   LYS  42          2HE       LYS  42 -12.003  14.646   0.732
  340   2HE   LYS  42          1HE       LYS  42 -10.798  13.607  -0.027
  341   1HZ   LYS  42          1HZ       LYS  42 -13.449  14.052  -1.258
  342   2HZ   LYS  42          2HZ       LYS  42 -12.029  13.492  -1.987
  343   3HZ   LYS  42          3HZ       LYS  42 -12.163  15.116  -1.527
  344    H    GLU  43           H        GLU  43 -10.793   8.625   4.115
  345    HA   GLU  43           HA       GLU  43 -11.325  10.741   6.077
  346   1HB   GLU  43          2HB       GLU  43 -12.667   8.040   6.122
  347   2HB   GLU  43          1HB       GLU  43 -13.015   9.424   7.149
  348   1HG   GLU  43          2HG       GLU  43 -13.983  10.625   5.348
  349   2HG   GLU  43          1HG       GLU  43 -13.407   9.447   4.170
  350    H    LEU  44           H        LEU  44 -10.460   7.310   5.698
  351    HA   LEU  44           HA       LEU  44  -9.248   7.118   8.268
  352   1HB   LEU  44          2HB       LEU  44  -9.803   5.376   6.038
  353   2HB   LEU  44          1HB       LEU  44  -8.168   5.115   6.616
  354    HG   LEU  44           HG       LEU  44  -9.767   3.588   7.674
  355   1HD1  LEU  44          1HD1      LEU  44  -7.952   3.893   9.053
  356   2HD1  LEU  44          2HD1      LEU  44  -9.276   4.382  10.111
  357   3HD1  LEU  44          3HD1      LEU  44  -8.293   5.605   9.305
  358   1HD2  LEU  44          1HD2      LEU  44 -11.790   4.793   7.689
  359   2HD2  LEU  44          2HD2      LEU  44 -11.070   6.149   8.556
  360   3HD2  LEU  44          3HD2      LEU  44 -11.336   4.615   9.385
  361    H    PHE  45           H        PHE  45  -7.388   8.007   8.854
  362    HA   PHE  45           HA       PHE  45  -5.494   8.922   6.869
  363   1HB   PHE  45          2HB       PHE  45  -6.108  10.226   8.947
  364   2HB   PHE  45          1HB       PHE  45  -5.206   9.033   9.874
  365    HD1  PHE  45           1HD      PHE  45  -4.842  11.447   7.074
  366    HD2  PHE  45           2HD      PHE  45  -2.930   9.299  10.210
  367    HE1  PHE  45           1HE      PHE  45  -2.769  12.709   6.667
  368    HE2  PHE  45           2HE      PHE  45  -0.853  10.557   9.809
  369    HZ   PHE  45           HZ       PHE  45  -0.770  12.264   8.036
  370    H    PHE  46           H        PHE  46  -5.257   6.539   6.236
  371    HA   PHE  46           HA       PHE  46  -3.893   4.698   7.823
  372   1HB   PHE  46          2HB       PHE  46  -4.117   5.078   4.852
  373   2HB   PHE  46          1HB       PHE  46  -3.099   3.807   5.519
  374    HD1  PHE  46           1HD      PHE  46  -6.420   4.785   4.633
  375    HD2  PHE  46           2HD      PHE  46  -4.169   2.081   7.028
  376    HE1  PHE  46           1HE      PHE  46  -8.383   3.313   4.810
  377    HE2  PHE  46           2HE      PHE  46  -6.128   0.603   7.206
  378    HZ   PHE  46           HZ       PHE  46  -8.239   1.220   6.099
  379    HA   PRO  47           HA       PRO  47   0.175   6.526   7.830
  380   1HB   PRO  47          2HB       PRO  47   1.381   4.305   9.055
  381   2HB   PRO  47          1HB       PRO  47   0.693   5.708   9.869
  382   1HG   PRO  47          2HG       PRO  47  -0.274   3.043   9.902
  383   2HG   PRO  47          1HG       PRO  47  -1.025   4.471  10.623
  384   1HD   PRO  47          2HD       PRO  47  -1.695   3.060   8.131
  385   2HD   PRO  47          1HD       PRO  47  -2.685   4.149   9.116
  386    H    VAL  48           H        VAL  48  -0.313   3.202   6.754
  387    HA   VAL  48           HA       VAL  48   1.845   3.580   4.790
  388    HB   VAL  48           HB       VAL  48   1.146   0.941   6.071
  389   1HG1  VAL  48          1HG1      VAL  48   3.008   1.831   3.966
  390   2HG1  VAL  48          2HG1      VAL  48   2.231   0.266   4.209
  391   3HG1  VAL  48          3HG1      VAL  48   3.664   0.695   5.145
  392   1HG2  VAL  48          1HG2      VAL  48   2.028   2.197   7.836
  393   2HG2  VAL  48          2HG2      VAL  48   3.206   2.995   6.795
  394   3HG2  VAL  48          3HG2      VAL  48   3.405   1.292   7.206
  395    H    ILE  49           H        ILE  49   1.381   3.053   2.727
  396    HA   ILE  49           HA       ILE  49  -1.128   1.618   2.169
  397    HB   ILE  49           HB       ILE  49  -0.391   3.877   0.371
  398   1HG1  ILE  49          2HG1      ILE  49  -0.326   4.796   2.718
  399   2HG1  ILE  49          1HG1      ILE  49  -1.533   5.531   1.671
  400   1HG2  ILE  49          1HG2      ILE  49  -2.774   2.266   1.048
  401   2HG2  ILE  49          2HG2      ILE  49  -2.197   2.843  -0.515
  402   3HG2  ILE  49          3HG2      ILE  49  -3.049   3.941   0.571
  403   1HD1  ILE  49          1HD1      ILE  49  -2.099   4.844   4.129
  404   2HD1  ILE  49          2HD1      ILE  49  -2.348   3.260   3.399
  405   3HD1  ILE  49          3HD1      ILE  49  -3.280   4.645   2.835
  406    H    VAL  50           H        VAL  50  -0.337  -0.241   1.214
  407    HA   VAL  50           HA       VAL  50   1.774   0.055  -0.800
  408    HB   VAL  50           HB       VAL  50   0.736  -2.499   0.426
  409   1HG1  VAL  50          1HG1      VAL  50   3.282  -2.982  -0.343
  410   2HG1  VAL  50          2HG1      VAL  50   2.784  -1.817  -1.571
  411   3HG1  VAL  50          3HG1      VAL  50   1.866  -3.306  -1.344
  412   1HG2  VAL  50          1HG2      VAL  50   3.244  -2.112   1.461
  413   2HG2  VAL  50          2HG2      VAL  50   1.728  -1.807   2.311
  414   3HG2  VAL  50          3HG2      VAL  50   2.563  -0.485   1.493
  415    H    LEU  51           H        LEU  51   1.360  -0.297  -2.901
  416    HA   LEU  51           HA       LEU  51  -1.372  -1.053  -3.643
  417   1HB   LEU  51          2HB       LEU  51  -0.611   1.053  -4.544
  418   2HB   LEU  51          1HB       LEU  51   0.828   0.297  -5.203
  419    HG   LEU  51           HG       LEU  51  -0.889  -1.143  -6.561
  420   1HD1  LEU  51          1HD1      LEU  51  -2.798   0.591  -7.141
  421   2HD1  LEU  51          2HD1      LEU  51  -2.533   1.070  -5.464
  422   3HD1  LEU  51          3HD1      LEU  51  -2.979  -0.592  -5.847
  423   1HD2  LEU  51          1HD2      LEU  51   0.482   0.106  -7.885
  424   2HD2  LEU  51          2HD2      LEU  51   0.126   1.607  -7.030
  425   3HD2  LEU  51          3HD2      LEU  51  -1.042   0.948  -8.175
  426    H    ASP  52           H        ASP  52  -1.807  -2.653  -5.145
  427    HA   ASP  52           HA       ASP  52   0.425  -4.427  -5.867
  428   1HB   ASP  52          2HB       ASP  52  -1.354  -5.101  -3.946
  429   2HB   ASP  52          1HB       ASP  52  -2.209  -5.692  -5.367
  430    H    VAL  53           H        VAL  53   0.592  -4.178  -8.005
  431    HA   VAL  53           HA       VAL  53  -1.703  -3.643  -9.661
  432    HB   VAL  53           HB       VAL  53   1.118  -4.243 -10.550
  433   1HG1  VAL  53          1HG1      VAL  53  -0.227  -4.380 -12.439
  434   2HG1  VAL  53          2HG1      VAL  53   0.320  -2.704 -12.458
  435   3HG1  VAL  53          3HG1      VAL  53  -1.302  -3.095 -11.888
  436   1HG2  VAL  53          1HG2      VAL  53   1.782  -2.165 -10.028
  437   2HG2  VAL  53          2HG2      VAL  53   0.414  -2.171  -8.916
  438   3HG2  VAL  53          3HG2      VAL  53   0.247  -1.449 -10.516
  439    H    TRP  54           H        TRP  54  -2.729  -5.748  -8.938
  440    HA   TRP  54           HA       TRP  54  -1.699  -8.200  -9.978
  441   1HB   TRP  54          2HB       TRP  54  -3.141  -8.356  -8.086
  442   2HB   TRP  54          1HB       TRP  54  -4.390  -7.395  -8.868
  443    HD1  TRP  54           HD       TRP  54  -6.339  -9.100  -8.890
  444    HE1  TRP  54           1HE      TRP  54  -6.708 -11.411  -9.959
  445    HE3  TRP  54           3HE      TRP  54  -1.559 -10.054 -10.448
  446    HZ2  TRP  54           2HZ      TRP  54  -5.181 -13.376 -11.287
  447    HZ3  TRP  54           3HZ      TRP  54  -1.101 -12.171 -11.610
  448    HH2  TRP  54           HH       TRP  54  -2.874 -13.799 -12.020
  449    H    MET  55           H        MET  55  -4.877  -6.826 -10.772
  450    HA   MET  55           HA       MET  55  -4.232  -6.822 -13.601
  451   1HB   MET  55          2HB       MET  55  -6.054  -8.284 -14.246
  452   2HB   MET  55          1HB       MET  55  -4.966  -9.137 -13.159
  453   1HG   MET  55          2HG       MET  55  -6.581  -8.495 -11.302
  454   2HG   MET  55          1HG       MET  55  -7.701  -8.054 -12.589
  455   1HE   MET  55          1HE       MET  55  -9.657 -11.072 -12.408
  456   2HE   MET  55          2HE       MET  55  -9.473  -9.336 -12.154
  457   3HE   MET  55          3HE       MET  55  -9.109 -10.462 -10.847
  458    HA   PRO  56           HA       PRO  56  -7.533  -3.767 -12.333
  459   1HB   PRO  56          2HB       PRO  56  -5.936  -1.663 -11.482
  460   2HB   PRO  56          1HB       PRO  56  -6.704  -2.846 -10.426
  461   1HG   PRO  56          2HG       PRO  56  -3.920  -2.487 -10.902
  462   2HG   PRO  56          1HG       PRO  56  -4.696  -3.729  -9.910
  463   1HD   PRO  56          2HD       PRO  56  -3.678  -3.890 -12.693
  464   2HD   PRO  56          1HD       PRO  56  -3.843  -5.164 -11.470
  465    H    ASP  57           H        ASP  57  -7.104  -1.055 -12.804
  466    HA   ASP  57           HA       ASP  57  -5.690  -0.652 -15.264
  467   1HB   ASP  57          2HB       ASP  57  -7.720  -1.818 -16.070
  468   2HB   ASP  57          1HB       ASP  57  -8.712  -0.561 -15.338
  469    H    GLY  58           H        GLY  58  -5.257   0.668 -12.998
  470   1HA   GLY  58          2HA       GLY  58  -6.466   3.310 -13.512
  471   2HA   GLY  58          1HA       GLY  58  -6.280   2.703 -11.873
  472    H    ASP  59           H        ASP  59  -5.174   5.116 -13.125
  473    HA   ASP  59           HA       ASP  59  -2.362   4.668 -13.489
  474   1HB   ASP  59          2HB       ASP  59  -3.963   6.611 -14.357
  475   2HB   ASP  59          1HB       ASP  59  -3.424   7.383 -12.869
  476    H    GLY  60           H        GLY  60  -1.151   4.063 -11.808
  477   1HA   GLY  60          2HA       GLY  60  -1.793   5.001  -9.125
  478   2HA   GLY  60          1HA       GLY  60  -0.602   3.780  -9.545
  479    H    VAL  61           H        VAL  61   0.388   5.815 -11.660
  480    HA   VAL  61           HA       VAL  61   2.579   6.767 -10.233
  481    HB   VAL  61           HB       VAL  61   1.471   7.981 -12.765
  482   1HG1  VAL  61          1HG1      VAL  61   4.334   7.722 -11.902
  483   2HG1  VAL  61          2HG1      VAL  61   3.343   9.126 -11.507
  484   3HG1  VAL  61          3HG1      VAL  61   3.665   8.719 -13.194
  485   1HG2  VAL  61          1HG2      VAL  61   2.748   5.369 -12.255
  486   2HG2  VAL  61          2HG2      VAL  61   3.361   6.279 -13.633
  487   3HG2  VAL  61          3HG2      VAL  61   1.650   5.865 -13.543
  488    H    ASN  62           H        ASN  62  -0.163   8.673 -11.515
  489    HA   ASN  62           HA       ASN  62   0.534  11.017 -10.127
  490   1HB   ASN  62          2HB       ASN  62  -1.765  11.702 -10.837
  491   2HB   ASN  62          1HB       ASN  62  -0.735  11.159 -12.143
  492   1HD2  ASN  62          1HD2      ASN  62  -3.238  10.067  -9.902
  493   2HD2  ASN  62          2HD2      ASN  62  -3.958   8.931 -10.985
  494    H    PHE  63           H        PHE  63  -1.207   8.171  -9.237
  495    HA   PHE  63           HA       PHE  63  -2.917   9.191  -7.271
  496   1HB   PHE  63          2HB       PHE  63  -3.127   6.906  -8.087
  497   2HB   PHE  63          1HB       PHE  63  -1.552   6.494  -7.416
  498    HD1  PHE  63           1HD      PHE  63  -4.581   8.228  -6.098
  499    HD2  PHE  63           2HD      PHE  63  -1.737   5.103  -5.603
  500    HE1  PHE  63           1HE      PHE  63  -5.654   7.594  -3.977
  501    HE2  PHE  63           2HE      PHE  63  -2.804   4.463  -3.480
  502    HZ   PHE  63           HZ       PHE  63  -4.766   5.711  -2.664
  503    H    ILE  64           H        ILE  64   0.469   8.185  -7.092
  504    HA   ILE  64           HA       ILE  64   0.920   8.150  -4.397
  505    HB   ILE  64           HB       ILE  64   2.744   9.314  -6.503
  506   1HG1  ILE  64          2HG1      ILE  64   3.456   6.710  -5.468
  507   2HG1  ILE  64          1HG1      ILE  64   1.817   6.689  -6.111
  508   1HG2  ILE  64          1HG2      ILE  64   4.489   8.483  -4.744
  509   2HG2  ILE  64          2HG2      ILE  64   3.152   8.694  -3.613
  510   3HG2  ILE  64          3HG2      ILE  64   3.729  10.064  -4.561
  511   1HD1  ILE  64          1HD1      ILE  64   3.932   6.206  -7.611
  512   2HD1  ILE  64          2HD1      ILE  64   3.917   7.963  -7.762
  513   3HD1  ILE  64          3HD1      ILE  64   2.503   7.022  -8.242
  514    H    ASP  65           H        ASP  65   0.270  10.934  -6.389
  515    HA   ASP  65           HA       ASP  65   1.162  12.867  -4.474
  516   1HB   ASP  65          2HB       ASP  65   0.802  13.124  -7.056
  517   2HB   ASP  65          1HB       ASP  65  -0.860  13.486  -6.602
  518    H    PHE  66           H        PHE  66  -1.888  11.298  -5.232
  519    HA   PHE  66           HA       PHE  66  -3.576  12.932  -3.694
  520   1HB   PHE  66          2HB       PHE  66  -4.621  11.446  -5.218
  521   2HB   PHE  66          1HB       PHE  66  -3.745  10.055  -4.591
  522    HD1  PHE  66           1HD      PHE  66  -4.417   9.007  -2.490
  523    HD2  PHE  66           2HD      PHE  66  -6.618  12.240  -4.165
  524    HE1  PHE  66           1HE      PHE  66  -6.315   8.471  -1.021
  525    HE2  PHE  66           2HE      PHE  66  -8.521  11.710  -2.699
  526    HZ   PHE  66           HZ       PHE  66  -8.371   9.823  -1.122
  527    H    ILE  67           H        ILE  67  -1.761   9.991  -2.896
  528    HA   ILE  67           HA       ILE  67  -2.655   9.679  -0.267
  529    HB   ILE  67           HB       ILE  67   0.045   8.983  -1.436
  530   1HG1  ILE  67          2HG1      ILE  67  -1.201   6.631  -1.170
  531   2HG1  ILE  67          1HG1      ILE  67  -2.619   7.654  -1.374
  532   1HG2  ILE  67          1HG2      ILE  67   0.470   8.885   0.828
  533   2HG2  ILE  67          2HG2      ILE  67  -0.097   7.247   0.506
  534   3HG2  ILE  67          3HG2      ILE  67  -1.186   8.432   1.227
  535   1HD1  ILE  67          1HD1      ILE  67  -0.725   8.373  -3.354
  536   2HD1  ILE  67          2HD1      ILE  67  -2.314   7.634  -3.557
  537   3HD1  ILE  67          3HD1      ILE  67  -0.887   6.617  -3.350
  538    H    LYS  68           H        LYS  68   0.001  11.622  -1.596
  539    HA   LYS  68           HA       LYS  68   0.775  12.562   1.023
  540   1HB   LYS  68          2HB       LYS  68   1.633  13.527  -1.713
  541   2HB   LYS  68          1HB       LYS  68   2.388  13.961  -0.186
  542   1HG   LYS  68          2HG       LYS  68   2.198  11.076  -0.732
  543   2HG   LYS  68          1HG       LYS  68   3.263  11.992  -1.800
  544   1HD   LYS  68          2HD       LYS  68   4.078  13.013   0.509
  545   2HD   LYS  68          1HD       LYS  68   3.480  11.469   1.119
  546   1HE   LYS  68          2HE       LYS  68   5.486  10.658   0.562
  547   2HE   LYS  68          1HE       LYS  68   4.913  10.729  -1.104
  548   1HZ   LYS  68          1HZ       LYS  68   6.415  12.880   0.290
  549   2HZ   LYS  68          2HZ       LYS  68   5.886  12.924  -1.316
  550   3HZ   LYS  68          3HZ       LYS  68   7.064  11.806  -0.843
  551    H    GLU  69           H        GLU  69  -1.400  13.509  -1.477
  552    HA   GLU  69           HA       GLU  69  -1.590  16.268  -0.936
  553   1HB   GLU  69          2HB       GLU  69  -2.487  15.085  -2.965
  554   2HB   GLU  69          1HB       GLU  69  -3.790  14.475  -1.957
  555   1HG   GLU  69          2HG       GLU  69  -4.572  16.714  -1.534
  556   2HG   GLU  69          1HG       GLU  69  -3.204  17.390  -2.418
  557    H    ASN  70           H        ASN  70  -2.986  13.442   0.529
  558    HA   ASN  70           HA       ASN  70  -4.167  15.141   2.612
  559   1HB   ASN  70          2HB       ASN  70  -5.892  13.071   2.666
  560   2HB   ASN  70          1HB       ASN  70  -6.174  14.532   1.727
  561   1HD2  ASN  70          1HD2      ASN  70  -5.133  14.439  -0.519
  562   2HD2  ASN  70          2HD2      ASN  70  -5.361  12.969  -1.396
  563    H    SER  71           H        SER  71  -1.715  13.300   2.178
  564    HA   SER  71           HA       SER  71  -1.566  12.362   4.848
  565   1HB   SER  71          2HB       SER  71  -2.922  10.610   3.227
  566   2HB   SER  71          1HB       SER  71  -1.272  10.003   3.119
  567    HG   SER  71           HG       SER  71  -2.821   9.353   4.961
  568    HA   PRO  72           HA       PRO  72   2.447  12.944   2.638
  569   1HB   PRO  72          2HB       PRO  72   3.146  15.089   4.365
  570   2HB   PRO  72          1HB       PRO  72   2.684  15.187   2.668
  571   1HG   PRO  72          2HG       PRO  72   1.208  16.175   4.816
  572   2HG   PRO  72          1HG       PRO  72   0.595  15.898   3.178
  573   1HD   PRO  72          2HD       PRO  72   0.301  14.223   5.625
  574   2HD   PRO  72          1HD       PRO  72  -0.833  14.475   4.280
  575    H    ASP  73           H        ASP  73   1.439  12.237   5.766
  576    HA   ASP  73           HA       ASP  73   4.157  11.787   6.746
  577   1HB   ASP  73          2HB       ASP  73   2.453  12.985   8.164
  578   2HB   ASP  73          1HB       ASP  73   1.585  11.457   8.281
  579    H    SER  74           H        SER  74   1.791  10.108   5.122
  580    HA   SER  74           HA       SER  74   2.205   7.563   6.435
  581   1HB   SER  74          2HB       SER  74   0.869   7.114   4.018
  582   2HB   SER  74          1HB       SER  74   0.143   7.266   5.615
  583    HG   SER  74           HG       SER  74   0.537   9.293   3.681
  584    H    VAL  75           H        VAL  75   2.327   5.731   4.480
  585    HA   VAL  75           HA       VAL  75   4.769   6.378   2.966
  586    HB   VAL  75           HB       VAL  75   4.181   3.776   4.401
  587   1HG1  VAL  75          1HG1      VAL  75   5.388   3.480   2.264
  588   2HG1  VAL  75          2HG1      VAL  75   6.376   3.057   3.662
  589   3HG1  VAL  75          3HG1      VAL  75   6.631   4.593   2.832
  590   1HG2  VAL  75          1HG2      VAL  75   4.910   5.863   5.731
  591   2HG2  VAL  75          2HG2      VAL  75   6.481   5.611   4.969
  592   3HG2  VAL  75          3HG2      VAL  75   5.780   4.351   5.985
  593    H    VAL  76           H        VAL  76   4.970   5.468   0.937
  594    HA   VAL  76           HA       VAL  76   2.634   3.968  -0.056
  595    HB   VAL  76           HB       VAL  76   4.216   5.725  -1.892
  596   1HG1  VAL  76          1HG1      VAL  76   2.769   4.556  -3.185
  597   2HG1  VAL  76          2HG1      VAL  76   1.693   5.880  -2.735
  598   3HG1  VAL  76          3HG1      VAL  76   1.603   4.340  -1.880
  599   1HG2  VAL  76          1HG2      VAL  76   1.886   6.693  -0.238
  600   2HG2  VAL  76          2HG2      VAL  76   2.742   7.602  -1.484
  601   3HG2  VAL  76          3HG2      VAL  76   3.569   7.159   0.011
  602    H    ILE  77           H        ILE  77   3.492   1.949  -0.024
  603    HA   ILE  77           HA       ILE  77   6.177   1.391  -0.817
  604    HB   ILE  77           HB       ILE  77   3.886  -0.547  -0.485
  605   1HG1  ILE  77          2HG1      ILE  77   4.238   0.765   1.550
  606   2HG1  ILE  77          1HG1      ILE  77   4.782  -0.892   1.787
  607   1HG2  ILE  77          1HG2      ILE  77   5.446  -1.856  -1.493
  608   2HG2  ILE  77          2HG2      ILE  77   6.040  -1.966   0.163
  609   3HG2  ILE  77          3HG2      ILE  77   6.793  -0.845  -0.970
  610   1HD1  ILE  77          1HD1      ILE  77   7.109  -0.031   1.228
  611   2HD1  ILE  77          2HD1      ILE  77   6.420   0.439   2.782
  612   3HD1  ILE  77          3HD1      ILE  77   6.432   1.583   1.440
  613    H    VAL  78           H        VAL  78   3.138   0.165  -2.246
  614    HA   VAL  78           HA       VAL  78   2.565  -0.308  -4.405
  615    HB   VAL  78           HB       VAL  78   4.811   1.512  -5.278
  616   1HG1  VAL  78          1HG1      VAL  78   2.145   0.922  -6.557
  617   2HG1  VAL  78          2HG1      VAL  78   3.657   0.125  -6.990
  618   3HG1  VAL  78          3HG1      VAL  78   3.471   1.861  -7.242
  619   1HG2  VAL  78          1HG2      VAL  78   1.994   2.387  -4.676
  620   2HG2  VAL  78          2HG2      VAL  78   3.388   3.394  -5.068
  621   3HG2  VAL  78          3HG2      VAL  78   3.320   2.546  -3.523
  622    H    ILE  79           H        ILE  79   3.103  -2.427  -4.541
  623    HA   ILE  79           HA       ILE  79   5.874  -3.148  -5.147
  624    HB   ILE  79           HB       ILE  79   3.757  -5.218  -4.751
  625   1HG1  ILE  79          2HG1      ILE  79   5.051  -3.736  -2.456
  626   2HG1  ILE  79          1HG1      ILE  79   3.392  -3.481  -2.982
  627   1HG2  ILE  79          1HG2      ILE  79   5.594  -6.478  -4.797
  628   2HG2  ILE  79          2HG2      ILE  79   6.058  -5.760  -3.255
  629   3HG2  ILE  79          3HG2      ILE  79   6.634  -5.053  -4.765
  630   1HD1  ILE  79          1HD1      ILE  79   3.881  -5.044  -0.987
  631   2HD1  ILE  79          2HD1      ILE  79   4.312  -6.215  -2.235
  632   3HD1  ILE  79          3HD1      ILE  79   2.689  -5.523  -2.196
  633    H    THR  80           H        THR  80   4.765  -5.737  -6.384
  634    HA   THR  80           HA       THR  80   4.478  -6.552  -8.480
  635    HB   THR  80           HB       THR  80   2.885  -4.623  -9.770
  636    HG1  THR  80           1HG      THR  80   2.444  -3.460  -8.002
  637   1HG2  THR  80          1HG2      THR  80   1.003  -6.192  -8.852
  638   2HG2  THR  80          2HG2      THR  80   2.374  -7.196  -8.382
  639   3HG2  THR  80          3HG2      THR  80   2.144  -6.754 -10.073
  640    H    GLY  81           H        GLY  81   6.639  -6.262  -9.117
  641   1HA   GLY  81          2HA       GLY  81   6.969  -4.587 -11.412
  642   2HA   GLY  81          1HA       GLY  81   7.875  -3.984 -10.033
  643    H    HIS  82           H        HIS  82   7.255  -7.339 -10.996
  644    HA   HIS  82           HA       HIS  82  10.007  -8.032 -10.643
  645   1HB   HIS  82          2HB       HIS  82   8.110  -9.592 -10.193
  646   2HB   HIS  82          1HB       HIS  82   7.805  -9.663 -11.926
  647    HD1  HIS  82           1HD      HIS  82   9.549 -11.400  -9.329
  648    HD2  HIS  82           2HD      HIS  82  10.246 -10.664 -13.360
  649    HE1  HIS  82           1HE      HIS  82  11.236 -13.122 -10.045
  650    HE2  HIS  82           2HE      HIS  82  11.580 -12.710 -12.507
  651    H    GLY  83           H        GLY  83   7.868  -7.667 -13.452
  652   1HA   GLY  83          2HA       GLY  83  10.157  -8.055 -15.240
  653   2HA   GLY  83          1HA       GLY  83   8.468  -8.011 -15.720
  654    H    SER  84           H        SER  84   7.540  -5.688 -14.744
  655    HA   SER  84           HA       SER  84   9.080  -3.726 -16.277
  656   1HB   SER  84          2HB       SER  84   6.228  -3.654 -15.261
  657   2HB   SER  84          1HB       SER  84   6.995  -2.372 -16.198
  658    HG   SER  84           HG       SER  84   5.731  -3.886 -17.451
  659    H    VAL  85           H        VAL  85  10.605  -3.790 -14.355
  660    HA   VAL  85           HA       VAL  85   9.901  -2.716 -11.862
  661    HB   VAL  85           HB       VAL  85  12.008  -3.917 -12.251
  662   1HG1  VAL  85          1HG1      VAL  85  12.426  -2.817 -14.490
  663   2HG1  VAL  85          2HG1      VAL  85  13.832  -3.003 -13.441
  664   3HG1  VAL  85          3HG1      VAL  85  13.044  -1.432 -13.590
  665   1HG2  VAL  85          1HG2      VAL  85  13.021  -1.296 -11.368
  666   2HG2  VAL  85          2HG2      VAL  85  13.054  -2.860 -10.556
  667   3HG2  VAL  85          3HG2      VAL  85  11.586  -1.883 -10.528
  668    H    ASP  86           H        ASP  86  10.289  -1.200 -14.915
  669    HA   ASP  86           HA       ASP  86  11.180   1.339 -14.277
  670   1HB   ASP  86          2HB       ASP  86   9.016   0.671 -16.283
  671   2HB   ASP  86          1HB       ASP  86  10.036   2.106 -16.282
  672    H    THR  87           H        THR  87   7.996  -0.077 -13.811
  673    HA   THR  87           HA       THR  87   6.560   2.266 -13.283
  674    HB   THR  87           HB       THR  87   5.706  -0.157 -13.568
  675    HG1  THR  87           1HG      THR  87   4.553   1.388 -11.496
  676   1HG2  THR  87          1HG2      THR  87   7.053  -0.764 -11.343
  677   2HG2  THR  87          2HG2      THR  87   5.580  -1.598 -11.840
  678   3HG2  THR  87          3HG2      THR  87   5.503  -0.316 -10.632
  679    H    ALA  88           H        ALA  88   8.696   0.355 -11.284
  680    HA   ALA  88           HA       ALA  88   8.061   1.412  -8.773
  681   1HB   ALA  88          1HB       ALA  88  10.285   0.675  -8.089
  682   2HB   ALA  88          2HB       ALA  88  10.749   0.483  -9.778
  683   3HB   ALA  88          3HB       ALA  88   9.498  -0.549  -9.087
  684    H    VAL  89           H        VAL  89  10.724   2.322 -10.941
  685    HA   VAL  89           HA       VAL  89  11.532   4.597  -9.538
  686    HB   VAL  89           HB       VAL  89  12.666   5.296 -11.595
  687   1HG1  VAL  89          1HG1      VAL  89  12.791   2.400 -10.825
  688   2HG1  VAL  89          2HG1      VAL  89  13.891   3.710 -10.395
  689   3HG1  VAL  89          3HG1      VAL  89  13.872   3.079 -12.042
  690   1HG2  VAL  89          1HG2      VAL  89  12.335   4.311 -13.691
  691   2HG2  VAL  89          2HG2      VAL  89  10.704   4.546 -13.068
  692   3HG2  VAL  89          3HG2      VAL  89  11.446   2.948 -13.012
  693    H    LYS  90           H        LYS  90   8.900   4.097 -11.763
  694    HA   LYS  90           HA       LYS  90   8.444   6.901 -12.246
  695   1HB   LYS  90          2HB       LYS  90   7.860   5.232 -13.936
  696   2HB   LYS  90          1HB       LYS  90   6.714   4.494 -12.824
  697   1HG   LYS  90          2HG       LYS  90   5.243   6.299 -12.955
  698   2HG   LYS  90          1HG       LYS  90   6.468   7.366 -13.640
  699   1HD   LYS  90          2HD       LYS  90   5.791   4.920 -15.173
  700   2HD   LYS  90          1HD       LYS  90   4.580   6.201 -15.125
  701   1HE   LYS  90          2HE       LYS  90   7.204   7.290 -15.615
  702   2HE   LYS  90          1HE       LYS  90   6.815   6.038 -16.795
  703   1HZ   LYS  90          1HZ       LYS  90   6.061   8.571 -17.044
  704   2HZ   LYS  90          2HZ       LYS  90   4.707   7.957 -16.238
  705   3HZ   LYS  90          3HZ       LYS  90   5.194   7.279 -17.709
  706    H    ALA  91           H        ALA  91   7.724   4.764  -9.714
  707    HA   ALA  91           HA       ALA  91   5.468   6.436  -8.835
  708   1HB   ALA  91          1HB       ALA  91   5.190   4.424  -7.190
  709   2HB   ALA  91          2HB       ALA  91   6.160   3.570  -8.390
  710   3HB   ALA  91          3HB       ALA  91   4.624   4.300  -8.856
  711    H    ILE  92           H        ILE  92   8.589   5.117  -7.871
  712    HA   ILE  92           HA       ILE  92   8.441   6.162  -5.205
  713    HB   ILE  92           HB       ILE  92  10.615   5.331  -4.848
  714   1HG1  ILE  92          2HG1      ILE  92  10.920   5.224  -7.860
  715   2HG1  ILE  92          1HG1      ILE  92  11.753   6.322  -6.765
  716   1HG2  ILE  92          1HG2      ILE  92  10.457   3.058  -6.240
  717   2HG2  ILE  92          2HG2      ILE  92   8.829   3.670  -6.525
  718   3HG2  ILE  92          3HG2      ILE  92   9.400   3.420  -4.877
  719   1HD1  ILE  92          1HD1      ILE  92  13.007   4.530  -5.815
  720   2HD1  ILE  92          2HD1      ILE  92  13.132   4.420  -7.572
  721   3HD1  ILE  92          3HD1      ILE  92  12.058   3.331  -6.694
  722    H    LYS  93           H        LYS  93   9.527   7.368  -8.273
  723    HA   LYS  93           HA       LYS  93  11.247   9.403  -7.322
  724   1HB   LYS  93          2HB       LYS  93  11.064   8.539  -9.704
  725   2HB   LYS  93          1HB       LYS  93   9.615   9.524  -9.857
  726   1HG   LYS  93          2HG       LYS  93  11.601  10.626 -10.778
  727   2HG   LYS  93          1HG       LYS  93  10.892  11.533  -9.441
  728   1HD   LYS  93          2HD       LYS  93  12.599  10.886  -7.956
  729   2HD   LYS  93          1HD       LYS  93  13.157   9.602  -9.031
  730   1HE   LYS  93          2HE       LYS  93  13.505  11.693 -10.656
  731   2HE   LYS  93          1HE       LYS  93  13.682  12.517  -9.108
  732   1HZ   LYS  93          1HZ       LYS  93  15.806  11.858  -9.354
  733   2HZ   LYS  93          2HZ       LYS  93  15.421  10.566 -10.378
  734   3HZ   LYS  93          3HZ       LYS  93  15.234  10.405  -8.705
  735    H    LYS  94           H        LYS  94   7.795   9.133  -7.616
  736    HA   LYS  94           HA       LYS  94   7.225  11.922  -7.399
  737   1HB   LYS  94          2HB       LYS  94   5.686  10.188  -8.371
  738   2HB   LYS  94          1HB       LYS  94   5.395   9.619  -6.733
  739   1HG   LYS  94          2HG       LYS  94   3.712  11.063  -6.664
  740   2HG   LYS  94          1HG       LYS  94   4.931  12.335  -6.567
  741   1HD   LYS  94          2HD       LYS  94   3.700  11.249  -9.100
  742   2HD   LYS  94          1HD       LYS  94   3.308  12.792  -8.338
  743   1HE   LYS  94          2HE       LYS  94   6.119  12.131  -9.142
  744   2HE   LYS  94          1HE       LYS  94   4.967  12.771 -10.313
  745   1HZ   LYS  94          1HZ       LYS  94   6.215  14.085  -8.026
  746   2HZ   LYS  94          2HZ       LYS  94   4.621  14.522  -8.388
  747   3HZ   LYS  94          3HZ       LYS  94   5.834  14.704  -9.553
  748    H    GLY  95           H        GLY  95   6.797   9.219  -5.102
  749   1HA   GLY  95          2HA       GLY  95   7.947  10.483  -2.905
  750   2HA   GLY  95          1HA       GLY  95   6.241  10.898  -2.888
  751    H    ALA  96           H        ALA  96   7.636   7.837  -3.968
  752    HA   ALA  96           HA       ALA  96   5.947   6.448  -2.049
  753   1HB   ALA  96          1HB       ALA  96   5.939   4.715  -3.478
  754   2HB   ALA  96          2HB       ALA  96   7.670   4.833  -3.790
  755   3HB   ALA  96          3HB       ALA  96   6.546   5.895  -4.637
  756    H    TYR  97           H        TYR  97   7.438   4.103  -1.708
  757    HA   TYR  97           HA       TYR  97   9.557   5.092   0.072
  758   1HB   TYR  97          2HB       TYR  97   7.653   3.930   1.148
  759   2HB   TYR  97          1HB       TYR  97   8.035   2.487   0.218
  760    HD1  TYR  97           1HD      TYR  97   9.923   4.912   2.356
  761    HD2  TYR  97           2HD      TYR  97   9.105   0.845   1.419
  762    HE1  TYR  97           1HE      TYR  97  11.480   4.199   4.121
  763    HE2  TYR  97           2HE      TYR  97  10.659   0.120   3.181
  764    HH   TYR  97           HH       TYR  97  11.936   2.283   5.511
  765    H    GLU  98           H        GLU  98   9.735   4.394  -2.829
  766    HA   GLU  98           HA       GLU  98  11.448   3.663  -4.142
  767   1HB   GLU  98          2HB       GLU  98  13.456   3.169  -3.234
  768   2HB   GLU  98          1HB       GLU  98  12.687   3.705  -1.750
  769   1HG   GLU  98          2HG       GLU  98  12.024   1.126  -1.635
  770   2HG   GLU  98          1HG       GLU  98  13.488   0.989  -2.608
  771    H    PHE  99           H        PHE  99   8.931   2.148  -3.351
  772    HA   PHE  99           HA       PHE  99   7.891   0.223  -3.977
  773   1HB   PHE  99          2HB       PHE  99   9.960   0.678  -5.915
  774   2HB   PHE  99          1HB       PHE  99   9.792  -1.053  -5.650
  775    HD1  PHE  99           1HD      PHE  99   8.490  -2.064  -7.235
  776    HD2  PHE  99           2HD      PHE  99   7.428   1.829  -5.883
  777    HE1  PHE  99           1HE      PHE  99   6.519  -2.094  -8.709
  778    HE2  PHE  99           2HE      PHE  99   5.456   1.806  -7.354
  779    HZ   PHE  99           HZ       PHE  99   4.997  -0.158  -8.765
  780    H    LEU 100           H        LEU 100   7.997  -2.165  -3.829
  781    HA   LEU 100           HA       LEU 100   9.856  -2.955  -1.709
  782   1HB   LEU 100          2HB       LEU 100   7.295  -3.129  -1.511
  783   2HB   LEU 100          1HB       LEU 100   7.432  -4.490  -2.606
  784    HG   LEU 100           HG       LEU 100   7.299  -5.237  -0.291
  785   1HD1  LEU 100          1HD1      LEU 100   8.834  -6.889  -0.527
  786   2HD1  LEU 100          2HD1      LEU 100  10.132  -5.776  -0.957
  787   3HD1  LEU 100          3HD1      LEU 100   8.915  -6.215  -2.155
  788   1HD2  LEU 100          1HD2      LEU 100   9.967  -3.992   0.251
  789   2HD2  LEU 100          2HD2      LEU 100   8.771  -4.608   1.391
  790   3HD2  LEU 100          3HD2      LEU 100   8.477  -3.093   0.537
  791    H    GLU 101           H        GLU 101  11.341  -4.519  -2.003
  792    HA   GLU 101           HA       GLU 101  12.015  -5.373  -4.606
  793   1HB   GLU 101          2HB       GLU 101  12.969  -6.018  -1.851
  794   2HB   GLU 101          1HB       GLU 101  13.461  -7.065  -3.175
  795   1HG   GLU 101          2HG       GLU 101  13.793  -4.216  -3.730
  796   2HG   GLU 101          1HG       GLU 101  14.759  -4.808  -2.379
  797    H    LYS 102           H        LYS 102  11.059  -7.411  -1.835
  798    HA   LYS 102           HA       LYS 102   9.904  -9.364  -1.709
  799   1HB   LYS 102          2HB       LYS 102   8.363  -7.765  -3.246
  800   2HB   LYS 102          1HB       LYS 102   8.657  -9.075  -4.380
  801   1HG   LYS 102          2HG       LYS 102   7.678 -10.671  -2.916
  802   2HG   LYS 102          1HG       LYS 102   7.608  -9.503  -1.595
  803   1HD   LYS 102          2HD       LYS 102   5.482  -9.216  -2.277
  804   2HD   LYS 102          1HD       LYS 102   6.210  -8.196  -3.518
  805   1HE   LYS 102          2HE       LYS 102   6.037 -11.105  -4.065
  806   2HE   LYS 102          1HE       LYS 102   4.533 -10.184  -4.095
  807   1HZ   LYS 102          1HZ       LYS 102   5.135  -9.100  -5.958
  808   2HZ   LYS 102          2HZ       LYS 102   6.136 -10.442  -6.195
  809   3HZ   LYS 102          3HZ       LYS 102   6.771  -9.018  -5.536
  810    HA   PRO 103           HA       PRO 103  12.843 -11.299  -4.794
  811   1HB   PRO 103          2HB       PRO 103  14.754 -12.135  -3.109
  812   2HB   PRO 103          1HB       PRO 103  14.723 -10.479  -3.727
  813   1HG   PRO 103          2HG       PRO 103  13.815 -11.528  -1.075
  814   2HG   PRO 103          1HG       PRO 103  14.730 -10.054  -1.441
  815   1HD   PRO 103          2HD       PRO 103  12.029 -10.100  -0.971
  816   2HD   PRO 103          1HD       PRO 103  12.842  -8.865  -1.953
  817    H    PHE 104           H        PHE 104  10.855 -12.230  -2.300
  818    HA   PHE 104           HA       PHE 104  11.110 -15.043  -3.056
  819   1HB   PHE 104          2HB       PHE 104  11.923 -14.003  -0.540
  820   2HB   PHE 104          1HB       PHE 104  10.454 -14.938  -0.276
  821    HD1  PHE 104           1HD      PHE 104  13.955 -15.084  -0.592
  822    HD2  PHE 104           2HD      PHE 104  10.408 -17.298  -1.384
  823    HE1  PHE 104           1HE      PHE 104  15.272 -17.161  -0.661
  824    HE2  PHE 104           2HE      PHE 104  11.719 -19.380  -1.453
  825    HZ   PHE 104           HZ       PHE 104  14.153 -19.313  -1.092
  826    H    SER 105           H        SER 105   9.216 -13.359  -0.564
  827    HA   SER 105           HA       SER 105   6.800 -13.525  -2.139
  828   1HB   SER 105          2HB       SER 105   6.865 -15.021   0.484
  829   2HB   SER 105          1HB       SER 105   5.584 -15.011  -0.727
  830    HG   SER 105           HG       SER 105   6.912 -16.176  -2.102
  831    H    VAL 106           H        VAL 106   4.913 -13.169  -0.196
  832    HA   VAL 106           HA       VAL 106   5.164 -10.453   0.432
  833    HB   VAL 106           HB       VAL 106   2.995 -11.605   0.231
  834   1HG1  VAL 106          1HG1      VAL 106   3.771 -12.864   2.856
  835   2HG1  VAL 106          2HG1      VAL 106   3.473 -13.686   1.324
  836   3HG1  VAL 106          3HG1      VAL 106   2.146 -12.895   2.173
  837   1HG2  VAL 106          1HG2      VAL 106   2.368 -10.688   2.801
  838   2HG2  VAL 106          2HG2      VAL 106   2.284  -9.784   1.289
  839   3HG2  VAL 106          3HG2      VAL 106   3.745  -9.722   2.274
  840    H    GLU 107           H        GLU 107   5.930 -13.341   2.290
  841    HA   GLU 107           HA       GLU 107   6.117 -12.431   4.848
  842   1HB   GLU 107          2HB       GLU 107   6.717 -14.730   3.837
  843   2HB   GLU 107          1HB       GLU 107   8.340 -14.071   3.686
  844   1HG   GLU 107          2HG       GLU 107   7.884 -13.466   6.240
  845   2HG   GLU 107          1HG       GLU 107   6.828 -14.870   6.092
  846    H    ARG 108           H        ARG 108   8.376 -11.827   2.212
  847    HA   ARG 108           HA       ARG 108  10.356 -10.538   3.792
  848   1HB   ARG 108          2HB       ARG 108  10.711 -11.497   1.489
  849   2HB   ARG 108          1HB       ARG 108   9.816 -10.127   0.846
  850   1HG   ARG 108          2HG       ARG 108  12.135  -9.584   2.621
  851   2HG   ARG 108          1HG       ARG 108  12.443 -10.123   0.970
  852   1HD   ARG 108          2HD       ARG 108  12.010  -8.091   0.188
  853   2HD   ARG 108          1HD       ARG 108  10.417  -8.105   0.942
  854    HE   ARG 108           HE       ARG 108  11.237  -6.793   2.634
  855   1HH1  ARG 108          1HH1      ARG 108  13.910  -8.092   0.803
  856   2HH1  ARG 108          2HH1      ARG 108  15.091  -7.097   1.585
  857   1HH2  ARG 108          1HH2      ARG 108  12.791  -5.485   3.665
  858   2HH2  ARG 108          2HH2      ARG 108  14.458  -5.618   3.210
  859    H    PHE 109           H        PHE 109   7.546  -9.440   1.975
  860    HA   PHE 109           HA       PHE 109   7.954  -6.678   2.152
  861   1HB   PHE 109          2HB       PHE 109   6.256  -7.339   0.679
  862   2HB   PHE 109          1HB       PHE 109   5.520  -8.416   1.856
  863    HD1  PHE 109           1HD      PHE 109   6.401  -4.786   1.921
  864    HD2  PHE 109           2HD      PHE 109   3.378  -7.757   2.296
  865    HE1  PHE 109           1HE      PHE 109   4.760  -3.043   2.492
  866    HE2  PHE 109           2HE      PHE 109   1.732  -6.021   2.867
  867    HZ   PHE 109           HZ       PHE 109   2.424  -3.658   2.966
  868    H    LEU 110           H        LEU 110   6.929  -9.004   4.504
  869    HA   LEU 110           HA       LEU 110   5.600  -7.385   6.345
  870   1HB   LEU 110          2HB       LEU 110   6.219  -9.993   6.216
  871   2HB   LEU 110          1HB       LEU 110   7.367  -9.467   7.430
  872    HG   LEU 110           HG       LEU 110   4.404  -8.951   7.614
  873   1HD1  LEU 110          1HD1      LEU 110   4.443 -10.771   9.312
  874   2HD1  LEU 110          2HD1      LEU 110   6.065 -11.183   8.758
  875   3HD1  LEU 110          3HD1      LEU 110   4.696 -11.316   7.655
  876   1HD2  LEU 110          1HD2      LEU 110   6.761  -8.272   9.236
  877   2HD2  LEU 110          2HD2      LEU 110   5.392  -8.926  10.135
  878   3HD2  LEU 110          3HD2      LEU 110   5.185  -7.488   9.135
  879    H    LEU 111           H        LEU 111   9.039  -8.236   6.153
  880    HA   LEU 111           HA       LEU 111   9.953  -6.863   8.378
  881   1HB   LEU 111          2HB       LEU 111  11.346  -7.302   5.740
  882   2HB   LEU 111          1HB       LEU 111  12.139  -6.779   7.214
  883    HG   LEU 111           HG       LEU 111  10.833  -9.093   7.988
  884   1HD1  LEU 111          1HD1      LEU 111  10.503  -9.377   5.436
  885   2HD1  LEU 111          2HD1      LEU 111  11.084 -10.743   6.388
  886   3HD1  LEU 111          3HD1      LEU 111  12.217  -9.788   5.432
  887   1HD2  LEU 111          1HD2      LEU 111  13.301  -8.082   8.191
  888   2HD2  LEU 111          2HD2      LEU 111  13.608  -9.351   7.006
  889   3HD2  LEU 111          3HD2      LEU 111  12.915  -9.760   8.575
  890    H    THR 112           H        THR 112   9.873  -5.682   5.009
  891    HA   THR 112           HA       THR 112  10.830  -3.139   5.399
  892    HB   THR 112           HB       THR 112   8.590  -3.954   3.535
  893    HG1  THR 112           1HG      THR 112  10.151  -5.121   2.749
  894   1HG2  THR 112          1HG2      THR 112   8.897  -2.069   2.306
  895   2HG2  THR 112          2HG2      THR 112  10.560  -1.848   2.847
  896   3HG2  THR 112          3HG2      THR 112   9.222  -1.427   3.916
  897    H    ILE 113           H        ILE 113   7.390  -4.052   5.401
  898    HA   ILE 113           HA       ILE 113   6.025  -1.859   5.909
  899    HB   ILE 113           HB       ILE 113   5.804  -4.492   7.333
  900   1HG1  ILE 113          2HG1      ILE 113   5.181  -4.303   4.942
  901   2HG1  ILE 113          1HG1      ILE 113   3.815  -4.740   5.965
  902   1HG2  ILE 113          1HG2      ILE 113   4.404  -1.977   8.006
  903   2HG2  ILE 113          2HG2      ILE 113   4.794  -3.367   9.019
  904   3HG2  ILE 113          3HG2      ILE 113   3.421  -3.437   7.915
  905   1HD1  ILE 113          1HD1      ILE 113   3.638  -2.020   5.911
  906   2HD1  ILE 113          2HD1      ILE 113   2.739  -3.127   4.873
  907   3HD1  ILE 113          3HD1      ILE 113   4.233  -2.392   4.293
  908    H    LYS 114           H        LYS 114   7.451  -3.561   8.707
  909    HA   LYS 114           HA       LYS 114   7.026  -1.613  10.614
  910   1HB   LYS 114          2HB       LYS 114   7.929  -3.825  11.154
  911   2HB   LYS 114          1HB       LYS 114   9.428  -3.430  10.328
  912   1HG   LYS 114          2HG       LYS 114   8.570  -1.641  12.528
  913   2HG   LYS 114          1HG       LYS 114   9.159  -3.247  12.958
  914   1HD   LYS 114          2HD       LYS 114  10.656  -1.292  11.213
  915   2HD   LYS 114          1HD       LYS 114  10.924  -1.489  12.944
  916   1HE   LYS 114          2HE       LYS 114  11.169  -3.733  10.951
  917   2HE   LYS 114          1HE       LYS 114  12.524  -2.731  11.463
  918   1HZ   LYS 114          1HZ       LYS 114  10.947  -3.907  13.598
  919   2HZ   LYS 114          2HZ       LYS 114  12.624  -3.734  13.458
  920   3HZ   LYS 114          3HZ       LYS 114  11.836  -5.001  12.662
  921    H    HIS 115           H        HIS 115   9.980  -2.087   8.725
  922    HA   HIS 115           HA       HIS 115  11.324   0.231   9.438
  923   1HB   HIS 115          2HB       HIS 115  11.375  -1.247   6.805
  924   2HB   HIS 115          1HB       HIS 115  12.533  -0.007   7.271
  925    HD1  HIS 115           1HD      HIS 115  13.890  -0.624   9.587
  926    HD2  HIS 115           2HD      HIS 115  12.131  -3.753   7.495
  927    HE1  HIS 115           1HE      HIS 115  15.036  -2.707  10.405
  928    HE2  HIS 115           2HE      HIS 115  13.887  -4.596   9.198
  929    H    ALA 116           H        ALA 116   8.647  -0.212   7.251
  930    HA   ALA 116           HA       ALA 116   8.908   2.270   5.871
  931   1HB   ALA 116          1HB       ALA 116   6.193   1.475   5.886
  932   2HB   ALA 116          2HB       ALA 116   7.169   0.009   5.797
  933   3HB   ALA 116          3HB       ALA 116   7.381   1.283   4.596
  934    H    PHE 117           H        PHE 117   7.061   1.196   8.691
  935    HA   PHE 117           HA       PHE 117   5.579   3.529   9.118
  936   1HB   PHE 117          2HB       PHE 117   6.461   1.255  10.844
  937   2HB   PHE 117          1HB       PHE 117   5.751   2.672  11.611
  938    HD1  PHE 117           1HD      PHE 117   3.421   3.136  11.437
  939    HD2  PHE 117           2HD      PHE 117   5.135  -0.105   9.275
  940    HE1  PHE 117           1HE      PHE 117   1.172   2.276  10.951
  941    HE2  PHE 117           2HE      PHE 117   2.890  -0.968   8.788
  942    HZ   PHE 117           HZ       PHE 117   0.906   0.218   9.624
  943    H    GLU 118           H        GLU 118   8.921   2.875   9.606
  944    HA   GLU 118           HA       GLU 118   9.582   4.619  11.665
  945   1HB   GLU 118          2HB       GLU 118  11.156   3.850   9.210
  946   2HB   GLU 118          1HB       GLU 118  11.830   4.727  10.576
  947   1HG   GLU 118          2HG       GLU 118  10.457   2.301  11.382
  948   2HG   GLU 118          1HG       GLU 118  11.774   1.995  10.250
  949    H    GLU 119           H        GLU 119   8.515   5.327   8.470
  950    HA   GLU 119           HA       GLU 119   9.538   8.056   8.565
  951   1HB   GLU 119          2HB       GLU 119   7.902   6.676   6.431
  952   2HB   GLU 119          1HB       GLU 119   8.653   8.259   6.293
  953   1HG   GLU 119          2HG       GLU 119  10.629   6.337   7.046
  954   2HG   GLU 119          1HG       GLU 119   9.742   5.753   5.639
  955    H    TYR 120           H        TYR 120   7.461   7.093  10.443
  956    HA   TYR 120           HA       TYR 120   5.233   8.842   9.643
  957   1HB   TYR 120          2HB       TYR 120   4.877   6.325  10.208
  958   2HB   TYR 120          1HB       TYR 120   5.061   6.846  11.879
  959    HD1  TYR 120           1HD      TYR 120   3.212   7.637  13.049
  960    HD2  TYR 120           2HD      TYR 120   3.100   7.582   8.796
  961    HE1  TYR 120           1HE      TYR 120   0.843   8.294  13.108
  962    HE2  TYR 120           2HE      TYR 120   0.733   8.241   8.843
  963    HH   TYR 120           HH       TYR 120  -1.210   8.006  10.570
  964    H    SER 121           H        SER 121   7.787   9.683  10.832
  965    HA   SER 121           HA       SER 121   6.939  10.587  13.488
  966   1HB   SER 121          2HB       SER 121   9.196   9.487  13.163
  967   2HB   SER 121          1HB       SER 121   9.670  10.907  12.232
  968    HG   SER 121           HG       SER 121  10.150  11.735  14.096
  Start of MODEL   35
    1   1H    MET   1          1HT       MET   1  -2.450   3.543  18.221
    2   2H    MET   1          2HT       MET   1  -2.119   4.021  16.606
    3   3H    MET   1          3HT       MET   1  -0.828   3.685  17.685
    4    HA   MET   1           HA       MET   1  -1.292   1.436  17.727
    5   1HB   MET   1          2HB       MET   1  -3.297   0.563  16.478
    6   2HB   MET   1          1HB       MET   1  -3.674   1.502  17.915
    7   1HG   MET   1          2HG       MET   1  -4.040   3.475  16.431
    8   2HG   MET   1          1HG       MET   1  -3.861   2.393  15.051
    9   1HE   MET   1          1HE       MET   1  -5.928   1.777  13.839
   10   2HE   MET   1          2HE       MET   1  -6.288   3.433  14.330
   11   3HE   MET   1          3HE       MET   1  -7.525   2.184  14.468
   12    H    LYS   2           H        LYS   2  -1.620  -0.098  15.616
   13    HA   LYS   2           HA       LYS   2  -0.147   1.221  13.436
   14   1HB   LYS   2          2HB       LYS   2   0.403  -1.249  14.925
   15   2HB   LYS   2          1HB       LYS   2   0.567  -1.380  13.180
   16   1HG   LYS   2          2HG       LYS   2   2.683  -0.829  14.298
   17   2HG   LYS   2          1HG       LYS   2   2.177   0.411  13.150
   18   1HD   LYS   2          2HD       LYS   2   1.423   1.837  14.909
   19   2HD   LYS   2          1HD       LYS   2   1.630   0.560  16.109
   20   1HE   LYS   2          2HE       LYS   2   3.605   1.551  16.503
   21   2HE   LYS   2          1HE       LYS   2   4.127   0.702  15.048
   22   1HZ   LYS   2          1HZ       LYS   2   4.756   2.889  14.679
   23   2HZ   LYS   2          2HZ       LYS   2   3.342   3.531  15.349
   24   3HZ   LYS   2          3HZ       LYS   2   3.293   2.777  13.835
   25    H    ARG   3           H        ARG   3  -1.038   1.112  11.479
   26    HA   ARG   3           HA       ARG   3  -2.684  -1.128  10.708
   27   1HB   ARG   3          2HB       ARG   3  -4.637   0.200  10.121
   28   2HB   ARG   3          1HB       ARG   3  -4.305   0.294  11.845
   29   1HG   ARG   3          2HG       ARG   3  -3.141   2.383  10.118
   30   2HG   ARG   3          1HG       ARG   3  -4.883   2.413  10.385
   31   1HD   ARG   3          2HD       ARG   3  -3.861   1.971  12.906
   32   2HD   ARG   3          1HD       ARG   3  -2.699   3.088  12.192
   33    HE   ARG   3           HE       ARG   3  -5.439   3.879  11.830
   34   1HH1  ARG   3          1HH1      ARG   3  -2.680   4.003  13.964
   35   2HH1  ARG   3          2HH1      ARG   3  -3.211   5.440  14.770
   36   1HH2  ARG   3          1HH2      ARG   3  -6.138   5.771  12.889
   37   2HH2  ARG   3          2HH2      ARG   3  -5.174   6.444  14.160
   38    H    VAL   4           H        VAL   4  -2.531  -1.547   8.587
   39    HA   VAL   4           HA       VAL   4  -1.255   0.500   6.891
   40    HB   VAL   4           HB       VAL   4  -1.043  -2.503   6.606
   41   1HG1  VAL   4          1HG1      VAL   4   0.029  -0.198   5.032
   42   2HG1  VAL   4          2HG1      VAL   4  -0.720  -1.689   4.465
   43   3HG1  VAL   4          3HG1      VAL   4   0.924  -1.715   5.103
   44   1HG2  VAL   4          1HG2      VAL   4   1.031  -0.541   7.584
   45   2HG2  VAL   4          2HG2      VAL   4   1.232  -2.285   7.406
   46   3HG2  VAL   4          3HG2      VAL   4   0.114  -1.643   8.611
   47    H    LEU   5           H        LEU   5  -1.786   0.332   4.553
   48    HA   LEU   5           HA       LEU   5  -4.558  -0.587   4.168
   49   1HB   LEU   5          2HB       LEU   5  -4.420   1.839   4.172
   50   2HB   LEU   5          1HB       LEU   5  -3.159   1.797   2.955
   51    HG   LEU   5           HG       LEU   5  -4.774   0.839   1.342
   52   1HD1  LEU   5          1HD1      LEU   5  -6.896   0.271   1.850
   53   2HD1  LEU   5          2HD1      LEU   5  -7.078   1.571   3.028
   54   3HD1  LEU   5          3HD1      LEU   5  -6.230   0.092   3.471
   55   1HD2  LEU   5          1HD2      LEU   5  -6.364   3.020   1.586
   56   2HD2  LEU   5          2HD2      LEU   5  -4.749   3.038   0.878
   57   3HD2  LEU   5          3HD2      LEU   5  -4.978   3.503   2.563
   58    H    VAL   6           H        VAL   6  -5.125  -1.521   2.214
   59    HA   VAL   6           HA       VAL   6  -2.901  -2.239   0.419
   60    HB   VAL   6           HB       VAL   6  -5.207  -4.093   0.965
   61   1HG1  VAL   6          1HG1      VAL   6  -2.698  -4.178  -0.575
   62   2HG1  VAL   6          2HG1      VAL   6  -4.238  -4.990  -0.860
   63   3HG1  VAL   6          3HG1      VAL   6  -3.102  -5.644   0.319
   64   1HG2  VAL   6          1HG2      VAL   6  -3.989  -5.242   2.629
   65   2HG2  VAL   6          2HG2      VAL   6  -3.921  -3.537   3.075
   66   3HG2  VAL   6          3HG2      VAL   6  -2.528  -4.305   2.315
   67    H    VAL   7           H        VAL   7  -3.338  -2.278  -1.755
   68    HA   VAL   7           HA       VAL   7  -6.078  -1.665  -2.615
   69    HB   VAL   7           HB       VAL   7  -3.697  -0.300  -3.863
   70   1HG1  VAL   7          1HG1      VAL   7  -6.173  -0.637  -4.845
   71   2HG1  VAL   7          2HG1      VAL   7  -5.173   0.774  -5.190
   72   3HG1  VAL   7          3HG1      VAL   7  -6.408   0.855  -3.935
   73   1HG2  VAL   7          1HG2      VAL   7  -5.451   0.658  -1.612
   74   2HG2  VAL   7          2HG2      VAL   7  -4.498   1.745  -2.622
   75   3HG2  VAL   7          3HG2      VAL   7  -3.693   0.523  -1.638
   76    H    ASP   8           H        ASP   8  -6.684  -3.271  -3.918
   77    HA   ASP   8           HA       ASP   8  -4.921  -4.099  -6.074
   78   1HB   ASP   8          2HB       ASP   8  -4.178  -5.703  -4.531
   79   2HB   ASP   8          1HB       ASP   8  -5.773  -5.899  -3.819
   80    H    ASP   9           H        ASP   9  -6.016  -5.255  -7.744
   81    HA   ASP   9           HA       ASP   9  -8.820  -4.540  -7.923
   82   1HB   ASP   9          2HB       ASP   9  -7.316  -4.110  -9.827
   83   2HB   ASP   9          1HB       ASP   9  -6.999  -5.835  -9.966
   84    H    GLU  10           H        GLU  10  -8.588  -6.394  -5.988
   85    HA   GLU  10           HA       GLU  10 -10.134  -8.584  -7.059
   86   1HB   GLU  10          2HB       GLU  10  -7.465  -9.035  -6.956
   87   2HB   GLU  10          1HB       GLU  10  -7.927  -9.536  -5.335
   88   1HG   GLU  10          2HG       GLU  10  -9.589 -10.569  -7.540
   89   2HG   GLU  10          1HG       GLU  10  -7.933 -11.169  -7.456
   90    H    GLU  11           H        GLU  11 -11.376  -9.643  -5.489
   91    HA   GLU  11           HA       GLU  11 -12.030  -8.082  -3.214
   92   1HB   GLU  11          2HB       GLU  11 -12.957 -10.635  -4.402
   93   2HB   GLU  11          1HB       GLU  11 -13.287 -10.402  -2.692
   94   1HG   GLU  11          2HG       GLU  11 -13.947  -8.074  -4.306
   95   2HG   GLU  11          1HG       GLU  11 -14.838  -9.521  -4.774
   96    H    SER  12           H        SER  12 -12.120  -8.943  -0.980
   97    HA   SER  12           HA       SER  12 -11.121  -9.732   0.903
   98   1HB   SER  12          2HB       SER  12  -9.768 -11.797  -0.839
   99   2HB   SER  12          1HB       SER  12 -10.147 -11.914   0.879
  100    HG   SER  12           HG       SER  12 -12.214 -12.288   0.420
  101    H    ILE  13           H        ILE  13  -8.679 -10.675   1.541
  102    HA   ILE  13           HA       ILE  13  -7.002  -8.375   1.103
  103    HB   ILE  13           HB       ILE  13  -6.236 -10.913   2.526
  104   1HG1  ILE  13          2HG1      ILE  13  -8.378 -10.070   3.421
  105   2HG1  ILE  13          1HG1      ILE  13  -7.073  -9.915   4.591
  106   1HG2  ILE  13          1HG2      ILE  13  -4.317  -9.649   2.307
  107   2HG2  ILE  13          2HG2      ILE  13  -4.919  -9.155   3.888
  108   3HG2  ILE  13          3HG2      ILE  13  -5.179  -8.121   2.484
  109   1HD1  ILE  13          1HD1      ILE  13  -6.930  -7.501   3.452
  110   2HD1  ILE  13          2HD1      ILE  13  -7.953  -7.864   4.843
  111   3HD1  ILE  13          3HD1      ILE  13  -8.645  -7.841   3.220
  112    H    THR  14           H        THR  14  -4.657  -8.694   0.576
  113    HA   THR  14           HA       THR  14  -4.445 -10.131  -1.910
  114    HB   THR  14           HB       THR  14  -2.314  -9.043  -2.163
  115    HG1  THR  14           1HG      THR  14  -1.281  -8.041  -0.508
  116   1HG2  THR  14          1HG2      THR  14  -2.840  -6.658  -1.704
  117   2HG2  THR  14          2HG2      THR  14  -4.304  -7.193  -0.879
  118   3HG2  THR  14          3HG2      THR  14  -4.091  -7.521  -2.599
  119    H    SER  15           H        SER  15  -3.594 -12.071  -2.205
  120    HA   SER  15           HA       SER  15  -3.218 -14.013  -0.430
  121   1HB   SER  15          2HB       SER  15  -2.044 -15.240  -2.039
  122   2HB   SER  15          1HB       SER  15  -2.927 -14.054  -2.999
  123    HG   SER  15           HG       SER  15  -1.104 -13.070  -3.492
  124    H    SER  16           H        SER  16  -1.952 -14.545   1.203
  125    HA   SER  16           HA       SER  16  -0.088 -14.802   2.502
  126   1HB   SER  16          2HB       SER  16   2.030 -14.338   1.730
  127   2HB   SER  16          1HB       SER  16   1.144 -14.378   0.206
  128    HG   SER  16           HG       SER  16   1.945 -12.108   1.695
  129    H    LEU  17           H        LEU  17  -0.704 -11.478   1.396
  130    HA   LEU  17           HA       LEU  17   0.370 -10.080   3.521
  131   1HB   LEU  17          2HB       LEU  17  -0.815  -9.334   1.301
  132   2HB   LEU  17          1HB       LEU  17  -2.238  -9.243   2.311
  133    HG   LEU  17           HG       LEU  17  -0.431  -7.214   1.844
  134   1HD1  LEU  17          1HD1      LEU  17  -1.658  -6.287   4.011
  135   2HD1  LEU  17          2HD1      LEU  17  -2.664  -7.705   3.713
  136   3HD1  LEU  17          3HD1      LEU  17  -2.472  -6.482   2.459
  137   1HD2  LEU  17          1HD2      LEU  17   0.478  -6.731   4.141
  138   2HD2  LEU  17          2HD2      LEU  17   1.285  -8.027   3.261
  139   3HD2  LEU  17          3HD2      LEU  17   0.142  -8.413   4.546
  140    H    SER  18           H        SER  18  -2.964 -11.306   3.205
  141    HA   SER  18           HA       SER  18  -4.017 -10.417   5.592
  142   1HB   SER  18          2HB       SER  18  -4.978 -11.937   3.593
  143   2HB   SER  18          1HB       SER  18  -4.727 -13.193   4.804
  144    HG   SER  18           HG       SER  18  -6.168 -12.235   6.123
  145    H    ALA  19           H        ALA  19  -2.772 -13.729   5.116
  146    HA   ALA  19           HA       ALA  19  -2.759 -14.576   7.718
  147   1HB   ALA  19          1HB       ALA  19  -2.032 -15.740   5.469
  148   2HB   ALA  19          2HB       ALA  19  -1.461 -16.331   7.029
  149   3HB   ALA  19          3HB       ALA  19  -0.418 -15.314   6.036
  150    H    ILE  20           H        ILE  20  -0.300 -12.645   6.079
  151    HA   ILE  20           HA       ILE  20   1.641 -12.661   8.092
  152    HB   ILE  20           HB       ILE  20   1.007 -10.695   5.901
  153   1HG1  ILE  20          2HG1      ILE  20   3.314 -12.589   6.395
  154   2HG1  ILE  20          1HG1      ILE  20   1.979 -12.860   5.281
  155   1HG2  ILE  20          1HG2      ILE  20   2.841 -10.346   8.195
  156   2HG2  ILE  20          2HG2      ILE  20   2.014  -9.142   7.207
  157   3HG2  ILE  20          3HG2      ILE  20   3.475  -9.924   6.606
  158   1HD1  ILE  20          1HD1      ILE  20   4.416 -11.327   4.935
  159   2HD1  ILE  20          2HD1      ILE  20   2.967 -10.434   4.474
  160   3HD1  ILE  20          3HD1      ILE  20   3.313 -11.997   3.733
  161    H    LEU  21           H        LEU  21  -0.543  -9.915   7.362
  162    HA   LEU  21           HA       LEU  21  -0.099  -8.443   9.640
  163   1HB   LEU  21          2HB       LEU  21  -2.741  -8.808   8.236
  164   2HB   LEU  21          1HB       LEU  21  -2.311  -7.471   9.284
  165    HG   LEU  21           HG       LEU  21  -0.414  -7.816   7.107
  166   1HD1  LEU  21          1HD1      LEU  21  -1.803  -8.185   5.427
  167   2HD1  LEU  21          2HD1      LEU  21  -2.524  -6.610   5.755
  168   3HD1  LEU  21          3HD1      LEU  21  -3.212  -8.063   6.481
  169   1HD2  LEU  21          1HD2      LEU  21  -2.148  -5.520   8.001
  170   2HD2  LEU  21          2HD2      LEU  21  -0.800  -5.417   6.867
  171   3HD2  LEU  21          3HD2      LEU  21  -0.506  -5.858   8.550
  172    H    GLU  22           H        GLU  22  -2.053 -11.312   9.247
  173    HA   GLU  22           HA       GLU  22  -3.457 -11.143  11.701
  174   1HB   GLU  22          2HB       GLU  22  -3.013 -13.198   9.629
  175   2HB   GLU  22          1HB       GLU  22  -3.443 -13.787  11.230
  176   1HG   GLU  22          2HG       GLU  22  -5.535 -12.868  11.161
  177   2HG   GLU  22          1HG       GLU  22  -5.061 -11.602  10.028
  178    H    GLU  23           H        GLU  23  -0.314 -12.373  10.785
  179    HA   GLU  23           HA       GLU  23   0.115 -13.660  13.342
  180   1HB   GLU  23          2HB       GLU  23   1.141 -14.778  11.539
  181   2HB   GLU  23          1HB       GLU  23   1.771 -13.285  10.858
  182   1HG   GLU  23          2HG       GLU  23   3.638 -13.399  12.053
  183   2HG   GLU  23          1HG       GLU  23   2.771 -13.808  13.532
  184    H    GLU  24           H        GLU  24   0.996 -10.697  11.695
  185    HA   GLU  24           HA       GLU  24   2.841  -9.858  13.744
  186   1HB   GLU  24          2HB       GLU  24   1.639  -8.207  11.516
  187   2HB   GLU  24          1HB       GLU  24   3.084  -7.838  12.447
  188   1HG   GLU  24          2HG       GLU  24   2.807 -10.245  10.668
  189   2HG   GLU  24          1HG       GLU  24   3.505  -8.710  10.153
  190    H    GLY  25           H        GLY  25  -0.487  -9.142  12.818
  191   1HA   GLY  25          2HA       GLY  25  -2.177  -8.459  14.297
  192   2HA   GLY  25          1HA       GLY  25  -0.943  -8.018  15.466
  193    H    TYR  26           H        TYR  26  -2.379  -7.051  12.378
  194    HA   TYR  26           HA       TYR  26  -1.857  -4.247  13.113
  195   1HB   TYR  26          2HB       TYR  26  -1.349  -5.643  10.507
  196   2HB   TYR  26          1HB       TYR  26  -1.717  -3.927  10.525
  197    HD1  TYR  26           1HD      TYR  26  -0.102  -2.324  11.228
  198    HD2  TYR  26           2HD      TYR  26   0.710  -6.482  11.607
  199    HE1  TYR  26           1HE      TYR  26   2.262  -1.816  11.669
  200    HE2  TYR  26           2HE      TYR  26   3.076  -5.985  12.047
  201    HH   TYR  26           HH       TYR  26   4.692  -4.204  11.650
  202    H    HIS  27           H        HIS  27  -3.104  -2.904  11.240
  203    HA   HIS  27           HA       HIS  27  -5.878  -3.889  11.212
  204   1HB   HIS  27          2HB       HIS  27  -4.808  -1.488  12.351
  205   2HB   HIS  27          1HB       HIS  27  -5.834  -1.046  10.991
  206    HD1  HIS  27           1HD      HIS  27  -8.145  -0.599  11.707
  207    HD2  HIS  27           2HD      HIS  27  -6.360  -3.533  14.045
  208    HE1  HIS  27           1HE      HIS  27  -9.885  -1.263  13.396
  209    HE2  HIS  27           2HE      HIS  27  -8.750  -2.971  14.859
  210    HA   PRO  28           HA       PRO  28  -4.526  -3.139   6.896
  211   1HB   PRO  28          2HB       PRO  28  -5.205  -5.512   5.867
  212   2HB   PRO  28          1HB       PRO  28  -3.715  -5.288   6.790
  213   1HG   PRO  28          2HG       PRO  28  -6.296  -6.520   7.626
  214   2HG   PRO  28          1HG       PRO  28  -4.641  -6.984   8.050
  215   1HD   PRO  28          2HD       PRO  28  -6.364  -5.484   9.645
  216   2HD   PRO  28          1HD       PRO  28  -4.604  -5.578   9.838
  217    H    ASP  29           H        ASP  29  -5.719  -2.217   5.401
  218    HA   ASP  29           HA       ASP  29  -8.589  -2.856   5.231
  219   1HB   ASP  29          2HB       ASP  29  -8.376  -0.654   6.242
  220   2HB   ASP  29          1HB       ASP  29  -7.260  -0.144   4.984
  221    H    THR  30           H        THR  30  -9.225  -3.479   3.230
  222    HA   THR  30           HA       THR  30  -7.219  -3.317   1.113
  223    HB   THR  30           HB       THR  30  -8.559  -5.052  -0.013
  224    HG1  THR  30           1HG      THR  30 -10.378  -5.839   0.908
  225   1HG2  THR  30          1HG2      THR  30  -8.208  -6.876   1.539
  226   2HG2  THR  30          2HG2      THR  30  -7.999  -5.729   2.863
  227   3HG2  THR  30          3HG2      THR  30  -6.829  -5.776   1.544
  228    H    ALA  31           H        ALA  31  -7.603  -2.604  -0.923
  229    HA   ALA  31           HA       ALA  31 -10.080  -1.086  -1.389
  230   1HB   ALA  31          1HB       ALA  31  -8.011   0.326  -0.849
  231   2HB   ALA  31          2HB       ALA  31  -8.907   0.729  -2.314
  232   3HB   ALA  31          3HB       ALA  31  -7.404  -0.188  -2.424
  233    H    LYS  32           H        LYS  32 -11.074  -1.612  -3.249
  234    HA   LYS  32           HA       LYS  32  -9.872  -3.623  -4.924
  235   1HB   LYS  32          2HB       LYS  32 -12.461  -2.362  -5.672
  236   2HB   LYS  32          1HB       LYS  32 -11.972  -4.049  -5.744
  237   1HG   LYS  32          2HG       LYS  32 -12.236  -4.273  -3.363
  238   2HG   LYS  32          1HG       LYS  32 -12.586  -2.554  -3.213
  239   1HD   LYS  32          2HD       LYS  32 -14.549  -2.951  -4.761
  240   2HD   LYS  32          1HD       LYS  32 -14.257  -4.677  -4.538
  241   1HE   LYS  32          2HE       LYS  32 -14.456  -2.997  -2.103
  242   2HE   LYS  32          1HE       LYS  32 -15.942  -3.292  -3.006
  243   1HZ   LYS  32          1HZ       LYS  32 -15.802  -5.565  -2.644
  244   2HZ   LYS  32          2HZ       LYS  32 -15.298  -4.922  -1.164
  245   3HZ   LYS  32          3HZ       LYS  32 -14.156  -5.521  -2.259
  246    H    THR  33           H        THR  33  -9.860  -0.271  -4.924
  247    HA   THR  33           HA       THR  33  -8.494  -0.121  -7.392
  248    HB   THR  33           HB       THR  33 -10.378   1.595  -8.246
  249    HG1  THR  33           1HG      THR  33 -12.238   1.232  -7.385
  250   1HG2  THR  33          1HG2      THR  33  -9.398  -0.643  -9.266
  251   2HG2  THR  33          2HG2      THR  33 -10.817   0.161  -9.939
  252   3HG2  THR  33          3HG2      THR  33 -11.014  -1.225  -8.865
  253    H    LEU  34           H        LEU  34  -8.038   2.216  -7.972
  254    HA   LEU  34           HA       LEU  34  -7.089   3.573  -5.716
  255   1HB   LEU  34          2HB       LEU  34  -7.664   4.788  -8.418
  256   2HB   LEU  34          1HB       LEU  34  -6.533   5.383  -7.217
  257    HG   LEU  34           HG       LEU  34  -6.221   2.696  -8.541
  258   1HD1  LEU  34          1HD1      LEU  34  -4.998   5.324  -9.363
  259   2HD1  LEU  34          2HD1      LEU  34  -6.205   4.411 -10.270
  260   3HD1  LEU  34          3HD1      LEU  34  -4.592   3.741 -10.025
  261   1HD2  LEU  34          1HD2      LEU  34  -5.031   3.665  -6.314
  262   2HD2  LEU  34          2HD2      LEU  34  -3.910   4.222  -7.556
  263   3HD2  LEU  34          3HD2      LEU  34  -4.286   2.505  -7.413
  264    H    ARG  35           H        ARG  35 -10.187   3.541  -7.202
  265    HA   ARG  35           HA       ARG  35 -11.095   6.047  -6.143
  266   1HB   ARG  35          2HB       ARG  35 -12.015   4.502  -8.126
  267   2HB   ARG  35          1HB       ARG  35 -13.029   3.889  -6.826
  268   1HG   ARG  35          2HG       ARG  35 -12.994   6.762  -6.791
  269   2HG   ARG  35          1HG       ARG  35 -13.444   6.168  -8.390
  270   1HD   ARG  35          2HD       ARG  35 -14.735   4.747  -6.179
  271   2HD   ARG  35          1HD       ARG  35 -15.147   6.460  -6.271
  272    HE   ARG  35           HE       ARG  35 -16.088   4.421  -7.973
  273   1HH1  ARG  35          1HH1      ARG  35 -14.957   7.721  -8.071
  274   2HH1  ARG  35          2HH1      ARG  35 -15.877   8.126  -9.480
  275   1HH2  ARG  35          1HH2      ARG  35 -17.300   4.952  -9.827
  276   2HH2  ARG  35          2HH2      ARG  35 -17.208   6.555 -10.477
  277    H    GLU  36           H        GLU  36 -11.476   2.626  -5.280
  278    HA   GLU  36           HA       GLU  36 -13.069   3.075  -2.984
  279   1HB   GLU  36          2HB       GLU  36 -12.381   0.854  -4.368
  280   2HB   GLU  36          1HB       GLU  36 -11.278   0.708  -3.006
  281   1HG   GLU  36          2HG       GLU  36 -14.276   0.907  -2.888
  282   2HG   GLU  36          1HG       GLU  36 -13.289  -0.514  -2.547
  283    H    ALA  37           H        ALA  37  -9.626   3.101  -3.588
  284    HA   ALA  37           HA       ALA  37  -8.858   3.041  -0.829
  285   1HB   ALA  37          1HB       ALA  37  -7.159   4.113  -3.061
  286   2HB   ALA  37          2HB       ALA  37  -7.439   2.383  -2.858
  287   3HB   ALA  37          3HB       ALA  37  -6.653   3.306  -1.576
  288    H    GLU  38           H        GLU  38  -8.830   5.628  -3.298
  289    HA   GLU  38           HA       GLU  38  -8.054   7.755  -1.782
  290   1HB   GLU  38          2HB       GLU  38 -10.139   7.630  -3.952
  291   2HB   GLU  38          1HB       GLU  38  -9.602   9.146  -3.241
  292   1HG   GLU  38          2HG       GLU  38  -7.475   8.965  -4.138
  293   2HG   GLU  38          1HG       GLU  38  -7.622   7.227  -4.390
  294    H    LYS  39           H        LYS  39 -11.310   6.373  -1.958
  295    HA   LYS  39           HA       LYS  39 -12.557   8.261  -0.279
  296   1HB   LYS  39          2HB       LYS  39 -13.792   6.644  -1.689
  297   2HB   LYS  39          1HB       LYS  39 -13.240   5.337  -0.650
  298   1HG   LYS  39          2HG       LYS  39 -14.753   7.631   0.516
  299   2HG   LYS  39          1HG       LYS  39 -15.608   6.334  -0.320
  300   1HD   LYS  39          2HD       LYS  39 -14.208   4.772   1.213
  301   2HD   LYS  39          1HD       LYS  39 -13.986   6.222   2.194
  302   1HE   LYS  39          2HE       LYS  39 -16.356   6.462   2.479
  303   2HE   LYS  39          1HE       LYS  39 -16.672   5.158   1.335
  304   1HZ   LYS  39          1HZ       LYS  39 -15.216   4.797   3.895
  305   2HZ   LYS  39          2HZ       LYS  39 -15.742   3.582   2.841
  306   3HZ   LYS  39          3HZ       LYS  39 -16.870   4.504   3.701
  307    H    LYS  40           H        LYS  40 -11.221   5.038   0.414
  308    HA   LYS  40           HA       LYS  40 -11.585   5.113   3.191
  309   1HB   LYS  40          2HB       LYS  40  -9.463   3.655   1.607
  310   2HB   LYS  40          1HB       LYS  40  -9.906   3.315   3.273
  311   1HG   LYS  40          2HG       LYS  40 -12.190   3.268   1.477
  312   2HG   LYS  40          1HG       LYS  40 -10.941   2.102   1.033
  313   1HD   LYS  40          2HD       LYS  40 -11.397   0.792   2.789
  314   2HD   LYS  40          1HD       LYS  40 -11.459   2.162   3.898
  315   1HE   LYS  40          2HE       LYS  40 -13.748   2.555   2.541
  316   2HE   LYS  40          1HE       LYS  40 -13.630   0.799   2.435
  317   1HZ   LYS  40          1HZ       LYS  40 -14.117   2.488   4.748
  318   2HZ   LYS  40          2HZ       LYS  40 -13.097   1.165   5.009
  319   3HZ   LYS  40          3HZ       LYS  40 -14.664   0.923   4.416
  320    H    ILE  41           H        ILE  41  -9.094   6.479   1.145
  321    HA   ILE  41           HA       ILE  41  -7.428   7.141   3.448
  322    HB   ILE  41           HB       ILE  41  -6.978   7.819   0.545
  323   1HG1  ILE  41          2HG1      ILE  41  -5.723   5.576   2.131
  324   2HG1  ILE  41          1HG1      ILE  41  -7.117   5.349   1.081
  325   1HG2  ILE  41          1HG2      ILE  41  -5.485   8.305   3.037
  326   2HG2  ILE  41          2HG2      ILE  41  -5.485   9.202   1.518
  327   3HG2  ILE  41          3HG2      ILE  41  -4.531   7.726   1.671
  328   1HD1  ILE  41          1HD1      ILE  41  -5.740   5.032  -0.613
  329   2HD1  ILE  41          2HD1      ILE  41  -4.351   5.381   0.416
  330   3HD1  ILE  41          3HD1      ILE  41  -5.168   6.690  -0.437
  331    H    LYS  42           H        LYS  42 -10.027   8.513   1.813
  332    HA   LYS  42           HA       LYS  42  -9.243  11.251   1.918
  333   1HB   LYS  42          2HB       LYS  42 -10.895  10.658   0.317
  334   2HB   LYS  42          1HB       LYS  42 -11.880   9.844   1.524
  335   1HG   LYS  42          2HG       LYS  42 -12.831  11.756   2.238
  336   2HG   LYS  42          1HG       LYS  42 -11.376  12.715   1.960
  337   1HD   LYS  42          2HD       LYS  42 -11.807  12.754  -0.418
  338   2HD   LYS  42          1HD       LYS  42 -13.189  11.676  -0.216
  339   1HE   LYS  42          2HE       LYS  42 -14.539  13.326   0.538
  340   2HE   LYS  42          1HE       LYS  42 -13.233  14.147   1.392
  341   1HZ   LYS  42          1HZ       LYS  42 -13.604  14.194  -1.554
  342   2HZ   LYS  42          2HZ       LYS  42 -12.460  15.069  -0.667
  343   3HZ   LYS  42          3HZ       LYS  42 -14.108  15.421  -0.505
  344    H    GLU  43           H        GLU  43 -10.073   9.050   4.306
  345    HA   GLU  43           HA       GLU  43 -10.595  11.229   6.185
  346   1HB   GLU  43          2HB       GLU  43 -12.160   8.644   6.147
  347   2HB   GLU  43          1HB       GLU  43 -12.348   9.956   7.303
  348   1HG   GLU  43          2HG       GLU  43 -13.136  11.428   5.553
  349   2HG   GLU  43          1HG       GLU  43 -12.873  10.168   4.347
  350    H    LEU  44           H        LEU  44  -9.890   7.773   5.811
  351    HA   LEU  44           HA       LEU  44  -8.754   7.513   8.421
  352   1HB   LEU  44          2HB       LEU  44  -9.567   5.783   6.372
  353   2HB   LEU  44          1HB       LEU  44  -7.844   5.510   6.543
  354    HG   LEU  44           HG       LEU  44  -9.130   3.950   7.907
  355   1HD1  LEU  44          1HD1      LEU  44  -7.651   3.989   9.601
  356   2HD1  LEU  44          2HD1      LEU  44  -8.003   5.669  10.012
  357   3HD1  LEU  44          3HD1      LEU  44  -6.922   5.296   8.669
  358   1HD2  LEU  44          1HD2      LEU  44 -11.113   4.900   8.523
  359   2HD2  LEU  44          2HD2      LEU  44 -10.382   6.466   8.875
  360   3HD2  LEU  44          3HD2      LEU  44 -10.195   5.131  10.011
  361    H    PHE  45           H        PHE  45  -6.842   8.261   9.029
  362    HA   PHE  45           HA       PHE  45  -4.916   9.194   7.117
  363   1HB   PHE  45          2HB       PHE  45  -5.377  10.253   9.374
  364   2HB   PHE  45          1HB       PHE  45  -4.515   8.899  10.096
  365    HD1  PHE  45           1HD      PHE  45  -3.810  10.924   7.049
  366    HD2  PHE  45           2HD      PHE  45  -2.517   9.700  10.914
  367    HE1  PHE  45           1HE      PHE  45  -1.678  12.104   6.705
  368    HE2  PHE  45           2HE      PHE  45  -0.383  10.878  10.578
  369    HZ   PHE  45           HZ       PHE  45   0.040  12.082   8.472
  370    H    PHE  46           H        PHE  46  -4.951   6.835   6.239
  371    HA   PHE  46           HA       PHE  46  -3.651   4.744   7.517
  372   1HB   PHE  46          2HB       PHE  46  -3.985   5.495   4.632
  373   2HB   PHE  46          1HB       PHE  46  -2.988   4.113   5.073
  374    HD1  PHE  46           1HD      PHE  46  -6.114   4.987   3.990
  375    HD2  PHE  46           2HD      PHE  46  -4.243   2.583   6.962
  376    HE1  PHE  46           1HE      PHE  46  -8.129   3.581   4.114
  377    HE2  PHE  46           2HE      PHE  46  -6.257   1.171   7.092
  378    HZ   PHE  46           HZ       PHE  46  -8.203   1.673   5.668
  379    HA   PRO  47           HA       PRO  47   0.451   6.580   7.742
  380   1HB   PRO  47          2HB       PRO  47   1.609   4.593   9.162
  381   2HB   PRO  47          1HB       PRO  47   0.530   5.781   9.903
  382   1HG   PRO  47          2HG       PRO  47  -0.054   2.984   9.020
  383   2HG   PRO  47          1HG       PRO  47  -0.557   3.817  10.502
  384   1HD   PRO  47          2HD       PRO  47  -2.189   3.506   8.351
  385   2HD   PRO  47          1HD       PRO  47  -2.298   4.892   9.455
  386    H    VAL  48           H        VAL  48  -0.269   3.290   6.712
  387    HA   VAL  48           HA       VAL  48   1.979   3.458   4.831
  388    HB   VAL  48           HB       VAL  48   1.192   0.864   6.127
  389   1HG1  VAL  48          1HG1      VAL  48   2.643   1.259   3.929
  390   2HG1  VAL  48          2HG1      VAL  48   2.985  -0.043   5.070
  391   3HG1  VAL  48          3HG1      VAL  48   3.918   1.453   5.133
  392   1HG2  VAL  48          1HG2      VAL  48   1.849   2.185   7.970
  393   2HG2  VAL  48          2HG2      VAL  48   3.185   2.904   7.070
  394   3HG2  VAL  48          3HG2      VAL  48   3.253   1.206   7.543
  395    H    ILE  49           H        ILE  49   1.468   3.035   2.796
  396    HA   ILE  49           HA       ILE  49  -1.107   1.721   2.229
  397    HB   ILE  49           HB       ILE  49   0.230   3.703   0.398
  398   1HG1  ILE  49          2HG1      ILE  49  -0.266   4.786   2.573
  399   2HG1  ILE  49          1HG1      ILE  49  -1.256   5.423   1.265
  400   1HG2  ILE  49          1HG2      ILE  49  -2.670   2.928   0.565
  401   2HG2  ILE  49          2HG2      ILE  49  -1.507   2.066  -0.442
  402   3HG2  ILE  49          3HG2      ILE  49  -1.836   3.772  -0.739
  403   1HD1  ILE  49          1HD1      ILE  49  -2.111   3.460   3.375
  404   2HD1  ILE  49          2HD1      ILE  49  -3.108   3.978   2.016
  405   3HD1  ILE  49          3HD1      ILE  49  -2.599   5.149   3.232
  406    H    VAL  50           H        VAL  50  -1.208   0.220   0.595
  407    HA   VAL  50           HA       VAL  50   1.281  -0.449  -0.810
  408    HB   VAL  50           HB       VAL  50  -0.439  -2.489   0.607
  409   1HG1  VAL  50          1HG1      VAL  50   2.032  -2.761  -1.095
  410   2HG1  VAL  50          2HG1      VAL  50   0.439  -3.459  -1.386
  411   3HG1  VAL  50          3HG1      VAL  50   1.424  -4.038  -0.043
  412   1HG2  VAL  50          1HG2      VAL  50   1.311  -2.756   2.168
  413   2HG2  VAL  50          2HG2      VAL  50   1.044  -1.017   2.036
  414   3HG2  VAL  50          3HG2      VAL  50   2.414  -1.764   1.214
  415    H    LEU  51           H        LEU  51   0.774  -0.164  -2.866
  416    HA   LEU  51           HA       LEU  51  -1.880  -0.935  -3.832
  417   1HB   LEU  51          2HB       LEU  51  -1.228   1.288  -4.443
  418   2HB   LEU  51          1HB       LEU  51   0.313   0.726  -5.062
  419    HG   LEU  51           HG       LEU  51  -0.968  -0.550  -6.821
  420   1HD1  LEU  51          1HD1      LEU  51  -3.135  -0.779  -6.103
  421   2HD1  LEU  51          2HD1      LEU  51  -3.288   0.593  -7.200
  422   3HD1  LEU  51          3HD1      LEU  51  -3.210   0.861  -5.459
  423   1HD2  LEU  51          1HD2      LEU  51  -0.712   2.384  -6.595
  424   2HD2  LEU  51          2HD2      LEU  51  -1.731   1.779  -7.901
  425   3HD2  LEU  51          3HD2      LEU  51  -0.047   1.272  -7.792
  426    H    ASP  52           H        ASP  52  -1.735  -3.145  -4.016
  427    HA   ASP  52           HA       ASP  52   0.446  -4.421  -5.394
  428   1HB   ASP  52          2HB       ASP  52  -0.731  -5.593  -3.593
  429   2HB   ASP  52          1HB       ASP  52  -2.236  -5.507  -4.501
  430    H    VAL  53           H        VAL  53   0.515  -3.560  -7.445
  431    HA   VAL  53           HA       VAL  53  -1.681  -3.208  -9.153
  432    HB   VAL  53           HB       VAL  53  -0.055  -2.988 -10.957
  433   1HG1  VAL  53          1HG1      VAL  53   1.117  -1.110 -10.121
  434   2HG1  VAL  53          2HG1      VAL  53   1.107  -1.747  -8.476
  435   3HG1  VAL  53          3HG1      VAL  53  -0.395  -1.195  -9.217
  436   1HG2  VAL  53          1HG2      VAL  53   1.829  -4.166 -10.981
  437   2HG2  VAL  53          2HG2      VAL  53   1.488  -4.767  -9.359
  438   3HG2  VAL  53          3HG2      VAL  53   2.405  -3.277  -9.572
  439    H    TRP  54           H        TRP  54  -2.872  -5.219  -8.849
  440    HA   TRP  54           HA       TRP  54  -1.746  -7.659  -9.887
  441   1HB   TRP  54          2HB       TRP  54  -3.399  -7.626  -8.028
  442   2HB   TRP  54          1HB       TRP  54  -4.620  -7.044  -9.151
  443    HD1  TRP  54           HD       TRP  54  -3.577  -9.170 -11.522
  444    HE1  TRP  54           1HE      TRP  54  -4.374 -11.599 -11.304
  445    HE3  TRP  54           3HE      TRP  54  -4.806  -9.181  -6.559
  446    HZ2  TRP  54           2HZ      TRP  54  -5.388 -13.306  -9.297
  447    HZ3  TRP  54           3HZ      TRP  54  -5.683 -11.256  -5.568
  448    HH2  TRP  54           HH       TRP  54  -5.967 -13.275  -6.911
  449    H    MET  55           H        MET  55  -4.975  -6.632 -10.855
  450    HA   MET  55           HA       MET  55  -4.080  -6.232 -13.602
  451   1HB   MET  55          2HB       MET  55  -4.923  -8.702 -12.909
  452   2HB   MET  55          1HB       MET  55  -6.465  -7.965 -13.319
  453   1HG   MET  55          2HG       MET  55  -5.445  -7.287 -15.509
  454   2HG   MET  55          1HG       MET  55  -4.058  -8.291 -15.086
  455   1HE   MET  55          1HE       MET  55  -3.724  -9.987 -16.253
  456   2HE   MET  55          2HE       MET  55  -4.835 -11.101 -17.049
  457   3HE   MET  55          3HE       MET  55  -4.386 -11.358 -15.363
  458    HA   PRO  56           HA       PRO  56  -7.686  -3.554 -12.373
  459   1HB   PRO  56          2HB       PRO  56  -6.182  -1.253 -11.822
  460   2HB   PRO  56          1HB       PRO  56  -6.864  -2.359 -10.630
  461   1HG   PRO  56          2HG       PRO  56  -4.129  -1.913 -11.173
  462   2HG   PRO  56          1HG       PRO  56  -4.818  -3.168 -10.132
  463   1HD   PRO  56          2HD       PRO  56  -3.852  -3.351 -12.938
  464   2HD   PRO  56          1HD       PRO  56  -3.866  -4.583 -11.660
  465    H    ASP  57           H        ASP  57  -7.523  -0.837 -13.037
  466    HA   ASP  57           HA       ASP  57  -6.434  -0.582 -15.698
  467   1HB   ASP  57          2HB       ASP  57  -8.587  -1.785 -16.055
  468   2HB   ASP  57          1HB       ASP  57  -9.426  -0.423 -15.321
  469    H    GLY  58           H        GLY  58  -6.245   0.747 -13.068
  470   1HA   GLY  58          2HA       GLY  58  -7.187   3.434 -13.858
  471   2HA   GLY  58          1HA       GLY  58  -7.053   2.904 -12.189
  472    H    ASP  59           H        ASP  59  -5.829   5.204 -13.550
  473    HA   ASP  59           HA       ASP  59  -3.077   4.720 -13.987
  474   1HB   ASP  59          2HB       ASP  59  -4.516   7.273 -13.236
  475   2HB   ASP  59          1HB       ASP  59  -2.842   7.185 -13.777
  476    H    GLY  60           H        GLY  60  -2.508   3.386 -12.172
  477   1HA   GLY  60          2HA       GLY  60  -2.722   4.144  -9.487
  478   2HA   GLY  60          1HA       GLY  60  -1.518   3.037 -10.130
  479    H    VAL  61           H        VAL  61  -0.251   4.911 -11.884
  480    HA   VAL  61           HA       VAL  61   1.651   6.012 -10.149
  481    HB   VAL  61           HB       VAL  61   1.090   6.773 -13.021
  482   1HG1  VAL  61          1HG1      VAL  61   3.442   7.200 -11.209
  483   2HG1  VAL  61          2HG1      VAL  61   2.523   8.397 -12.122
  484   3HG1  VAL  61          3HG1      VAL  61   3.577   7.263 -12.967
  485   1HG2  VAL  61          1HG2      VAL  61   2.900   4.640 -11.891
  486   2HG2  VAL  61          2HG2      VAL  61   2.811   5.115 -13.587
  487   3HG2  VAL  61          3HG2      VAL  61   1.415   4.374 -12.804
  488    H    ASN  62           H        ASN  62  -1.127   7.434 -11.811
  489    HA   ASN  62           HA       ASN  62  -0.576  10.108 -11.005
  490   1HB   ASN  62          2HB       ASN  62  -2.013  10.290 -12.740
  491   2HB   ASN  62          1HB       ASN  62  -2.679   8.684 -12.474
  492   1HD2  ASN  62          1HD2      ASN  62  -4.228   8.484 -10.678
  493   2HD2  ASN  62          2HD2      ASN  62  -5.314   9.795 -10.391
  494    H    PHE  63           H        PHE  63  -1.798   7.390  -9.379
  495    HA   PHE  63           HA       PHE  63  -3.390   8.859  -7.465
  496   1HB   PHE  63          2HB       PHE  63  -4.104   6.622  -8.052
  497   2HB   PHE  63          1HB       PHE  63  -2.538   5.960  -7.597
  498    HD1  PHE  63           1HD      PHE  63  -4.977   8.250  -5.938
  499    HD2  PHE  63           2HD      PHE  63  -2.690   4.669  -5.715
  500    HE1  PHE  63           1HE      PHE  63  -5.807   7.865  -3.654
  501    HE2  PHE  63           2HE      PHE  63  -3.515   4.278  -3.431
  502    HZ   PHE  63           HZ       PHE  63  -5.077   5.879  -2.398
  503    H    ILE  64           H        ILE  64  -0.148   7.591  -7.733
  504    HA   ILE  64           HA       ILE  64   0.695   7.428  -5.124
  505    HB   ILE  64           HB       ILE  64   2.409   8.757  -7.212
  506   1HG1  ILE  64          2HG1      ILE  64   1.545   6.904  -8.412
  507   2HG1  ILE  64          1HG1      ILE  64   3.109   6.377  -7.808
  508   1HG2  ILE  64          1HG2      ILE  64   4.118   7.233  -6.023
  509   2HG2  ILE  64          2HG2      ILE  64   2.897   7.123  -4.755
  510   3HG2  ILE  64          3HG2      ILE  64   3.563   8.694  -5.204
  511   1HD1  ILE  64          1HD1      ILE  64   0.408   5.668  -6.698
  512   2HD1  ILE  64          2HD1      ILE  64   1.945   5.223  -5.958
  513   3HD1  ILE  64          3HD1      ILE  64   1.526   4.607  -7.556
  514    H    ASP  65           H        ASP  65  -0.003  10.298  -6.984
  515    HA   ASP  65           HA       ASP  65   1.240  12.126  -5.166
  516   1HB   ASP  65          2HB       ASP  65   0.692  12.528  -7.641
  517   2HB   ASP  65          1HB       ASP  65  -0.962  12.817  -7.111
  518    H    PHE  66           H        PHE  66  -2.137  11.131  -5.762
  519    HA   PHE  66           HA       PHE  66  -3.456  12.742  -3.979
  520   1HB   PHE  66          2HB       PHE  66  -4.676  11.247  -5.423
  521   2HB   PHE  66          1HB       PHE  66  -3.949   9.836  -4.665
  522    HD1  PHE  66           1HD      PHE  66  -4.495   9.403  -2.208
  523    HD2  PHE  66           2HD      PHE  66  -6.699  12.095  -4.659
  524    HE1  PHE  66           1HE      PHE  66  -6.394   9.261  -0.652
  525    HE2  PHE  66           2HE      PHE  66  -8.602  11.956  -3.106
  526    HZ   PHE  66           HZ       PHE  66  -8.452  10.537  -1.099
  527    H    ILE  67           H        ILE  67  -1.747   9.713  -3.302
  528    HA   ILE  67           HA       ILE  67  -2.408   9.496  -0.586
  529    HB   ILE  67           HB       ILE  67   0.057   8.557  -2.066
  530   1HG1  ILE  67          2HG1      ILE  67  -1.392   6.345  -1.387
  531   2HG1  ILE  67          1HG1      ILE  67  -2.673   7.521  -1.665
  532   1HG2  ILE  67          1HG2      ILE  67   0.907   8.343   0.017
  533   2HG2  ILE  67          2HG2      ILE  67  -0.103   6.897   0.049
  534   3HG2  ILE  67          3HG2      ILE  67  -0.679   8.391   0.786
  535   1HD1  ILE  67          1HD1      ILE  67  -0.765   7.702  -3.776
  536   2HD1  ILE  67          2HD1      ILE  67  -2.470   7.259  -3.847
  537   3HD1  ILE  67          3HD1      ILE  67  -1.248   6.020  -3.562
  538    H    LYS  68           H        LYS  68   0.378  11.036  -2.172
  539    HA   LYS  68           HA       LYS  68   1.441  12.021   0.302
  540   1HB   LYS  68          2HB       LYS  68   3.211  12.878  -0.952
  541   2HB   LYS  68          1HB       LYS  68   2.724  11.452  -1.855
  542   1HG   LYS  68          2HG       LYS  68   2.506  12.694  -3.660
  543   2HG   LYS  68          1HG       LYS  68   1.224  13.608  -2.866
  544   1HD   LYS  68          2HD       LYS  68   2.631  15.315  -2.253
  545   2HD   LYS  68          1HD       LYS  68   4.056  14.273  -2.232
  546   1HE   LYS  68          2HE       LYS  68   2.663  14.809  -4.818
  547   2HE   LYS  68          1HE       LYS  68   3.721  16.043  -4.136
  548   1HZ   LYS  68          1HZ       LYS  68   5.565  14.657  -4.298
  549   2HZ   LYS  68          2HZ       LYS  68   4.732  14.364  -5.740
  550   3HZ   LYS  68          3HZ       LYS  68   4.635  13.254  -4.468
  551    H    GLU  69           H        GLU  69  -0.990  13.042  -1.835
  552    HA   GLU  69           HA       GLU  69  -0.780  15.852  -1.437
  553   1HB   GLU  69          2HB       GLU  69  -1.955  14.664  -3.347
  554   2HB   GLU  69          1HB       GLU  69  -3.260  14.345  -2.217
  555   1HG   GLU  69          2HG       GLU  69  -3.923  16.528  -2.139
  556   2HG   GLU  69          1HG       GLU  69  -2.317  17.143  -2.533
  557    H    ASN  70           H        ASN  70  -2.807  13.308  -0.050
  558    HA   ASN  70           HA       ASN  70  -3.561  15.170   2.105
  559   1HB   ASN  70          2HB       ASN  70  -5.369  13.109   2.294
  560   2HB   ASN  70          1HB       ASN  70  -5.659  14.637   1.468
  561   1HD2  ASN  70          1HD2      ASN  70  -4.692  14.616  -0.849
  562   2HD2  ASN  70          2HD2      ASN  70  -5.081  13.226  -1.793
  563    H    SER  71           H        SER  71  -1.277  13.090   1.664
  564    HA   SER  71           HA       SER  71  -1.175  12.267   4.410
  565   1HB   SER  71          2HB       SER  71  -2.130  10.413   2.383
  566   2HB   SER  71          1HB       SER  71  -0.682   9.808   3.184
  567    HG   SER  71           HG       SER  71  -1.723  10.015   5.157
  568    HA   PRO  72           HA       PRO  72   2.873  12.888   2.184
  569   1HB   PRO  72          2HB       PRO  72   3.412  15.093   3.975
  570   2HB   PRO  72          1HB       PRO  72   3.258  15.116   2.219
  571   1HG   PRO  72          2HG       PRO  72   1.457  16.274   3.924
  572   2HG   PRO  72          1HG       PRO  72   1.055  15.708   2.295
  573   1HD   PRO  72          2HD       PRO  72   0.559  14.397   4.936
  574   2HD   PRO  72          1HD       PRO  72  -0.477  14.463   3.495
  575    H    ASP  73           H        ASP  73   1.793  12.472   5.374
  576    HA   ASP  73           HA       ASP  73   4.481  11.777   6.329
  577   1HB   ASP  73          2HB       ASP  73   2.947  13.402   7.605
  578   2HB   ASP  73          1HB       ASP  73   2.035  11.967   8.061
  579    H    SER  74           H        SER  74   2.803  10.122   4.540
  580    HA   SER  74           HA       SER  74   2.381   7.793   6.290
  581   1HB   SER  74          2HB       SER  74   0.357   8.561   5.097
  582   2HB   SER  74          1HB       SER  74   1.190   8.335   3.560
  583    HG   SER  74           HG       SER  74  -0.070   6.523   4.034
  584    H    VAL  75           H        VAL  75   2.329   5.823   4.362
  585    HA   VAL  75           HA       VAL  75   5.021   5.947   3.174
  586    HB   VAL  75           HB       VAL  75   3.907   3.470   4.488
  587   1HG1  VAL  75          1HG1      VAL  75   5.824   3.690   2.563
  588   2HG1  VAL  75          2HG1      VAL  75   5.735   2.389   3.748
  589   3HG1  VAL  75          3HG1      VAL  75   6.791   3.772   4.033
  590   1HG2  VAL  75          1HG2      VAL  75   4.363   4.593   6.395
  591   2HG2  VAL  75          2HG2      VAL  75   5.422   5.749   5.588
  592   3HG2  VAL  75          3HG2      VAL  75   6.025   4.146   6.011
  593    H    VAL  76           H        VAL  76   5.301   5.069   1.240
  594    HA   VAL  76           HA       VAL  76   3.003   3.712  -0.022
  595    HB   VAL  76           HB       VAL  76   4.791   5.541  -1.592
  596   1HG1  VAL  76          1HG1      VAL  76   2.800   3.756  -2.297
  597   2HG1  VAL  76          2HG1      VAL  76   3.462   5.041  -3.307
  598   3HG1  VAL  76          3HG1      VAL  76   2.004   5.328  -2.357
  599   1HG2  VAL  76          1HG2      VAL  76   2.513   6.271   0.183
  600   2HG2  VAL  76          2HG2      VAL  76   2.714   7.130  -1.344
  601   3HG2  VAL  76          3HG2      VAL  76   4.009   7.144  -0.147
  602    H    ILE  77           H        ILE  77   3.943   1.686   0.256
  603    HA   ILE  77           HA       ILE  77   6.602   1.146  -0.712
  604    HB   ILE  77           HB       ILE  77   4.464  -0.833   0.083
  605   1HG1  ILE  77          2HG1      ILE  77   4.936   0.731   1.913
  606   2HG1  ILE  77          1HG1      ILE  77   5.570  -0.871   2.279
  607   1HG2  ILE  77          1HG2      ILE  77   6.383  -1.684  -1.276
  608   2HG2  ILE  77          2HG2      ILE  77   6.233  -2.415   0.321
  609   3HG2  ILE  77          3HG2      ILE  77   7.456  -1.178   0.029
  610   1HD1  ILE  77          1HD1      ILE  77   7.762   0.159   1.219
  611   2HD1  ILE  77          2HD1      ILE  77   7.342   0.392   2.915
  612   3HD1  ILE  77          3HD1      ILE  77   7.003   1.663   1.740
  613    H    VAL  78           H        VAL  78   3.292   0.475  -1.786
  614    HA   VAL  78           HA       VAL  78   2.466  -0.390  -3.742
  615    HB   VAL  78           HB       VAL  78   4.680   1.329  -4.884
  616   1HG1  VAL  78          1HG1      VAL  78   2.082   0.449  -6.144
  617   2HG1  VAL  78          2HG1      VAL  78   3.666  -0.236  -6.509
  618   3HG1  VAL  78          3HG1      VAL  78   3.327   1.454  -6.886
  619   1HG2  VAL  78          1HG2      VAL  78   2.044   2.483  -4.957
  620   2HG2  VAL  78          2HG2      VAL  78   3.532   3.127  -4.264
  621   3HG2  VAL  78          3HG2      VAL  78   2.495   2.073  -3.303
  622    H    ILE  79           H        ILE  79   2.992  -2.570  -3.509
  623    HA   ILE  79           HA       ILE  79   5.488  -3.490  -4.739
  624    HB   ILE  79           HB       ILE  79   3.580  -5.397  -3.466
  625   1HG1  ILE  79          2HG1      ILE  79   5.460  -3.657  -1.862
  626   2HG1  ILE  79          1HG1      ILE  79   3.715  -3.441  -1.922
  627   1HG2  ILE  79          1HG2      ILE  79   5.384  -6.592  -4.139
  628   2HG2  ILE  79          2HG2      ILE  79   6.004  -6.077  -2.572
  629   3HG2  ILE  79          3HG2      ILE  79   6.476  -5.212  -4.035
  630   1HD1  ILE  79          1HD1      ILE  79   3.663  -4.754  -0.130
  631   2HD1  ILE  79          2HD1      ILE  79   5.313  -5.318  -0.389
  632   3HD1  ILE  79          3HD1      ILE  79   3.975  -6.084  -1.244
  633    H    THR  80           H        THR  80   5.049  -5.808  -5.844
  634    HA   THR  80           HA       THR  80   4.065  -7.022  -7.508
  635    HB   THR  80           HB       THR  80   1.728  -5.112  -7.446
  636    HG1  THR  80           1HG      THR  80   1.850  -5.818  -5.381
  637   1HG2  THR  80          1HG2      THR  80   0.428  -6.889  -8.279
  638   2HG2  THR  80          2HG2      THR  80   1.734  -8.051  -8.043
  639   3HG2  THR  80          3HG2      THR  80   1.873  -6.808  -9.286
  640    H    GLY  81           H        GLY  81   3.895  -6.928  -9.787
  641   1HA   GLY  81          2HA       GLY  81   3.780  -4.501 -11.246
  642   2HA   GLY  81          1HA       GLY  81   5.452  -4.995 -11.037
  643    H    HIS  82           H        HIS  82   6.284  -6.386 -12.462
  644    HA   HIS  82           HA       HIS  82   4.733  -8.421 -13.732
  645   1HB   HIS  82          2HB       HIS  82   4.050  -6.408 -15.036
  646   2HB   HIS  82          1HB       HIS  82   5.734  -6.173 -15.490
  647    HD1  HIS  82           1HD      HIS  82   6.785  -8.017 -17.072
  648    HD2  HIS  82           2HD      HIS  82   2.673  -8.269 -16.528
  649    HE1  HIS  82           1HE      HIS  82   5.958  -9.537 -18.897
  650    HE2  HIS  82           2HE      HIS  82   3.457  -9.611 -18.596
  651    H    GLY  83           H        GLY  83   7.549  -6.465 -14.723
  652   1HA   GLY  83          2HA       GLY  83   9.285  -8.766 -14.194
  653   2HA   GLY  83          1HA       GLY  83   9.231  -8.143 -15.836
  654    H    SER  84           H        SER  84   9.899  -5.920 -16.187
  655    HA   SER  84           HA       SER  84  12.311  -5.315 -14.840
  656   1HB   SER  84          2HB       SER  84  11.955  -4.683 -17.177
  657   2HB   SER  84          1HB       SER  84  10.645  -3.601 -16.702
  658    HG   SER  84           HG       SER  84  13.006  -2.829 -17.003
  659    H    VAL  85           H        VAL  85  12.675  -2.954 -14.043
  660    HA   VAL  85           HA       VAL  85  10.681  -2.477 -11.947
  661    HB   VAL  85           HB       VAL  85  12.493  -1.049 -10.925
  662   1HG1  VAL  85          1HG1      VAL  85  13.485  -3.848 -11.287
  663   2HG1  VAL  85          2HG1      VAL  85  11.959  -3.540 -10.459
  664   3HG1  VAL  85          3HG1      VAL  85  13.458  -2.851  -9.832
  665   1HG2  VAL  85          1HG2      VAL  85  14.547  -2.446 -12.508
  666   2HG2  VAL  85          2HG2      VAL  85  14.537  -0.809 -11.850
  667   3HG2  VAL  85          3HG2      VAL  85  13.676  -1.163 -13.348
  668    H    ASP  86           H        ASP  86  10.232  -1.588 -14.663
  669    HA   ASP  86           HA       ASP  86  10.775   1.224 -14.795
  670   1HB   ASP  86          2HB       ASP  86   9.243   1.156 -16.774
  671   2HB   ASP  86          1HB       ASP  86  10.569   0.001 -16.863
  672    H    THR  87           H        THR  87   8.024  -0.771 -13.836
  673    HA   THR  87           HA       THR  87   6.252   1.463 -13.529
  674    HB   THR  87           HB       THR  87   5.714  -1.116 -13.820
  675    HG1  THR  87           1HG      THR  87   4.161   0.474 -12.068
  676   1HG2  THR  87          1HG2      THR  87   6.777  -1.756 -11.644
  677   2HG2  THR  87          2HG2      THR  87   5.100  -2.265 -11.838
  678   3HG2  THR  87          3HG2      THR  87   5.487  -0.869 -10.832
  679    H    ALA  88           H        ALA  88   8.503  -0.286 -11.540
  680    HA   ALA  88           HA       ALA  88   7.741   0.659  -9.014
  681   1HB   ALA  88          1HB       ALA  88  10.087   0.139  -8.371
  682   2HB   ALA  88          2HB       ALA  88  10.447  -0.149 -10.072
  683   3HB   ALA  88          3HB       ALA  88   9.289  -1.177  -9.230
  684    H    VAL  89           H        VAL  89  10.363   1.776 -11.126
  685    HA   VAL  89           HA       VAL  89  11.005   4.069  -9.676
  686    HB   VAL  89           HB       VAL  89  12.211   4.826 -11.619
  687   1HG1  VAL  89          1HG1      VAL  89  12.308   2.010 -10.792
  688   2HG1  VAL  89          2HG1      VAL  89  13.585   3.226 -10.843
  689   3HG1  VAL  89          3HG1      VAL  89  13.122   2.371 -12.315
  690   1HG2  VAL  89          1HG2      VAL  89  11.407   4.587 -13.676
  691   2HG2  VAL  89          2HG2      VAL  89  10.107   3.570 -13.057
  692   3HG2  VAL  89          3HG2      VAL  89  11.628   2.841 -13.566
  693    H    LYS  90           H        LYS  90   8.408   3.444 -11.905
  694    HA   LYS  90           HA       LYS  90   7.819   6.211 -12.412
  695   1HB   LYS  90          2HB       LYS  90   7.243   4.443 -14.026
  696   2HB   LYS  90          1HB       LYS  90   6.122   3.752 -12.862
  697   1HG   LYS  90          2HG       LYS  90   4.658   5.583 -13.027
  698   2HG   LYS  90          1HG       LYS  90   5.863   6.574 -13.850
  699   1HD   LYS  90          2HD       LYS  90   4.970   4.012 -15.098
  700   2HD   LYS  90          1HD       LYS  90   3.931   5.434 -15.203
  701   1HE   LYS  90          2HE       LYS  90   6.450   6.388 -15.854
  702   2HE   LYS  90          1HE       LYS  90   6.375   4.809 -16.634
  703   1HZ   LYS  90          1HZ       LYS  90   5.419   6.079 -18.234
  704   2HZ   LYS  90          2HZ       LYS  90   4.794   7.213 -17.146
  705   3HZ   LYS  90          3HZ       LYS  90   4.025   5.721 -17.343
  706    H    ALA  91           H        ALA  91   7.458   4.323  -9.710
  707    HA   ALA  91           HA       ALA  91   5.140   5.898  -8.799
  708   1HB   ALA  91          1HB       ALA  91   5.065   3.837  -7.098
  709   2HB   ALA  91          2HB       ALA  91   5.778   3.026  -8.493
  710   3HB   ALA  91          3HB       ALA  91   4.218   3.836  -8.645
  711    H    ILE  92           H        ILE  92   8.254   4.480  -7.905
  712    HA   ILE  92           HA       ILE  92   8.252   5.653  -5.287
  713    HB   ILE  92           HB       ILE  92  10.383   4.722  -4.957
  714   1HG1  ILE  92          2HG1      ILE  92  10.620   4.520  -7.966
  715   2HG1  ILE  92          1HG1      ILE  92  11.532   5.597  -6.914
  716   1HG2  ILE  92          1HG2      ILE  92  10.170   2.397  -5.951
  717   2HG2  ILE  92          2HG2      ILE  92   8.725   2.991  -6.766
  718   3HG2  ILE  92          3HG2      ILE  92   8.802   2.983  -5.007
  719   1HD1  ILE  92          1HD1      ILE  92  12.708   3.764  -5.943
  720   2HD1  ILE  92          2HD1      ILE  92  12.791   3.604  -7.698
  721   3HD1  ILE  92          3HD1      ILE  92  11.678   2.598  -6.774
  722    H    LYS  93           H        LYS  93   9.757   6.419  -8.392
  723    HA   LYS  93           HA       LYS  93  11.379   8.530  -7.554
  724   1HB   LYS  93          2HB       LYS  93  11.223   7.362  -9.858
  725   2HB   LYS  93          1HB       LYS  93   9.966   8.541 -10.208
  726   1HG   LYS  93          2HG       LYS  93  11.435  10.206 -10.489
  727   2HG   LYS  93          1HG       LYS  93  12.428   9.693  -9.122
  728   1HD   LYS  93          2HD       LYS  93  13.547   8.062 -10.443
  729   2HD   LYS  93          1HD       LYS  93  12.399   8.255 -11.769
  730   1HE   LYS  93          2HE       LYS  93  14.214  10.452 -10.792
  731   2HE   LYS  93          1HE       LYS  93  14.627   9.360 -12.114
  732   1HZ   LYS  93          1HZ       LYS  93  13.670  10.961 -13.343
  733   2HZ   LYS  93          2HZ       LYS  93  12.758  11.578 -12.058
  734   3HZ   LYS  93          3HZ       LYS  93  12.225  10.207 -12.891
  735    H    LYS  94           H        LYS  94   7.949   8.361  -8.101
  736    HA   LYS  94           HA       LYS  94   7.440  11.140  -8.298
  737   1HB   LYS  94          2HB       LYS  94   5.634   8.902  -7.371
  738   2HB   LYS  94          1HB       LYS  94   5.104  10.529  -7.769
  739   1HG   LYS  94          2HG       LYS  94   6.636   9.101  -9.849
  740   2HG   LYS  94          1HG       LYS  94   5.018   8.492  -9.494
  741   1HD   LYS  94          2HD       LYS  94   5.645  11.373 -10.123
  742   2HD   LYS  94          1HD       LYS  94   5.097  10.195 -11.317
  743   1HE   LYS  94          2HE       LYS  94   3.059  10.989 -10.768
  744   2HE   LYS  94          1HE       LYS  94   3.213   9.858  -9.424
  745   1HZ   LYS  94          1HZ       LYS  94   4.378  12.456  -8.941
  746   2HZ   LYS  94          2HZ       LYS  94   3.380  11.515  -7.951
  747   3HZ   LYS  94          3HZ       LYS  94   2.702  12.481  -9.162
  748    H    GLY  95           H        GLY  95   6.801   8.920  -5.574
  749   1HA   GLY  95          2HA       GLY  95   7.996  10.593  -3.636
  750   2HA   GLY  95          1HA       GLY  95   6.269  10.904  -3.682
  751    H    ALA  96           H        ALA  96   7.493   7.704  -4.366
  752    HA   ALA  96           HA       ALA  96   6.112   6.730  -2.000
  753   1HB   ALA  96          1HB       ALA  96   5.742   4.839  -3.144
  754   2HB   ALA  96          2HB       ALA  96   7.417   4.727  -3.682
  755   3HB   ALA  96          3HB       ALA  96   6.277   5.754  -4.552
  756    H    TYR  97           H        TYR  97   7.380   4.517  -1.244
  757    HA   TYR  97           HA       TYR  97   9.843   5.564  -0.097
  758   1HB   TYR  97          2HB       TYR  97   8.226   4.675   1.476
  759   2HB   TYR  97          1HB       TYR  97   8.181   3.144   0.612
  760    HD1  TYR  97           1HD      TYR  97  10.657   5.382   2.300
  761    HD2  TYR  97           2HD      TYR  97   9.430   1.397   1.455
  762    HE1  TYR  97           1HE      TYR  97  12.458   4.528   3.739
  763    HE2  TYR  97           2HE      TYR  97  11.227   0.532   2.893
  764    HH   TYR  97           HH       TYR  97  13.741   2.546   4.107
  765    H    GLU  98           H        GLU  98   8.758   3.277  -2.377
  766    HA   GLU  98           HA       GLU  98  10.822   2.762  -3.904
  767   1HB   GLU  98          2HB       GLU  98  12.137   0.870  -2.982
  768   2HB   GLU  98          1HB       GLU  98  12.352   2.345  -2.059
  769   1HG   GLU  98          2HG       GLU  98  10.793   1.515  -0.370
  770   2HG   GLU  98          1HG       GLU  98  10.569   0.038  -1.305
  771    H    PHE  99           H        PHE  99  11.093   0.031  -4.225
  772    HA   PHE  99           HA       PHE  99   8.312  -0.926  -4.381
  773   1HB   PHE  99          2HB       PHE  99   9.988  -0.272  -6.532
  774   2HB   PHE  99          1HB       PHE  99   9.990  -2.029  -6.465
  775    HD1  PHE  99           1HD      PHE  99   8.437  -3.081  -7.765
  776    HD2  PHE  99           2HD      PHE  99   7.508   0.750  -6.161
  777    HE1  PHE  99           1HE      PHE  99   6.270  -3.124  -8.930
  778    HE2  PHE  99           2HE      PHE  99   5.339   0.713  -7.324
  779    HZ   PHE  99           HZ       PHE  99   4.717  -1.225  -8.708
  780    H    LEU 100           H        LEU 100   8.199  -2.515  -2.913
  781    HA   LEU 100           HA       LEU 100  10.305  -4.040  -1.935
  782   1HB   LEU 100          2HB       LEU 100   7.682  -3.770  -1.315
  783   2HB   LEU 100          1HB       LEU 100   7.672  -5.364  -2.042
  784    HG   LEU 100           HG       LEU 100   7.940  -5.757   0.248
  785   1HD1  LEU 100          1HD1      LEU 100   9.740  -6.701  -1.441
  786   2HD1  LEU 100          2HD1      LEU 100   9.830  -7.023   0.290
  787   3HD1  LEU 100          3HD1      LEU 100  10.830  -5.759  -0.424
  788   1HD2  LEU 100          1HD2      LEU 100  10.000  -3.557   0.241
  789   2HD2  LEU 100          2HD2      LEU 100   9.652  -4.601   1.618
  790   3HD2  LEU 100          3HD2      LEU 100   8.407  -3.518   0.996
  791    H    GLU 101           H        GLU 101  11.601  -4.861  -3.568
  792    HA   GLU 101           HA       GLU 101  10.724  -6.275  -5.818
  793   1HB   GLU 101          2HB       GLU 101  13.072  -7.267  -5.763
  794   2HB   GLU 101          1HB       GLU 101  12.957  -5.515  -5.841
  795   1HG   GLU 101          2HG       GLU 101  13.619  -5.247  -3.628
  796   2HG   GLU 101          1HG       GLU 101  13.256  -6.923  -3.219
  797    H    LYS 102           H        LYS 102   9.104  -7.726  -5.200
  798    HA   LYS 102           HA       LYS 102   9.888 -10.356  -4.721
  799   1HB   LYS 102          2HB       LYS 102   9.388  -8.759  -2.304
  800   2HB   LYS 102          1HB       LYS 102   8.479 -10.262  -2.371
  801   1HG   LYS 102          2HG       LYS 102  10.981 -11.075  -3.109
  802   2HG   LYS 102          1HG       LYS 102  11.327  -9.806  -1.932
  803   1HD   LYS 102          2HD       LYS 102  11.140 -11.630  -0.549
  804   2HD   LYS 102          1HD       LYS 102   9.478 -11.038  -0.533
  805   1HE   LYS 102          2HE       LYS 102   9.372 -13.389  -0.855
  806   2HE   LYS 102          1HE       LYS 102   8.995 -12.638  -2.404
  807   1HZ   LYS 102          1HZ       LYS 102  10.865 -13.429  -3.346
  808   2HZ   LYS 102          2HZ       LYS 102  10.752 -14.601  -2.132
  809   3HZ   LYS 102          3HZ       LYS 102  11.791 -13.281  -1.938
  810    HA   PRO 103           HA       PRO 103   5.620  -9.485  -6.420
  811   1HB   PRO 103          2HB       PRO 103   5.910 -11.311  -8.459
  812   2HB   PRO 103          1HB       PRO 103   6.288  -9.590  -8.598
  813   1HG   PRO 103          2HG       PRO 103   8.123 -11.897  -8.087
  814   2HG   PRO 103          1HG       PRO 103   8.361 -10.486  -9.136
  815   1HD   PRO 103          2HD       PRO 103   9.516 -10.644  -6.718
  816   2HD   PRO 103          1HD       PRO 103   8.912  -9.102  -7.358
  817    H    PHE 104           H        PHE 104   7.342 -12.155  -5.213
  818    HA   PHE 104           HA       PHE 104   4.891 -13.771  -5.055
  819   1HB   PHE 104          2HB       PHE 104   7.805 -14.547  -4.952
  820   2HB   PHE 104          1HB       PHE 104   6.517 -15.647  -4.475
  821    HD1  PHE 104           1HD      PHE 104   8.028 -13.824  -7.282
  822    HD2  PHE 104           2HD      PHE 104   5.119 -16.697  -6.100
  823    HE1  PHE 104           1HE      PHE 104   7.746 -14.499  -9.632
  824    HE2  PHE 104           2HE      PHE 104   4.832 -17.378  -8.447
  825    HZ   PHE 104           HZ       PHE 104   6.146 -16.279 -10.217
  826    H    SER 105           H        SER 105   3.868 -13.409  -3.197
  827    HA   SER 105           HA       SER 105   3.432 -13.256  -0.973
  828   1HB   SER 105          2HB       SER 105   4.686 -15.358  -0.802
  829   2HB   SER 105          1HB       SER 105   6.194 -14.455  -0.667
  830    HG   SER 105           HG       SER 105   4.033 -14.132   1.134
  831    H    VAL 106           H        VAL 106   3.672 -11.813   0.726
  832    HA   VAL 106           HA       VAL 106   5.655  -9.690   0.258
  833    HB   VAL 106           HB       VAL 106   4.172  -8.180   1.423
  834   1HG1  VAL 106          1HG1      VAL 106   2.639  -9.835  -0.577
  835   2HG1  VAL 106          2HG1      VAL 106   3.779  -8.545  -0.961
  836   3HG1  VAL 106          3HG1      VAL 106   2.280  -8.172  -0.110
  837   1HG2  VAL 106          1HG2      VAL 106   1.773  -9.470   1.793
  838   2HG2  VAL 106          2HG2      VAL 106   2.926  -9.050   3.061
  839   3HG2  VAL 106          3HG2      VAL 106   2.953 -10.659   2.342
  840    H    GLU 107           H        GLU 107   6.510 -12.008   1.590
  841    HA   GLU 107           HA       GLU 107   6.386 -11.727   4.414
  842   1HB   GLU 107          2HB       GLU 107   7.130 -13.736   2.827
  843   2HB   GLU 107          1HB       GLU 107   8.719 -13.055   3.150
  844   1HG   GLU 107          2HG       GLU 107   7.990 -13.159   5.627
  845   2HG   GLU 107          1HG       GLU 107   6.777 -14.298   5.043
  846    H    ARG 108           H        ARG 108   8.909 -10.997   2.011
  847    HA   ARG 108           HA       ARG 108  10.696  -9.753   3.791
  848   1HB   ARG 108          2HB       ARG 108  10.716 -10.395   1.109
  849   2HB   ARG 108          1HB       ARG 108  10.672  -8.638   1.076
  850   1HG   ARG 108          2HG       ARG 108  12.821  -8.514   1.596
  851   2HG   ARG 108          1HG       ARG 108  12.591  -9.543   3.011
  852   1HD   ARG 108          2HD       ARG 108  12.882 -11.523   1.703
  853   2HD   ARG 108          1HD       ARG 108  12.865 -10.598   0.202
  854    HE   ARG 108           HE       ARG 108  14.960  -9.544   1.543
  855   1HH1  ARG 108          1HH1      ARG 108  14.057 -12.818   0.736
  856   2HH1  ARG 108          2HH1      ARG 108  15.693 -13.380   0.652
  857   1HH2  ARG 108          1HH2      ARG 108  17.111 -10.282   1.432
  858   2HH2  ARG 108          2HH2      ARG 108  17.427 -11.941   1.048
  859    H    PHE 109           H        PHE 109   7.854  -8.668   2.105
  860    HA   PHE 109           HA       PHE 109   8.118  -5.894   2.327
  861   1HB   PHE 109          2HB       PHE 109   6.345  -6.621   0.974
  862   2HB   PHE 109          1HB       PHE 109   5.789  -7.783   2.166
  863    HD1  PHE 109           1HD      PHE 109   5.907  -4.189   1.336
  864    HD2  PHE 109           2HD      PHE 109   4.142  -7.210   3.759
  865    HE1  PHE 109           1HE      PHE 109   4.209  -2.581   2.095
  866    HE2  PHE 109           2HE      PHE 109   2.438  -5.606   4.520
  867    HZ   PHE 109           HZ       PHE 109   2.472  -3.288   3.690
  868    H    LEU 110           H        LEU 110   6.911  -8.333   4.562
  869    HA   LEU 110           HA       LEU 110   5.840  -6.832   6.590
  870   1HB   LEU 110          2HB       LEU 110   6.448  -9.434   6.252
  871   2HB   LEU 110          1HB       LEU 110   7.633  -8.989   7.462
  872    HG   LEU 110           HG       LEU 110   4.699  -8.425   7.811
  873   1HD1  LEU 110          1HD1      LEU 110   4.571 -10.457   9.143
  874   2HD1  LEU 110          2HD1      LEU 110   6.238 -10.848   8.725
  875   3HD1  LEU 110          3HD1      LEU 110   4.998 -10.825   7.473
  876   1HD2  LEU 110          1HD2      LEU 110   6.801  -7.446   9.178
  877   2HD2  LEU 110          2HD2      LEU 110   6.514  -8.934  10.078
  878   3HD2  LEU 110          3HD2      LEU 110   5.222  -7.748   9.900
  879    H    LEU 111           H        LEU 111   9.258  -7.674   6.156
  880    HA   LEU 111           HA       LEU 111  10.302  -6.485   8.429
  881   1HB   LEU 111          2HB       LEU 111  11.443  -6.973   5.707
  882   2HB   LEU 111          1HB       LEU 111  12.389  -6.181   6.952
  883    HG   LEU 111           HG       LEU 111  12.119  -8.160   8.401
  884   1HD1  LEU 111          1HD1      LEU 111  10.581  -9.182   6.036
  885   2HD1  LEU 111          2HD1      LEU 111  10.093  -9.125   7.729
  886   3HD1  LEU 111          3HD1      LEU 111  11.331 -10.267   7.206
  887   1HD2  LEU 111          1HD2      LEU 111  13.870  -7.807   6.391
  888   2HD2  LEU 111          2HD2      LEU 111  13.149  -9.340   5.904
  889   3HD2  LEU 111          3HD2      LEU 111  13.908  -9.188   7.488
  890    H    THR 112           H        THR 112   9.754  -5.034   5.234
  891    HA   THR 112           HA       THR 112  10.825  -2.500   5.903
  892    HB   THR 112           HB       THR 112   8.833  -3.275   3.762
  893    HG1  THR 112           1HG      THR 112  10.747  -3.164   2.450
  894   1HG2  THR 112          1HG2      THR 112  10.186  -1.169   2.746
  895   2HG2  THR 112          2HG2      THR 112  10.033  -0.688   4.436
  896   3HG2  THR 112          3HG2      THR 112   8.592  -1.067   3.494
  897    H    ILE 113           H        ILE 113   7.568  -3.853   6.026
  898    HA   ILE 113           HA       ILE 113   6.029  -1.638   6.480
  899    HB   ILE 113           HB       ILE 113   5.856  -4.460   7.413
  900   1HG1  ILE 113          2HG1      ILE 113   5.084  -3.741   5.174
  901   2HG1  ILE 113          1HG1      ILE 113   3.782  -4.415   6.149
  902   1HG2  ILE 113          1HG2      ILE 113   5.096  -3.496   9.410
  903   2HG2  ILE 113          2HG2      ILE 113   3.631  -3.869   8.502
  904   3HG2  ILE 113          3HG2      ILE 113   4.233  -2.212   8.563
  905   1HD1  ILE 113          1HD1      ILE 113   3.648  -1.733   6.712
  906   2HD1  ILE 113          2HD1      ILE 113   2.634  -2.607   5.564
  907   3HD1  ILE 113          3HD1      ILE 113   4.078  -1.767   5.001
  908    H    LYS 114           H        LYS 114   7.630  -3.547   9.039
  909    HA   LYS 114           HA       LYS 114   6.947  -2.050  11.231
  910   1HB   LYS 114          2HB       LYS 114   8.218  -4.153  11.348
  911   2HB   LYS 114          1HB       LYS 114   9.632  -3.334  10.695
  912   1HG   LYS 114          2HG       LYS 114   8.428  -2.179  13.136
  913   2HG   LYS 114          1HG       LYS 114   9.254  -3.730  13.302
  914   1HD   LYS 114          2HD       LYS 114  10.437  -1.223  12.105
  915   2HD   LYS 114          1HD       LYS 114  10.763  -1.842  13.725
  916   1HE   LYS 114          2HE       LYS 114  11.188  -3.915  11.792
  917   2HE   LYS 114          1HE       LYS 114  12.092  -2.476  11.326
  918   1HZ   LYS 114          1HZ       LYS 114  12.646  -2.587  13.924
  919   2HZ   LYS 114          2HZ       LYS 114  13.597  -3.333  12.739
  920   3HZ   LYS 114          3HZ       LYS 114  12.458  -4.237  13.605
  921    H    HIS 115           H        HIS 115   9.870  -1.627   9.246
  922    HA   HIS 115           HA       HIS 115  10.770   0.711  10.481
  923   1HB   HIS 115          2HB       HIS 115  11.445  -0.842   8.154
  924   2HB   HIS 115          1HB       HIS 115  11.568   0.879   7.809
  925    HD1  HIS 115           1HD      HIS 115  13.368  -1.875   9.349
  926    HD2  HIS 115           2HD      HIS 115  13.345   2.266   9.684
  927    HE1  HIS 115           1HE      HIS 115  15.523  -1.282  10.502
  928    HE2  HIS 115           2HE      HIS 115  15.525   1.235  10.618
  929    H    ALA 116           H        ALA 116   8.359   0.190   8.006
  930    HA   ALA 116           HA       ALA 116   8.183   2.810   7.004
  931   1HB   ALA 116          1HB       ALA 116   5.768   1.063   7.245
  932   2HB   ALA 116          2HB       ALA 116   7.091   0.601   6.175
  933   3HB   ALA 116          3HB       ALA 116   6.252   2.132   5.928
  934    H    PHE 117           H        PHE 117   6.730   1.256   9.805
  935    HA   PHE 117           HA       PHE 117   5.081   3.523  10.457
  936   1HB   PHE 117          2HB       PHE 117   5.685   0.895  11.781
  937   2HB   PHE 117          1HB       PHE 117   4.827   2.160  12.654
  938    HD1  PHE 117           1HD      PHE 117   2.608   2.871  11.945
  939    HD2  PHE 117           2HD      PHE 117   4.644  -0.315   9.992
  940    HE1  PHE 117           1HE      PHE 117   0.496   2.164  10.909
  941    HE2  PHE 117           2HE      PHE 117   2.534  -1.028   8.952
  942    HZ   PHE 117           HZ       PHE 117   0.455   0.214   9.408
  943    H    GLU 118           H        GLU 118   8.256   2.358  11.281
  944    HA   GLU 118           HA       GLU 118   8.718   3.700  13.672
  945   1HB   GLU 118          2HB       GLU 118  10.617   3.041  11.424
  946   2HB   GLU 118          1HB       GLU 118  11.129   3.642  12.995
  947   1HG   GLU 118          2HG       GLU 118   9.786   1.620  13.914
  948   2HG   GLU 118          1HG       GLU 118   9.954   0.997  12.273
  949    H    GLU 119           H        GLU 119   8.407   4.947  10.471
  950    HA   GLU 119           HA       GLU 119   9.595   7.509  11.235
  951   1HB   GLU 119          2HB       GLU 119   8.539   6.594   8.555
  952   2HB   GLU 119          1HB       GLU 119   9.395   8.098   8.868
  953   1HG   GLU 119          2HG       GLU 119  11.425   7.055   9.112
  954   2HG   GLU 119          1HG       GLU 119  10.700   5.511   9.556
  955    H    TYR 120           H        TYR 120   7.060   6.567  12.362
  956    HA   TYR 120           HA       TYR 120   5.154   8.459  11.180
  957   1HB   TYR 120          2HB       TYR 120   4.504   6.037  11.570
  958   2HB   TYR 120          1HB       TYR 120   4.576   6.383  13.295
  959    HD1  TYR 120           1HD      TYR 120   2.761   7.403  14.397
  960    HD2  TYR 120           2HD      TYR 120   2.864   7.335  10.143
  961    HE1  TYR 120           1HE      TYR 120   0.441   8.220  14.333
  962    HE2  TYR 120           2HE      TYR 120   0.546   8.151  10.068
  963    HH   TYR 120           HH       TYR 120  -1.475   8.202  12.789
  964    H    SER 121           H        SER 121   7.440   9.235  12.864
  965    HA   SER 121           HA       SER 121   5.918  10.631  14.955
  966   1HB   SER 121          2HB       SER 121   7.082   8.968  16.190
  967   2HB   SER 121          1HB       SER 121   8.558   9.199  15.253
  968    HG   SER 121           HG       SER 121   8.069  10.285  17.514
  Start of MODEL   36
    1   1H    MET   1          1HT       MET   1  -0.076   1.101  16.848
    2   2H    MET   1          2HT       MET   1  -0.766  -0.062  17.906
    3   3H    MET   1          3HT       MET   1  -1.270   1.575  17.982
    4    HA   MET   1           HA       MET   1  -2.684  -0.182  16.793
    5   1HB   MET   1          2HB       MET   1  -3.169   1.750  15.055
    6   2HB   MET   1          1HB       MET   1  -3.546   1.947  16.757
    7   1HG   MET   1          2HG       MET   1  -0.845   2.786  16.186
    8   2HG   MET   1          1HG       MET   1  -2.007   3.623  15.163
    9   1HE   MET   1          1HE       MET   1  -2.044   6.539  17.502
   10   2HE   MET   1          2HE       MET   1  -2.431   5.951  15.884
   11   3HE   MET   1          3HE       MET   1  -0.797   5.765  16.522
   12    H    LYS   2           H        LYS   2  -0.514   1.655  14.630
   13    HA   LYS   2           HA       LYS   2   0.450   1.122  12.642
   14   1HB   LYS   2          2HB       LYS   2   0.535  -1.707  13.690
   15   2HB   LYS   2          1HB       LYS   2   1.616  -0.963  12.517
   16   1HG   LYS   2          2HG       LYS   2   1.549   0.426  15.082
   17   2HG   LYS   2          1HG       LYS   2   2.112  -1.242  15.190
   18   1HD   LYS   2          2HD       LYS   2   3.828  -0.830  13.564
   19   2HD   LYS   2          1HD       LYS   2   3.191   0.781  13.231
   20   1HE   LYS   2          2HE       LYS   2   5.099   1.034  14.641
   21   2HE   LYS   2          1HE       LYS   2   3.667   1.372  15.612
   22   1HZ   LYS   2          1HZ       LYS   2   3.804  -0.820  16.565
   23   2HZ   LYS   2          2HZ       LYS   2   5.287  -0.033  16.770
   24   3HZ   LYS   2          3HZ       LYS   2   5.118  -1.220  15.577
   25    H    ARG   3           H        ARG   3  -1.147   1.454  11.164
   26    HA   ARG   3           HA       ARG   3  -2.727  -0.909  10.369
   27   1HB   ARG   3          2HB       ARG   3  -3.785   1.710   9.547
   28   2HB   ARG   3          1HB       ARG   3  -4.625   0.312  10.198
   29   1HG   ARG   3          2HG       ARG   3  -3.163   2.439  11.740
   30   2HG   ARG   3          1HG       ARG   3  -4.900   2.137  11.707
   31   1HD   ARG   3          2HD       ARG   3  -3.731  -0.290  12.449
   32   2HD   ARG   3          1HD       ARG   3  -2.856   0.944  13.350
   33    HE   ARG   3           HE       ARG   3  -5.507   1.575  13.659
   34   1HH1  ARG   3          1HH1      ARG   3  -3.514  -1.208  14.335
   35   2HH1  ARG   3          2HH1      ARG   3  -4.467  -1.720  15.687
   36   1HH2  ARG   3          1HH2      ARG   3  -6.763   0.904  15.437
   37   2HH2  ARG   3          2HH2      ARG   3  -6.313  -0.521  16.311
   38    H    VAL   4           H        VAL   4  -2.764  -1.426   8.187
   39    HA   VAL   4           HA       VAL   4  -1.286   0.387   6.396
   40    HB   VAL   4           HB       VAL   4  -1.068  -2.622   6.288
   41   1HG1  VAL   4          1HG1      VAL   4   0.054  -0.360   4.709
   42   2HG1  VAL   4          2HG1      VAL   4  -0.548  -1.926   4.165
   43   3HG1  VAL   4          3HG1      VAL   4   1.035  -1.807   4.933
   44   1HG2  VAL   4          1HG2      VAL   4   1.000  -0.677   7.306
   45   2HG2  VAL   4          2HG2      VAL   4   1.104  -2.437   7.283
   46   3HG2  VAL   4          3HG2      VAL   4  -0.050  -1.637   8.350
   47    H    LEU   5           H        LEU   5  -1.795   0.132   4.113
   48    HA   LEU   5           HA       LEU   5  -4.526  -0.897   3.712
   49   1HB   LEU   5          2HB       LEU   5  -4.157   1.624   3.610
   50   2HB   LEU   5          1HB       LEU   5  -3.262   1.329   2.130
   51    HG   LEU   5           HG       LEU   5  -5.245   0.394   1.074
   52   1HD1  LEU   5          1HD1      LEU   5  -6.589  -0.643   2.568
   53   2HD1  LEU   5          2HD1      LEU   5  -7.420   0.913   2.529
   54   3HD1  LEU   5          3HD1      LEU   5  -6.290   0.548   3.834
   55   1HD2  LEU   5          1HD2      LEU   5  -6.366   2.866   2.243
   56   2HD2  LEU   5          2HD2      LEU   5  -6.152   2.402   0.556
   57   3HD2  LEU   5          3HD2      LEU   5  -4.780   3.001   1.486
   58    H    VAL   6           H        VAL   6  -4.860  -2.331   2.143
   59    HA   VAL   6           HA       VAL   6  -2.630  -2.887   0.293
   60    HB   VAL   6           HB       VAL   6  -4.726  -4.855   1.211
   61   1HG1  VAL   6          1HG1      VAL   6  -3.924  -5.596  -0.848
   62   2HG1  VAL   6          2HG1      VAL   6  -2.924  -6.458   0.320
   63   3HG1  VAL   6          3HG1      VAL   6  -2.283  -5.044  -0.516
   64   1HG2  VAL   6          1HG2      VAL   6  -3.288  -5.673   2.825
   65   2HG2  VAL   6          2HG2      VAL   6  -3.021  -3.933   2.947
   66   3HG2  VAL   6          3HG2      VAL   6  -1.866  -4.945   2.077
   67    H    VAL   7           H        VAL   7  -3.372  -1.506  -1.339
   68    HA   VAL   7           HA       VAL   7  -6.053  -1.811  -2.377
   69    HB   VAL   7           HB       VAL   7  -3.772  -0.249  -3.600
   70   1HG1  VAL   7          1HG1      VAL   7  -6.643  -0.563  -4.186
   71   2HG1  VAL   7          2HG1      VAL   7  -5.299  -0.177  -5.259
   72   3HG1  VAL   7          3HG1      VAL   7  -6.013   1.083  -4.253
   73   1HG2  VAL   7          1HG2      VAL   7  -5.909   0.905  -1.834
   74   2HG2  VAL   7          2HG2      VAL   7  -4.396   1.641  -2.365
   75   3HG2  VAL   7          3HG2      VAL   7  -4.372   0.332  -1.184
   76    H    ASP   8           H        ASP   8  -6.414  -3.704  -3.372
   77    HA   ASP   8           HA       ASP   8  -4.678  -4.382  -5.642
   78   1HB   ASP   8          2HB       ASP   8  -4.095  -5.878  -3.786
   79   2HB   ASP   8          1HB       ASP   8  -5.782  -6.349  -3.622
   80    H    ASP   9           H        ASP   9  -5.721  -5.010  -7.464
   81    HA   ASP   9           HA       ASP   9  -8.611  -4.719  -7.480
   82   1HB   ASP   9          2HB       ASP   9  -7.249  -3.588  -9.199
   83   2HB   ASP   9          1HB       ASP   9  -6.682  -5.154  -9.773
   84    H    GLU  10           H        GLU  10  -8.029  -6.943  -6.079
   85    HA   GLU  10           HA       GLU  10  -9.494  -8.947  -7.360
   86   1HB   GLU  10          2HB       GLU  10  -6.920  -8.918  -8.330
   87   2HB   GLU  10          1HB       GLU  10  -6.829 -10.131  -7.060
   88   1HG   GLU  10          2HG       GLU  10  -9.179 -10.441  -8.739
   89   2HG   GLU  10          1HG       GLU  10  -7.670 -10.534  -9.646
   90    H    GLU  11           H        GLU  11  -9.046 -11.182  -6.148
   91    HA   GLU  11           HA       GLU  11  -8.698 -10.535  -3.294
   92   1HB   GLU  11          2HB       GLU  11 -10.629 -12.475  -4.576
   93   2HB   GLU  11          1HB       GLU  11 -10.357 -12.348  -2.845
   94   1HG   GLU  11          2HG       GLU  11 -11.297 -10.058  -4.549
   95   2HG   GLU  11          1HG       GLU  11 -12.382 -11.163  -3.705
   96    H    SER  12           H        SER  12  -6.524 -11.166  -3.280
   97    HA   SER  12           HA       SER  12  -6.128 -14.018  -3.019
   98   1HB   SER  12          2HB       SER  12  -4.178 -12.647  -4.832
   99   2HB   SER  12          1HB       SER  12  -4.589 -14.358  -4.718
  100    HG   SER  12           HG       SER  12  -5.483 -12.705  -6.482
  101    H    ILE  13           H        ILE  13  -4.596 -10.821  -3.103
  102    HA   ILE  13           HA       ILE  13  -2.491 -11.608  -1.300
  103    HB   ILE  13           HB       ILE  13  -3.286  -8.817  -2.137
  104   1HG1  ILE  13          2HG1      ILE  13  -2.800 -10.300  -4.075
  105   2HG1  ILE  13          1HG1      ILE  13  -1.630  -8.996  -3.898
  106   1HG2  ILE  13          1HG2      ILE  13  -1.052  -9.969  -0.582
  107   2HG2  ILE  13          2HG2      ILE  13  -1.831  -8.392  -0.456
  108   3HG2  ILE  13          3HG2      ILE  13  -0.648  -8.692  -1.730
  109   1HD1  ILE  13          1HD1      ILE  13  -1.034 -11.634  -2.664
  110   2HD1  ILE  13          2HD1      ILE  13   0.063 -10.414  -3.309
  111   3HD1  ILE  13          3HD1      ILE  13  -0.861 -11.439  -4.409
  112    H    THR  14           H        THR  14  -5.435  -9.653  -1.111
  113    HA   THR  14           HA       THR  14  -5.152  -8.768   1.529
  114    HB   THR  14           HB       THR  14  -7.427  -8.132   1.427
  115    HG1  THR  14           1HG      THR  14  -7.734 -10.121  -0.568
  116   1HG2  THR  14          1HG2      THR  14  -5.920  -7.141  -0.380
  117   2HG2  THR  14          2HG2      THR  14  -7.666  -6.979  -0.575
  118   3HG2  THR  14          3HG2      THR  14  -6.784  -8.199  -1.493
  119    H    SER  15           H        SER  15  -5.817 -11.901   0.336
  120    HA   SER  15           HA       SER  15  -7.265 -12.823   2.646
  121   1HB   SER  15          2HB       SER  15  -6.279 -14.021   0.111
  122   2HB   SER  15          1HB       SER  15  -6.508 -15.115   1.475
  123    HG   SER  15           HG       SER  15  -8.499 -13.282   0.656
  124    H    SER  16           H        SER  16  -3.953 -13.122   1.417
  125    HA   SER  16           HA       SER  16  -3.160 -14.487   3.881
  126   1HB   SER  16          2HB       SER  16  -1.132 -13.928   1.797
  127   2HB   SER  16          1HB       SER  16  -1.431 -15.403   2.714
  128    HG   SER  16           HG       SER  16  -3.379 -15.592   1.356
  129    H    LEU  17           H        LEU  17  -1.865 -11.847   1.856
  130    HA   LEU  17           HA       LEU  17  -0.017 -10.795   3.577
  131   1HB   LEU  17          2HB       LEU  17  -0.326 -10.016   1.288
  132   2HB   LEU  17          1HB       LEU  17  -1.867  -9.299   1.714
  133    HG   LEU  17           HG       LEU  17   0.227  -7.790   1.465
  134   1HD1  LEU  17          1HD1      LEU  17  -0.674  -6.225   3.053
  135   2HD1  LEU  17          2HD1      LEU  17  -1.529  -7.518   3.893
  136   3HD1  LEU  17          3HD1      LEU  17  -1.990  -7.081   2.250
  137   1HD2  LEU  17          1HD2      LEU  17   1.456  -7.446   3.559
  138   2HD2  LEU  17          2HD2      LEU  17   1.715  -9.062   2.902
  139   3HD2  LEU  17          3HD2      LEU  17   0.624  -8.829   4.269
  140    H    SER  18           H        SER  18  -3.464  -9.877   3.428
  141    HA   SER  18           HA       SER  18  -3.429  -7.999   5.490
  142   1HB   SER  18          2HB       SER  18  -5.336  -8.618   3.846
  143   2HB   SER  18          1HB       SER  18  -5.775  -9.833   5.046
  144    HG   SER  18           HG       SER  18  -6.888  -7.860   5.371
  145    H    ALA  19           H        ALA  19  -4.107 -11.487   5.633
  146    HA   ALA  19           HA       ALA  19  -4.567 -11.661   8.388
  147   1HB   ALA  19          1HB       ALA  19  -5.184 -13.605   7.397
  148   2HB   ALA  19          2HB       ALA  19  -3.560 -14.089   7.890
  149   3HB   ALA  19          3HB       ALA  19  -3.858 -13.561   6.234
  150    H    ILE  20           H        ILE  20  -1.596 -11.801   6.507
  151    HA   ILE  20           HA       ILE  20   0.178 -12.603   8.505
  152    HB   ILE  20           HB       ILE  20   0.551 -10.905   6.046
  153   1HG1  ILE  20          2HG1      ILE  20   1.597 -13.648   6.745
  154   2HG1  ILE  20          1HG1      ILE  20   0.103 -13.358   5.859
  155   1HG2  ILE  20          1HG2      ILE  20   2.561 -11.574   8.163
  156   2HG2  ILE  20          2HG2      ILE  20   2.261 -10.033   7.360
  157   3HG2  ILE  20          3HG2      ILE  20   3.052 -11.345   6.485
  158   1HD1  ILE  20          1HD1      ILE  20   2.756 -13.520   4.874
  159   2HD1  ILE  20          2HD1      ILE  20   2.145 -11.894   4.575
  160   3HD1  ILE  20          3HD1      ILE  20   1.254 -13.294   3.978
  161    H    LEU  21           H        LEU  21  -0.204  -9.244   7.340
  162    HA   LEU  21           HA       LEU  21   1.175  -7.959   9.331
  163   1HB   LEU  21          2HB       LEU  21  -1.336  -7.067   7.928
  164   2HB   LEU  21          1HB       LEU  21  -0.290  -6.010   8.857
  165    HG   LEU  21           HG       LEU  21   1.191  -7.488   6.849
  166   1HD1  LEU  21          1HD1      LEU  21  -1.081  -7.297   5.775
  167   2HD1  LEU  21          2HD1      LEU  21   0.264  -6.580   4.887
  168   3HD1  LEU  21          3HD1      LEU  21  -0.842  -5.549   5.796
  169   1HD2  LEU  21          1HD2      LEU  21   0.902  -4.722   7.863
  170   2HD2  LEU  21          2HD2      LEU  21   1.563  -4.931   6.242
  171   3HD2  LEU  21          3HD2      LEU  21   2.351  -5.698   7.620
  172    H    GLU  22           H        GLU  22  -2.100  -9.214   9.399
  173    HA   GLU  22           HA       GLU  22  -2.938  -8.027  11.812
  174   1HB   GLU  22          2HB       GLU  22  -3.804 -10.453  10.286
  175   2HB   GLU  22          1HB       GLU  22  -4.493 -10.096  11.863
  176   1HG   GLU  22          2HG       GLU  22  -5.146  -7.858  10.990
  177   2HG   GLU  22          1HG       GLU  22  -4.613  -8.385   9.394
  178    H    GLU  23           H        GLU  23  -0.926 -10.785  11.111
  179    HA   GLU  23           HA       GLU  23  -1.074 -11.869  13.774
  180   1HB   GLU  23          2HB       GLU  23  -0.658 -13.476  12.103
  181   2HB   GLU  23          1HB       GLU  23   0.561 -12.478  11.323
  182   1HG   GLU  23          2HG       GLU  23   2.198 -13.294  12.585
  183   2HG   GLU  23          1HG       GLU  23   1.241 -13.180  14.062
  184    H    GLU  24           H        GLU  24   1.040  -9.762  11.933
  185    HA   GLU  24           HA       GLU  24   3.082  -9.667  13.940
  186   1HB   GLU  24          2HB       GLU  24   2.681  -8.616  11.268
  187   2HB   GLU  24          1HB       GLU  24   3.445  -7.448  12.338
  188   1HG   GLU  24          2HG       GLU  24   4.541 -10.174  12.438
  189   2HG   GLU  24          1HG       GLU  24   4.780  -9.305  10.924
  190    H    GLY  25           H        GLY  25   0.030  -8.378  13.834
  191   1HA   GLY  25          2HA       GLY  25  -0.887  -7.036  15.533
  192   2HA   GLY  25          1HA       GLY  25   0.723  -6.434  15.891
  193    H    TYR  26           H        TYR  26  -1.380  -6.498  13.018
  194    HA   TYR  26           HA       TYR  26  -1.028  -3.583  12.806
  195   1HB   TYR  26          2HB       TYR  26  -0.846  -5.658  10.627
  196   2HB   TYR  26          1HB       TYR  26  -1.111  -3.953  10.286
  197    HD1  TYR  26           1HD      TYR  26   0.638  -2.337  11.487
  198    HD2  TYR  26           2HD      TYR  26   1.325  -6.436  10.580
  199    HE1  TYR  26           1HE      TYR  26   3.064  -1.940  11.554
  200    HE2  TYR  26           2HE      TYR  26   3.751  -6.053  10.646
  201    HH   TYR  26           HH       TYR  26   5.373  -4.462  10.687
  202    H    HIS  27           H        HIS  27  -2.650  -2.899  10.850
  203    HA   HIS  27           HA       HIS  27  -5.240  -4.193  11.283
  204   1HB   HIS  27          2HB       HIS  27  -4.660  -1.979  12.704
  205   2HB   HIS  27          1HB       HIS  27  -5.263  -1.225  11.232
  206    HD1  HIS  27           1HD      HIS  27  -6.491  -4.176  13.314
  207    HD2  HIS  27           2HD      HIS  27  -7.869  -0.648  11.605
  208    HE1  HIS  27           1HE      HIS  27  -8.946  -4.082  13.854
  209    HE2  HIS  27           2HE      HIS  27  -9.776  -1.983  12.733
  210    HA   PRO  28           HA       PRO  28  -4.210  -3.263   6.813
  211   1HB   PRO  28          2HB       PRO  28  -5.533  -5.888   6.524
  212   2HB   PRO  28          1HB       PRO  28  -4.017  -5.306   5.829
  213   1HG   PRO  28          2HG       PRO  28  -4.041  -7.091   7.824
  214   2HG   PRO  28          1HG       PRO  28  -2.796  -5.833   7.714
  215   1HD   PRO  28          2HD       PRO  28  -5.203  -5.968   9.484
  216   2HD   PRO  28          1HD       PRO  28  -3.568  -5.378   9.843
  217    H    ASP  29           H        ASP  29  -5.590  -2.428   5.372
  218    HA   ASP  29           HA       ASP  29  -8.450  -2.743   5.918
  219   1HB   ASP  29          2HB       ASP  29  -6.955  -0.382   6.035
  220   2HB   ASP  29          1HB       ASP  29  -7.981  -0.254   4.610
  221    H    THR  30           H        THR  30  -6.271  -3.568   3.775
  222    HA   THR  30           HA       THR  30  -6.218  -3.482   1.403
  223    HB   THR  30           HB       THR  30  -7.069  -5.589   0.786
  224    HG1  THR  30           1HG      THR  30  -8.737  -6.583   1.827
  225   1HG2  THR  30          1HG2      THR  30  -5.834  -6.799   2.172
  226   2HG2  THR  30          2HG2      THR  30  -6.872  -6.424   3.548
  227   3HG2  THR  30          3HG2      THR  30  -5.581  -5.314   3.090
  228    H    ALA  31           H        ALA  31  -6.962  -2.428  -0.253
  229    HA   ALA  31           HA       ALA  31  -9.826  -1.781  -0.389
  230   1HB   ALA  31          1HB       ALA  31  -9.301   0.244  -1.224
  231   2HB   ALA  31          2HB       ALA  31  -7.986  -0.389  -2.214
  232   3HB   ALA  31          3HB       ALA  31  -7.725  -0.074  -0.498
  233    H    LYS  32           H        LYS  32  -9.943  -1.109  -3.103
  234    HA   LYS  32           HA       LYS  32  -9.494  -3.716  -4.391
  235   1HB   LYS  32          2HB       LYS  32 -11.803  -3.595  -4.214
  236   2HB   LYS  32          1HB       LYS  32 -11.829  -1.850  -4.427
  237   1HG   LYS  32          2HG       LYS  32 -11.248  -2.150  -6.786
  238   2HG   LYS  32          1HG       LYS  32 -11.303  -3.897  -6.560
  239   1HD   LYS  32          2HD       LYS  32 -13.689  -2.441  -5.645
  240   2HD   LYS  32          1HD       LYS  32 -13.406  -2.390  -7.386
  241   1HE   LYS  32          2HE       LYS  32 -13.443  -4.757  -7.548
  242   2HE   LYS  32          1HE       LYS  32 -13.382  -4.944  -5.796
  243   1HZ   LYS  32          1HZ       LYS  32 -15.628  -5.077  -7.200
  244   2HZ   LYS  32          2HZ       LYS  32 -15.628  -3.425  -6.840
  245   3HZ   LYS  32          3HZ       LYS  32 -15.578  -4.564  -5.590
  246    H    THR  33           H        THR  33  -9.298  -0.243  -4.687
  247    HA   THR  33           HA       THR  33  -7.325  -0.403  -6.710
  248    HB   THR  33           HB       THR  33  -9.038   1.116  -8.215
  249    HG1  THR  33           1HG      THR  33 -10.963  -0.116  -8.338
  250   1HG2  THR  33          1HG2      THR  33  -7.706  -1.324  -8.511
  251   2HG2  THR  33          2HG2      THR  33  -8.439  -0.330  -9.770
  252   3HG2  THR  33          3HG2      THR  33  -9.375  -1.612  -9.001
  253    H    LEU  34           H        LEU  34  -7.343   2.047  -7.816
  254    HA   LEU  34           HA       LEU  34  -6.584   3.719  -5.667
  255   1HB   LEU  34          2HB       LEU  34  -7.179   4.601  -8.489
  256   2HB   LEU  34          1HB       LEU  34  -6.130   5.390  -7.325
  257    HG   LEU  34           HG       LEU  34  -5.595   2.673  -8.525
  258   1HD1  LEU  34          1HD1      LEU  34  -3.890   4.974  -9.210
  259   2HD1  LEU  34          2HD1      LEU  34  -5.504   4.970  -9.922
  260   3HD1  LEU  34          3HD1      LEU  34  -4.415   3.610 -10.197
  261   1HD2  LEU  34          1HD2      LEU  34  -4.643   3.597  -6.199
  262   2HD2  LEU  34          2HD2      LEU  34  -3.473   4.324  -7.300
  263   3HD2  LEU  34          3HD2      LEU  34  -3.705   2.576  -7.287
  264    H    ARG  35           H        ARG  35  -9.364   3.829  -7.887
  265    HA   ARG  35           HA       ARG  35 -10.594   6.086  -6.762
  266   1HB   ARG  35          2HB       ARG  35 -12.677   5.224  -7.810
  267   2HB   ARG  35          1HB       ARG  35 -11.309   5.242  -8.914
  268   1HG   ARG  35          2HG       ARG  35 -11.015   2.770  -8.192
  269   2HG   ARG  35          1HG       ARG  35 -12.689   2.915  -7.654
  270   1HD   ARG  35          2HD       ARG  35 -13.096   3.892 -10.023
  271   2HD   ARG  35          1HD       ARG  35 -11.562   3.118 -10.420
  272    HE   ARG  35           HE       ARG  35 -13.133   1.211  -9.156
  273   1HH1  ARG  35          1HH1      ARG  35 -13.226   3.113 -12.081
  274   2HH1  ARG  35          2HH1      ARG  35 -14.122   1.929 -12.971
  275   1HH2  ARG  35          1HH2      ARG  35 -14.312  -0.347 -10.326
  276   2HH2  ARG  35          2HH2      ARG  35 -14.740  -0.035 -11.975
  277    H    GLU  36           H        GLU  36 -11.059   2.623  -6.118
  278    HA   GLU  36           HA       GLU  36 -12.966   2.979  -4.057
  279   1HB   GLU  36          2HB       GLU  36 -12.339   0.837  -5.408
  280   2HB   GLU  36          1HB       GLU  36 -11.113   0.618  -4.165
  281   1HG   GLU  36          2HG       GLU  36 -12.853  -0.621  -3.330
  282   2HG   GLU  36          1HG       GLU  36 -13.100   0.926  -2.522
  283    H    ALA  37           H        ALA  37  -9.474   3.001  -4.158
  284    HA   ALA  37           HA       ALA  37  -9.071   2.762  -1.341
  285   1HB   ALA  37          1HB       ALA  37  -6.777   3.646  -1.893
  286   2HB   ALA  37          2HB       ALA  37  -7.303   3.750  -3.573
  287   3HB   ALA  37          3HB       ALA  37  -7.251   2.186  -2.761
  288    H    GLU  38           H        GLU  38  -8.604   5.562  -3.515
  289    HA   GLU  38           HA       GLU  38  -8.234   7.559  -1.730
  290   1HB   GLU  38          2HB       GLU  38  -9.978   7.690  -4.194
  291   2HB   GLU  38          1HB       GLU  38  -9.346   9.087  -3.337
  292   1HG   GLU  38          2HG       GLU  38  -7.199   8.742  -4.066
  293   2HG   GLU  38          1HG       GLU  38  -7.451   7.016  -4.325
  294    H    LYS  39           H        LYS  39 -11.326   6.092  -2.574
  295    HA   LYS  39           HA       LYS  39 -12.955   7.862  -1.087
  296   1HB   LYS  39          2HB       LYS  39 -13.902   6.367  -2.768
  297   2HB   LYS  39          1HB       LYS  39 -13.399   4.963  -1.837
  298   1HG   LYS  39          2HG       LYS  39 -15.097   6.852  -0.373
  299   2HG   LYS  39          1HG       LYS  39 -15.870   6.076  -1.757
  300   1HD   LYS  39          2HD       LYS  39 -14.585   3.976  -0.568
  301   2HD   LYS  39          1HD       LYS  39 -15.059   4.953   0.823
  302   1HE   LYS  39          2HE       LYS  39 -16.892   3.563   0.510
  303   2HE   LYS  39          1HE       LYS  39 -17.372   5.047  -0.313
  304   1HZ   LYS  39          1HZ       LYS  39 -15.994   3.041  -1.917
  305   2HZ   LYS  39          2HZ       LYS  39 -17.274   4.067  -2.332
  306   3HZ   LYS  39          3HZ       LYS  39 -17.570   2.665  -1.431
  307    H    LYS  40           H        LYS  40 -11.552   4.701  -0.318
  308    HA   LYS  40           HA       LYS  40 -12.479   4.615   2.356
  309   1HB   LYS  40          2HB       LYS  40 -10.266   3.153   0.929
  310   2HB   LYS  40          1HB       LYS  40 -10.711   2.826   2.599
  311   1HG   LYS  40          2HG       LYS  40 -13.108   2.725   1.186
  312   2HG   LYS  40          1HG       LYS  40 -11.930   1.909   0.155
  313   1HD   LYS  40          2HD       LYS  40 -11.247   0.592   2.205
  314   2HD   LYS  40          1HD       LYS  40 -12.673   1.260   3.000
  315   1HE   LYS  40          2HE       LYS  40 -14.119   0.021   1.754
  316   2HE   LYS  40          1HE       LYS  40 -13.064   0.013   0.341
  317   1HZ   LYS  40          1HZ       LYS  40 -13.446  -2.089   1.953
  318   2HZ   LYS  40          2HZ       LYS  40 -12.042  -1.429   2.630
  319   3HZ   LYS  40          3HZ       LYS  40 -12.068  -1.867   0.997
  320    H    ILE  41           H        ILE  41  -9.602   5.928   0.842
  321    HA   ILE  41           HA       ILE  41  -8.294   6.412   3.385
  322    HB   ILE  41           HB       ILE  41  -7.442   7.455   0.692
  323   1HG1  ILE  41          2HG1      ILE  41  -6.402   4.912   1.911
  324   2HG1  ILE  41          1HG1      ILE  41  -7.823   4.893   0.877
  325   1HG2  ILE  41          1HG2      ILE  41  -5.363   6.696   2.549
  326   2HG2  ILE  41          2HG2      ILE  41  -6.458   7.883   3.256
  327   3HG2  ILE  41          3HG2      ILE  41  -5.639   8.236   1.734
  328   1HD1  ILE  41          1HD1      ILE  41  -6.625   5.460  -1.001
  329   2HD1  ILE  41          2HD1      ILE  41  -5.481   4.442  -0.126
  330   3HD1  ILE  41          3HD1      ILE  41  -5.318   6.198  -0.073
  331    H    LYS  42           H        LYS  42 -10.530   8.033   1.387
  332    HA   LYS  42           HA       LYS  42  -9.887  10.698   1.632
  333   1HB   LYS  42          2HB       LYS  42 -12.218   9.169   0.995
  334   2HB   LYS  42          1HB       LYS  42 -12.668  10.547   1.986
  335   1HG   LYS  42          2HG       LYS  42 -10.825  11.041  -0.277
  336   2HG   LYS  42          1HG       LYS  42 -12.510  10.682  -0.656
  337   1HD   LYS  42          2HD       LYS  42 -12.707  12.930  -0.411
  338   2HD   LYS  42          1HD       LYS  42 -12.892  12.478   1.285
  339   1HE   LYS  42          2HE       LYS  42 -11.239  13.956   1.633
  340   2HE   LYS  42          1HE       LYS  42 -10.189  12.654   1.074
  341   1HZ   LYS  42          1HZ       LYS  42 -11.375  14.488  -0.893
  342   2HZ   LYS  42          2HZ       LYS  42  -9.920  13.627  -0.968
  343   3HZ   LYS  42          3HZ       LYS  42 -10.040  15.002   0.009
  344    H    GLU  43           H        GLU  43 -10.959   8.525   4.099
  345    HA   GLU  43           HA       GLU  43 -11.093  10.779   5.981
  346   1HB   GLU  43          2HB       GLU  43 -12.585   8.175   6.280
  347   2HB   GLU  43          1HB       GLU  43 -12.761   9.625   7.259
  348   1HG   GLU  43          2HG       GLU  43 -14.221  10.525   5.847
  349   2HG   GLU  43          1HG       GLU  43 -13.235  10.129   4.441
  350    H    LEU  44           H        LEU  44 -10.570   7.257   5.862
  351    HA   LEU  44           HA       LEU  44  -9.214   7.075   8.311
  352   1HB   LEU  44          2HB       LEU  44  -9.995   5.327   6.242
  353   2HB   LEU  44          1HB       LEU  44  -8.269   5.098   6.448
  354    HG   LEU  44           HG       LEU  44  -9.462   3.506   7.812
  355   1HD1  LEU  44          1HD1      LEU  44  -8.473   3.967   9.964
  356   2HD1  LEU  44          2HD1      LEU  44  -8.314   5.677   9.561
  357   3HD1  LEU  44          3HD1      LEU  44  -7.367   4.472   8.686
  358   1HD2  LEU  44          1HD2      LEU  44 -11.542   4.232   8.345
  359   2HD2  LEU  44          2HD2      LEU  44 -11.022   5.902   8.573
  360   3HD2  LEU  44          3HD2      LEU  44 -10.727   4.707   9.836
  361    H    PHE  45           H        PHE  45  -7.202   7.535   8.915
  362    HA   PHE  45           HA       PHE  45  -5.348   8.577   6.919
  363   1HB   PHE  45          2HB       PHE  45  -5.864   9.787   9.092
  364   2HB   PHE  45          1HB       PHE  45  -4.969   8.514   9.915
  365    HD1  PHE  45           1HD      PHE  45  -4.739  11.446   7.764
  366    HD2  PHE  45           2HD      PHE  45  -2.560   8.319   9.658
  367    HE1  PHE  45           1HE      PHE  45  -2.642  12.667   7.357
  368    HE2  PHE  45           2HE      PHE  45  -0.460   9.535   9.255
  369    HZ   PHE  45           HZ       PHE  45  -0.498  11.711   8.103
  370    H    PHE  46           H        PHE  46  -4.733   6.617   5.930
  371    HA   PHE  46           HA       PHE  46  -3.595   4.481   7.477
  372   1HB   PHE  46          2HB       PHE  46  -3.755   5.002   4.511
  373   2HB   PHE  46          1HB       PHE  46  -2.979   3.578   5.193
  374    HD1  PHE  46           1HD      PHE  46  -5.870   4.691   3.734
  375    HD2  PHE  46           2HD      PHE  46  -4.560   2.406   7.072
  376    HE1  PHE  46           1HE      PHE  46  -8.046   3.545   3.792
  377    HE2  PHE  46           2HE      PHE  46  -6.734   1.254   7.141
  378    HZ   PHE  46           HZ       PHE  46  -8.481   1.826   5.501
  379    HA   PRO  47           HA       PRO  47   0.461   6.420   7.555
  380   1HB   PRO  47          2HB       PRO  47   1.687   4.525   9.046
  381   2HB   PRO  47          1HB       PRO  47   0.593   5.721   9.750
  382   1HG   PRO  47          2HG       PRO  47   0.077   2.871   9.028
  383   2HG   PRO  47          1HG       PRO  47  -0.451   3.777  10.456
  384   1HD   PRO  47          2HD       PRO  47  -2.062   3.285   8.307
  385   2HD   PRO  47          1HD       PRO  47  -2.242   4.700   9.359
  386    H    VAL  48           H        VAL  48  -0.390   3.275   6.382
  387    HA   VAL  48           HA       VAL  48   1.895   3.327   4.573
  388    HB   VAL  48           HB       VAL  48   1.140   0.760   5.933
  389   1HG1  VAL  48          1HG1      VAL  48   3.422   1.720   4.247
  390   2HG1  VAL  48          2HG1      VAL  48   2.393   0.305   4.026
  391   3HG1  VAL  48          3HG1      VAL  48   3.602   0.325   5.311
  392   1HG2  VAL  48          1HG2      VAL  48   1.762   2.080   7.758
  393   2HG2  VAL  48          2HG2      VAL  48   3.041   2.884   6.850
  394   3HG2  VAL  48          3HG2      VAL  48   3.225   1.194   7.322
  395    H    ILE  49           H        ILE  49   1.340   2.834   2.564
  396    HA   ILE  49           HA       ILE  49  -1.216   1.460   2.086
  397    HB   ILE  49           HB       ILE  49   0.040   3.363   0.125
  398   1HG1  ILE  49          2HG1      ILE  49  -0.303   4.617   2.205
  399   2HG1  ILE  49          1HG1      ILE  49  -1.453   5.124   0.972
  400   1HG2  ILE  49          1HG2      ILE  49  -2.482   1.863   0.367
  401   2HG2  ILE  49          2HG2      ILE  49  -1.584   2.357  -1.068
  402   3HG2  ILE  49          3HG2      ILE  49  -2.623   3.514  -0.238
  403   1HD1  ILE  49          1HD1      ILE  49  -1.905   3.710   3.527
  404   2HD1  ILE  49          2HD1      ILE  49  -2.947   3.289   2.169
  405   3HD1  ILE  49          3HD1      ILE  49  -2.862   4.959   2.731
  406    H    VAL  50           H        VAL  50  -1.315   0.137   0.163
  407    HA   VAL  50           HA       VAL  50   1.224  -0.593  -1.065
  408    HB   VAL  50           HB       VAL  50  -0.519  -2.653   0.296
  409   1HG1  VAL  50          1HG1      VAL  50   2.147  -3.449  -0.564
  410   2HG1  VAL  50          2HG1      VAL  50   1.105  -2.979  -1.906
  411   3HG1  VAL  50          3HG1      VAL  50   0.596  -4.253  -0.798
  412   1HG2  VAL  50          1HG2      VAL  50   1.373  -2.964   1.809
  413   2HG2  VAL  50          2HG2      VAL  50   0.752  -1.316   1.893
  414   3HG2  VAL  50          3HG2      VAL  50   2.236  -1.654   1.003
  415    H    LEU  51           H        LEU  51   0.657  -0.111  -3.075
  416    HA   LEU  51           HA       LEU  51  -1.952  -0.861  -4.107
  417   1HB   LEU  51          2HB       LEU  51  -1.149   1.335  -4.666
  418   2HB   LEU  51          1HB       LEU  51   0.336   0.674  -5.324
  419    HG   LEU  51           HG       LEU  51  -1.021  -0.454  -7.095
  420   1HD1  LEU  51          1HD1      LEU  51  -3.312   0.386  -7.465
  421   2HD1  LEU  51          2HD1      LEU  51  -3.235   1.207  -5.905
  422   3HD1  LEU  51          3HD1      LEU  51  -3.155  -0.553  -5.980
  423   1HD2  LEU  51          1HD2      LEU  51  -1.150   2.546  -6.871
  424   2HD2  LEU  51          2HD2      LEU  51  -1.497   1.646  -8.348
  425   3HD2  LEU  51          3HD2      LEU  51   0.115   1.580  -7.633
  426    H    ASP  52           H        ASP  52  -1.876  -3.092  -4.261
  427    HA   ASP  52           HA       ASP  52   0.221  -4.488  -5.603
  428   1HB   ASP  52          2HB       ASP  52  -1.203  -5.596  -3.928
  429   2HB   ASP  52          1HB       ASP  52  -2.607  -5.366  -4.964
  430    H    VAL  53           H        VAL  53   0.505  -3.572  -7.619
  431    HA   VAL  53           HA       VAL  53  -1.560  -2.960  -9.426
  432    HB   VAL  53           HB       VAL  53   0.202  -2.828 -11.137
  433   1HG1  VAL  53          1HG1      VAL  53  -0.196  -0.981  -9.539
  434   2HG1  VAL  53          2HG1      VAL  53   1.465  -1.041 -10.129
  435   3HG1  VAL  53          3HG1      VAL  53   1.081  -1.633  -8.513
  436   1HG2  VAL  53          1HG2      VAL  53   2.219  -3.801 -10.975
  437   2HG2  VAL  53          2HG2      VAL  53   1.469  -4.790  -9.724
  438   3HG2  VAL  53          3HG2      VAL  53   2.401  -3.363  -9.277
  439    H    TRP  54           H        TRP  54  -2.814  -5.015  -9.116
  440    HA   TRP  54           HA       TRP  54  -1.821  -7.418 -10.315
  441   1HB   TRP  54          2HB       TRP  54  -3.495  -7.617  -8.596
  442   2HB   TRP  54          1HB       TRP  54  -4.600  -6.567  -9.476
  443    HD1  TRP  54           HD       TRP  54  -6.547  -8.017 -10.275
  444    HE1  TRP  54           1HE      TRP  54  -6.796 -10.305 -11.424
  445    HE3  TRP  54           3HE      TRP  54  -1.637  -9.440 -10.321
  446    HZ2  TRP  54           2HZ      TRP  54  -5.132 -12.434 -12.242
  447    HZ3  TRP  54           3HZ      TRP  54  -1.050 -11.618 -11.305
  448    HH2  TRP  54           HH       TRP  54  -2.762 -13.083 -12.245
  449    H    MET  55           H        MET  55  -4.790  -5.721 -11.263
  450    HA   MET  55           HA       MET  55  -3.898  -5.254 -13.942
  451   1HB   MET  55          2HB       MET  55  -4.668  -7.810 -13.574
  452   2HB   MET  55          1HB       MET  55  -6.230  -7.084 -13.929
  453   1HG   MET  55          2HG       MET  55  -5.194  -6.116 -15.999
  454   2HG   MET  55          1HG       MET  55  -3.778  -7.110 -15.664
  455   1HE   MET  55          1HE       MET  55  -3.549  -9.452 -15.843
  456   2HE   MET  55          2HE       MET  55  -3.689  -9.099 -17.565
  457   3HE   MET  55          3HE       MET  55  -4.542 -10.480 -16.876
  458    HA   PRO  56           HA       PRO  56  -7.578  -2.799 -12.481
  459   1HB   PRO  56          2HB       PRO  56  -6.022  -0.464 -12.032
  460   2HB   PRO  56          1HB       PRO  56  -6.759  -1.507 -10.818
  461   1HG   PRO  56          2HG       PRO  56  -4.028  -1.175 -11.249
  462   2HG   PRO  56          1HG       PRO  56  -4.781  -2.489 -10.332
  463   1HD   PRO  56          2HD       PRO  56  -3.759  -2.472 -13.134
  464   2HD   PRO  56          1HD       PRO  56  -3.746  -3.779 -11.932
  465    H    ASP  57           H        ASP  57  -7.483  -0.041 -13.102
  466    HA   ASP  57           HA       ASP  57  -7.037  -0.077 -16.014
  467   1HB   ASP  57          2HB       ASP  57  -9.055   1.298 -16.287
  468   2HB   ASP  57          1HB       ASP  57  -9.435  -0.248 -15.535
  469    H    GLY  58           H        GLY  58  -7.304   1.925 -13.102
  470   1HA   GLY  58          2HA       GLY  58  -6.284   4.276 -14.410
  471   2HA   GLY  58          1HA       GLY  58  -6.570   4.081 -12.687
  472    H    ASP  59           H        ASP  59  -4.420   5.446 -13.160
  473    HA   ASP  59           HA       ASP  59  -2.162   3.558 -13.067
  474   1HB   ASP  59          2HB       ASP  59  -2.476   6.289 -14.185
  475   2HB   ASP  59          1HB       ASP  59  -0.933   5.928 -13.415
  476    H    GLY  60           H        GLY  60  -1.078   3.338 -11.220
  477   1HA   GLY  60          2HA       GLY  60  -1.903   4.833  -8.900
  478   2HA   GLY  60          1HA       GLY  60  -0.719   3.537  -8.941
  479    H    VAL  61           H        VAL  61   0.231   5.594 -11.307
  480    HA   VAL  61           HA       VAL  61   2.504   6.489  -9.949
  481    HB   VAL  61           HB       VAL  61   1.283   7.655 -12.454
  482   1HG1  VAL  61          1HG1      VAL  61   4.041   7.782 -11.270
  483   2HG1  VAL  61          2HG1      VAL  61   2.955   9.120 -11.647
  484   3HG1  VAL  61          3HG1      VAL  61   3.689   8.187 -12.951
  485   1HG2  VAL  61          1HG2      VAL  61   3.365   5.486 -12.251
  486   2HG2  VAL  61          2HG2      VAL  61   2.580   6.092 -13.709
  487   3HG2  VAL  61          3HG2      VAL  61   1.651   5.178 -12.521
  488    H    ASN  62           H        ASN  62  -0.254   8.431 -11.138
  489    HA   ASN  62           HA       ASN  62   0.497  10.749  -9.726
  490   1HB   ASN  62          2HB       ASN  62  -1.764  11.502 -10.431
  491   2HB   ASN  62          1HB       ASN  62  -0.789  10.891 -11.750
  492   1HD2  ASN  62          1HD2      ASN  62  -1.412   9.066 -12.812
  493   2HD2  ASN  62          2HD2      ASN  62  -2.928   8.283 -12.548
  494    H    PHE  63           H        PHE  63  -1.280   7.914  -8.857
  495    HA   PHE  63           HA       PHE  63  -2.967   8.953  -6.878
  496   1HB   PHE  63          2HB       PHE  63  -3.204   6.676  -7.759
  497   2HB   PHE  63          1HB       PHE  63  -1.678   6.219  -7.007
  498    HD1  PHE  63           1HD      PHE  63  -4.405   8.293  -5.590
  499    HD2  PHE  63           2HD      PHE  63  -2.313   4.589  -5.465
  500    HE1  PHE  63           1HE      PHE  63  -5.599   7.693  -3.526
  501    HE2  PHE  63           2HE      PHE  63  -3.507   3.982  -3.400
  502    HZ   PHE  63           HZ       PHE  63  -5.154   5.537  -2.430
  503    H    ILE  64           H        ILE  64   0.418   7.977  -6.755
  504    HA   ILE  64           HA       ILE  64   0.885   7.813  -4.063
  505    HB   ILE  64           HB       ILE  64   2.676   9.127  -6.110
  506   1HG1  ILE  64          2HG1      ILE  64   3.421   6.469  -5.226
  507   2HG1  ILE  64          1HG1      ILE  64   1.794   6.474  -5.900
  508   1HG2  ILE  64          1HG2      ILE  64   4.493   8.413  -4.507
  509   2HG2  ILE  64          2HG2      ILE  64   3.219   8.152  -3.316
  510   3HG2  ILE  64          3HG2      ILE  64   3.489   9.764  -3.980
  511   1HD1  ILE  64          1HD1      ILE  64   4.126   6.266  -7.313
  512   2HD1  ILE  64          2HD1      ILE  64   3.694   7.964  -7.515
  513   3HD1  ILE  64          3HD1      ILE  64   2.550   6.702  -7.975
  514    H    ASP  65           H        ASP  65   0.154  10.667  -5.917
  515    HA   ASP  65           HA       ASP  65   1.023  12.545  -3.946
  516   1HB   ASP  65          2HB       ASP  65   0.811  13.145  -6.332
  517   2HB   ASP  65          1HB       ASP  65  -0.931  12.912  -6.230
  518    H    PHE  66           H        PHE  66  -2.063  11.034  -4.783
  519    HA   PHE  66           HA       PHE  66  -3.731  12.503  -3.101
  520   1HB   PHE  66          2HB       PHE  66  -4.577  10.936  -4.794
  521   2HB   PHE  66          1HB       PHE  66  -3.943   9.582  -3.866
  522    HD1  PHE  66           1HD      PHE  66  -4.855   9.254  -1.495
  523    HD2  PHE  66           2HD      PHE  66  -6.727  11.717  -4.417
  524    HE1  PHE  66           1HE      PHE  66  -6.970   9.125  -0.245
  525    HE2  PHE  66           2HE      PHE  66  -8.845  11.592  -3.173
  526    HZ   PHE  66           HZ       PHE  66  -8.969  10.295  -1.083
  527    H    ILE  67           H        ILE  67  -1.797   9.608  -2.460
  528    HA   ILE  67           HA       ILE  67  -2.674   9.157   0.172
  529    HB   ILE  67           HB       ILE  67  -0.017   8.505  -1.115
  530   1HG1  ILE  67          2HG1      ILE  67  -1.199   6.144  -0.892
  531   2HG1  ILE  67          1HG1      ILE  67  -2.660   7.127  -0.901
  532   1HG2  ILE  67          1HG2      ILE  67   0.615   8.231   1.043
  533   2HG2  ILE  67          2HG2      ILE  67  -0.221   6.690   0.842
  534   3HG2  ILE  67          3HG2      ILE  67  -1.042   8.043   1.619
  535   1HD1  ILE  67          1HD1      ILE  67  -0.804   7.855  -3.011
  536   2HD1  ILE  67          2HD1      ILE  67  -2.524   7.475  -3.089
  537   3HD1  ILE  67          3HD1      ILE  67  -1.332   6.175  -3.101
  538    H    LYS  68           H        LYS  68  -0.026  11.121  -1.129
  539    HA   LYS  68           HA       LYS  68   0.855  11.976   1.471
  540   1HB   LYS  68          2HB       LYS  68   1.506  13.172  -1.228
  541   2HB   LYS  68          1HB       LYS  68   2.391  13.419   0.271
  542   1HG   LYS  68          2HG       LYS  68   2.275  10.634  -0.175
  543   2HG   LYS  68          1HG       LYS  68   2.727  11.392  -1.702
  544   1HD   LYS  68          2HD       LYS  68   4.810  11.392  -0.871
  545   2HD   LYS  68          1HD       LYS  68   4.267  12.761   0.101
  546   1HE   LYS  68          2HE       LYS  68   5.285  11.240   1.602
  547   2HE   LYS  68          1HE       LYS  68   3.545  11.086   1.842
  548   1HZ   LYS  68          1HZ       LYS  68   5.444   9.169   0.759
  549   2HZ   LYS  68          2HZ       LYS  68   3.931   9.218   0.006
  550   3HZ   LYS  68          3HZ       LYS  68   4.040   8.909   1.666
  551    H    GLU  69           H        GLU  69  -1.585  12.924  -0.730
  552    HA   GLU  69           HA       GLU  69  -1.763  15.674  -0.019
  553   1HB   GLU  69          2HB       GLU  69  -2.702  14.569  -2.105
  554   2HB   GLU  69          1HB       GLU  69  -3.997  13.961  -1.085
  555   1HG   GLU  69          2HG       GLU  69  -4.070  16.580  -0.453
  556   2HG   GLU  69          1HG       GLU  69  -3.514  16.665  -2.124
  557    H    ASN  70           H        ASN  70  -3.377  12.726   1.057
  558    HA   ASN  70           HA       ASN  70  -4.522  14.246   3.306
  559   1HB   ASN  70          2HB       ASN  70  -5.623  11.613   2.359
  560   2HB   ASN  70          1HB       ASN  70  -6.422  12.871   3.298
  561   1HD2  ASN  70          1HD2      ASN  70  -4.991  12.250   0.121
  562   2HD2  ASN  70          2HD2      ASN  70  -6.089  13.246  -0.763
  563    H    SER  71           H        SER  71  -1.920  12.590   2.812
  564    HA   SER  71           HA       SER  71  -1.759  11.577   5.477
  565   1HB   SER  71          2HB       SER  71  -2.470   9.748   3.333
  566   2HB   SER  71          1HB       SER  71  -0.959   9.276   4.109
  567    HG   SER  71           HG       SER  71  -2.591   8.353   5.276
  568    HA   PRO  72           HA       PRO  72   2.171  12.966   3.362
  569   1HB   PRO  72          2HB       PRO  72   2.419  14.750   5.668
  570   2HB   PRO  72          1HB       PRO  72   2.455  15.141   3.947
  571   1HG   PRO  72          2HG       PRO  72   0.390  15.830   5.547
  572   2HG   PRO  72          1HG       PRO  72   0.179  15.438   3.830
  573   1HD   PRO  72          2HD       PRO  72  -0.356  13.749   6.244
  574   2HD   PRO  72          1HD       PRO  72  -1.302  13.913   4.748
  575    H    ASP  73           H        ASP  73   1.250  11.935   6.490
  576    HA   ASP  73           HA       ASP  73   4.008  11.194   7.167
  577   1HB   ASP  73          2HB       ASP  73   2.623  12.523   8.809
  578   2HB   ASP  73          1HB       ASP  73   1.605  11.098   8.987
  579    H    SER  74           H        SER  74   2.561   9.757   5.175
  580    HA   SER  74           HA       SER  74   2.077   7.186   6.524
  581   1HB   SER  74          2HB       SER  74   0.131   8.051   5.295
  582   2HB   SER  74          1HB       SER  74   1.096   8.136   3.822
  583    HG   SER  74           HG       SER  74  -0.320   6.140   4.501
  584    H    VAL  75           H        VAL  75   2.216   5.678   4.066
  585    HA   VAL  75           HA       VAL  75   4.875   6.078   3.004
  586    HB   VAL  75           HB       VAL  75   4.304   3.525   4.516
  587   1HG1  VAL  75          1HG1      VAL  75   6.758   4.532   3.066
  588   2HG1  VAL  75          2HG1      VAL  75   5.714   3.203   2.563
  589   3HG1  VAL  75          3HG1      VAL  75   6.682   3.058   4.031
  590   1HG2  VAL  75          1HG2      VAL  75   4.652   5.271   6.116
  591   2HG2  VAL  75          2HG2      VAL  75   6.034   5.896   5.216
  592   3HG2  VAL  75          3HG2      VAL  75   6.138   4.328   6.015
  593    H    VAL  76           H        VAL  76   5.131   5.227   1.037
  594    HA   VAL  76           HA       VAL  76   2.939   3.534   0.015
  595    HB   VAL  76           HB       VAL  76   4.597   5.262  -1.786
  596   1HG1  VAL  76          1HG1      VAL  76   2.692   3.382  -2.281
  597   2HG1  VAL  76          2HG1      VAL  76   3.116   4.701  -3.372
  598   3HG1  VAL  76          3HG1      VAL  76   1.740   4.865  -2.282
  599   1HG2  VAL  76          1HG2      VAL  76   2.203   6.124  -0.173
  600   2HG2  VAL  76          2HG2      VAL  76   2.778   6.981  -1.603
  601   3HG2  VAL  76          3HG2      VAL  76   3.813   6.844  -0.183
  602    H    ILE  77           H        ILE  77   3.773   1.515   0.123
  603    HA   ILE  77           HA       ILE  77   6.501   0.976  -0.670
  604    HB   ILE  77           HB       ILE  77   4.317  -1.003  -0.008
  605   1HG1  ILE  77          2HG1      ILE  77   4.725   0.580   1.845
  606   2HG1  ILE  77          1HG1      ILE  77   5.252  -1.051   2.247
  607   1HG2  ILE  77          1HG2      ILE  77   5.855  -2.414  -0.836
  608   2HG2  ILE  77          2HG2      ILE  77   6.673  -2.152   0.704
  609   3HG2  ILE  77          3HG2      ILE  77   7.155  -1.228  -0.720
  610   1HD1  ILE  77          1HD1      ILE  77   7.551  -0.083   1.300
  611   2HD1  ILE  77          2HD1      ILE  77   7.063   0.067   2.988
  612   3HD1  ILE  77          3HD1      ILE  77   6.823   1.416   1.878
  613    H    VAL  78           H        VAL  78   3.264   0.060  -1.850
  614    HA   VAL  78           HA       VAL  78   2.538  -0.704  -3.876
  615    HB   VAL  78           HB       VAL  78   4.786   1.063  -4.873
  616   1HG1  VAL  78          1HG1      VAL  78   2.331   0.057  -6.313
  617   2HG1  VAL  78          2HG1      VAL  78   3.985  -0.489  -6.591
  618   3HG1  VAL  78          3HG1      VAL  78   3.532   1.174  -6.962
  619   1HG2  VAL  78          1HG2      VAL  78   2.148   1.616  -3.735
  620   2HG2  VAL  78          2HG2      VAL  78   2.446   2.412  -5.281
  621   3HG2  VAL  78          3HG2      VAL  78   3.548   2.671  -3.928
  622    H    ILE  79           H        ILE  79   2.968  -2.873  -3.847
  623    HA   ILE  79           HA       ILE  79   5.584  -3.758  -4.856
  624    HB   ILE  79           HB       ILE  79   3.633  -5.706  -3.712
  625   1HG1  ILE  79          2HG1      ILE  79   5.386  -3.961  -1.975
  626   2HG1  ILE  79          1HG1      ILE  79   3.650  -3.737  -2.158
  627   1HG2  ILE  79          1HG2      ILE  79   5.429  -6.999  -3.944
  628   2HG2  ILE  79          2HG2      ILE  79   6.238  -6.040  -2.707
  629   3HG2  ILE  79          3HG2      ILE  79   6.414  -5.613  -4.408
  630   1HD1  ILE  79          1HD1      ILE  79   3.711  -4.959  -0.238
  631   2HD1  ILE  79          2HD1      ILE  79   5.152  -5.855  -0.722
  632   3HD1  ILE  79          3HD1      ILE  79   3.585  -6.259  -1.424
  633    H    THR  80           H        THR  80   4.560  -6.415  -5.580
  634    HA   THR  80           HA       THR  80   3.606  -7.541  -7.305
  635    HB   THR  80           HB       THR  80   1.935  -5.088  -7.859
  636    HG1  THR  80           1HG      THR  80   1.770  -5.742  -5.652
  637   1HG2  THR  80          1HG2      THR  80   0.300  -6.608  -8.709
  638   2HG2  THR  80          2HG2      THR  80   1.284  -7.997  -8.249
  639   3HG2  THR  80          3HG2      THR  80   1.833  -6.912  -9.527
  640    H    GLY  81           H        GLY  81   4.897  -7.913  -8.961
  641   1HA   GLY  81          2HA       GLY  81   5.205  -5.898 -11.037
  642   2HA   GLY  81          1HA       GLY  81   6.683  -6.386 -10.221
  643    H    HIS  82           H        HIS  82   5.712  -6.728 -13.039
  644    HA   HIS  82           HA       HIS  82   5.514  -9.630 -13.253
  645   1HB   HIS  82          2HB       HIS  82   5.012  -7.334 -15.085
  646   2HB   HIS  82          1HB       HIS  82   5.462  -8.875 -15.807
  647    HD1  HIS  82           1HD      HIS  82   3.900 -10.934 -14.483
  648    HD2  HIS  82           2HD      HIS  82   2.329  -7.131 -15.064
  649    HE1  HIS  82           1HE      HIS  82   1.403 -11.211 -14.359
  650    HE2  HIS  82           2HE      HIS  82   0.478  -8.883 -14.622
  651    H    GLY  83           H        GLY  83   7.267  -7.365 -15.351
  652   1HA   GLY  83          2HA       GLY  83   9.828  -8.507 -14.652
  653   2HA   GLY  83          1HA       GLY  83   9.244  -8.985 -16.238
  654    H    SER  84           H        SER  84   9.008  -5.882 -14.524
  655    HA   SER  84           HA       SER  84  10.910  -4.653 -16.323
  656   1HB   SER  84          2HB       SER  84   8.116  -3.520 -16.278
  657   2HB   SER  84          1HB       SER  84   9.441  -3.120 -17.370
  658    HG   SER  84           HG       SER  84   8.216  -4.468 -18.541
  659    H    VAL  85           H        VAL  85  11.854  -2.870 -15.454
  660    HA   VAL  85           HA       VAL  85  10.898  -2.060 -12.793
  661    HB   VAL  85           HB       VAL  85  13.652  -1.586 -13.929
  662   1HG1  VAL  85          1HG1      VAL  85  12.435  -0.451 -11.770
  663   2HG1  VAL  85          2HG1      VAL  85  14.177  -0.638 -11.965
  664   3HG1  VAL  85          3HG1      VAL  85  13.262  -1.825 -11.036
  665   1HG2  VAL  85          1HG2      VAL  85  12.497  -3.974 -12.578
  666   2HG2  VAL  85          2HG2      VAL  85  14.153  -3.507 -12.193
  667   3HG2  VAL  85          3HG2      VAL  85  13.706  -3.874 -13.858
  668    H    ASP  86           H        ASP  86   9.646  -0.974 -15.060
  669    HA   ASP  86           HA       ASP  86  10.737   1.750 -15.209
  670   1HB   ASP  86          2HB       ASP  86   9.229   2.022 -17.171
  671   2HB   ASP  86          1HB       ASP  86  10.410   0.733 -17.382
  672    H    THR  87           H        THR  87   8.060  -0.121 -14.052
  673    HA   THR  87           HA       THR  87   6.347   2.181 -13.674
  674    HB   THR  87           HB       THR  87   5.615  -0.284 -14.106
  675    HG1  THR  87           1HG      THR  87   3.704   0.124 -12.914
  676   1HG2  THR  87          1HG2      THR  87   6.903  -1.109 -12.050
  677   2HG2  THR  87          2HG2      THR  87   5.261  -1.702 -12.303
  678   3HG2  THR  87          3HG2      THR  87   5.567  -0.432 -11.118
  679    H    ALA  88           H        ALA  88   8.449   0.123 -11.765
  680    HA   ALA  88           HA       ALA  88   7.834   1.055  -9.207
  681   1HB   ALA  88          1HB       ALA  88  10.158   0.350  -8.636
  682   2HB   ALA  88          2HB       ALA  88  10.445   0.075 -10.353
  683   3HB   ALA  88          3HB       ALA  88   9.232  -0.878  -9.500
  684    H    VAL  89           H        VAL  89  10.461   2.065 -11.360
  685    HA   VAL  89           HA       VAL  89  11.364   4.226  -9.851
  686    HB   VAL  89           HB       VAL  89  12.509   4.988 -11.826
  687   1HG1  VAL  89          1HG1      VAL  89  12.433   2.145 -11.132
  688   2HG1  VAL  89          2HG1      VAL  89  13.805   3.244 -11.274
  689   3HG1  VAL  89          3HG1      VAL  89  13.128   2.488 -12.716
  690   1HG2  VAL  89          1HG2      VAL  89  12.046   3.880 -14.040
  691   2HG2  VAL  89          2HG2      VAL  89  10.796   4.988 -13.474
  692   3HG2  VAL  89          3HG2      VAL  89  10.564   3.245 -13.326
  693    H    LYS  90           H        LYS  90   8.650   3.950 -12.031
  694    HA   LYS  90           HA       LYS  90   8.251   6.785 -12.293
  695   1HB   LYS  90          2HB       LYS  90   7.542   5.240 -14.058
  696   2HB   LYS  90          1HB       LYS  90   6.414   4.477 -12.946
  697   1HG   LYS  90          2HG       LYS  90   5.032   6.382 -12.875
  698   2HG   LYS  90          1HG       LYS  90   6.260   7.395 -13.637
  699   1HD   LYS  90          2HD       LYS  90   5.626   5.130 -15.306
  700   2HD   LYS  90          1HD       LYS  90   4.164   6.027 -14.891
  701   1HE   LYS  90          2HE       LYS  90   4.773   7.258 -16.689
  702   2HE   LYS  90          1HE       LYS  90   5.771   8.079 -15.490
  703   1HZ   LYS  90          1HZ       LYS  90   6.845   7.302 -17.671
  704   2HZ   LYS  90          2HZ       LYS  90   6.826   5.760 -16.975
  705   3HZ   LYS  90          3HZ       LYS  90   7.672   7.018 -16.224
  706    H    ALA  91           H        ALA  91   7.488   4.470  -9.905
  707    HA   ALA  91           HA       ALA  91   5.399   6.229  -8.802
  708   1HB   ALA  91          1HB       ALA  91   4.245   4.434  -8.090
  709   2HB   ALA  91          2HB       ALA  91   5.699   3.541  -7.645
  710   3HB   ALA  91          3HB       ALA  91   5.175   3.590  -9.328
  711    H    ILE  92           H        ILE  92   8.407   4.560  -8.092
  712    HA   ILE  92           HA       ILE  92   8.416   5.330  -5.323
  713    HB   ILE  92           HB       ILE  92  10.423   4.177  -5.088
  714   1HG1  ILE  92          2HG1      ILE  92  10.865   4.635  -8.046
  715   2HG1  ILE  92          1HG1      ILE  92  11.798   5.302  -6.712
  716   1HG2  ILE  92          1HG2      ILE  92   9.862   2.415  -7.279
  717   2HG2  ILE  92          2HG2      ILE  92   8.352   2.989  -6.573
  718   3HG2  ILE  92          3HG2      ILE  92   9.551   2.190  -5.559
  719   1HD1  ILE  92          1HD1      ILE  92  13.197   3.602  -6.874
  720   2HD1  ILE  92          2HD1      ILE  92  12.214   2.890  -8.154
  721   3HD1  ILE  92          3HD1      ILE  92  11.888   2.493  -6.467
  722    H    LYS  93           H        LYS  93   9.816   6.539  -8.307
  723    HA   LYS  93           HA       LYS  93  11.641   8.361  -7.190
  724   1HB   LYS  93          2HB       LYS  93  11.574   7.662  -9.588
  725   2HB   LYS  93          1HB       LYS  93  10.136   8.654  -9.795
  726   1HG   LYS  93          2HG       LYS  93  11.714  10.524  -8.802
  727   2HG   LYS  93          1HG       LYS  93  12.969   9.463  -9.446
  728   1HD   LYS  93          2HD       LYS  93  10.748   9.909 -11.295
  729   2HD   LYS  93          1HD       LYS  93  11.618  11.384 -10.865
  730   1HE   LYS  93          2HE       LYS  93  12.582  10.352 -12.849
  731   2HE   LYS  93          1HE       LYS  93  13.726  10.329 -11.508
  732   1HZ   LYS  93          1HZ       LYS  93  13.669   8.094 -11.384
  733   2HZ   LYS  93          2HZ       LYS  93  13.182   8.204 -12.999
  734   3HZ   LYS  93          3HZ       LYS  93  12.028   7.986 -11.781
  735    H    LYS  94           H        LYS  94   8.195   8.526  -7.733
  736    HA   LYS  94           HA       LYS  94   7.865  11.311  -7.472
  737   1HB   LYS  94          2HB       LYS  94   5.963   9.049  -6.858
  738   2HB   LYS  94          1HB       LYS  94   5.506  10.746  -6.889
  739   1HG   LYS  94          2HG       LYS  94   6.714  10.431  -9.320
  740   2HG   LYS  94          1HG       LYS  94   5.925   8.871  -9.084
  741   1HD   LYS  94          2HD       LYS  94   3.962   9.768  -9.622
  742   2HD   LYS  94          1HD       LYS  94   4.109  10.916  -8.291
  743   1HE   LYS  94          2HE       LYS  94   4.310  12.559  -9.770
  744   2HE   LYS  94          1HE       LYS  94   5.807  11.831 -10.349
  745   1HZ   LYS  94          1HZ       LYS  94   4.320  12.098 -12.179
  746   2HZ   LYS  94          2HZ       LYS  94   3.068  11.308 -11.363
  747   3HZ   LYS  94          3HZ       LYS  94   4.440  10.444 -11.847
  748    H    GLY  95           H        GLY  95   7.142   8.782  -5.052
  749   1HA   GLY  95          2HA       GLY  95   8.509  10.044  -2.943
  750   2HA   GLY  95          1HA       GLY  95   6.830  10.553  -2.900
  751    H    ALA  96           H        ALA  96   7.892   7.367  -3.953
  752    HA   ALA  96           HA       ALA  96   6.267   6.189  -1.845
  753   1HB   ALA  96          1HB       ALA  96   5.957   4.438  -3.215
  754   2HB   ALA  96          2HB       ALA  96   7.659   4.366  -3.672
  755   3HB   ALA  96          3HB       ALA  96   6.581   5.517  -4.462
  756    H    TYR  97           H        TYR  97   7.526   3.739  -1.527
  757    HA   TYR  97           HA       TYR  97   9.976   4.522  -0.094
  758   1HB   TYR  97          2HB       TYR  97   7.942   3.778   1.247
  759   2HB   TYR  97          1HB       TYR  97   8.219   2.172   0.585
  760    HD1  TYR  97           1HD      TYR  97   9.491   0.704   1.828
  761    HD2  TYR  97           2HD      TYR  97  10.110   4.882   2.332
  762    HE1  TYR  97           1HE      TYR  97  11.113   0.241   3.618
  763    HE2  TYR  97           2HE      TYR  97  11.733   4.431   4.124
  764    HH   TYR  97           HH       TYR  97  12.329   2.703   5.679
  765    H    GLU  98           H        GLU  98   9.691   3.594  -2.869
  766    HA   GLU  98           HA       GLU  98  10.974   2.391  -4.307
  767   1HB   GLU  98          2HB       GLU  98  12.984   1.577  -3.639
  768   2HB   GLU  98          1HB       GLU  98  12.601   2.492  -2.193
  769   1HG   GLU  98          2HG       GLU  98  13.041   0.619  -1.086
  770   2HG   GLU  98          1HG       GLU  98  11.484   0.037  -1.664
  771    H    PHE  99           H        PHE  99  10.673   0.523  -5.448
  772    HA   PHE  99           HA       PHE  99   8.428  -1.053  -4.777
  773   1HB   PHE  99          2HB       PHE  99  10.212  -0.738  -7.024
  774   2HB   PHE  99          1HB       PHE  99   9.893  -2.443  -6.737
  775    HD1  PHE  99           1HD      PHE  99   8.357  -3.187  -8.271
  776    HD2  PHE  99           2HD      PHE  99   7.757   0.602  -6.427
  777    HE1  PHE  99           1HE      PHE  99   6.195  -2.971  -9.426
  778    HE2  PHE  99           2HE      PHE  99   5.593   0.824  -7.578
  779    HZ   PHE  99           HZ       PHE  99   4.809  -0.965  -9.078
  780    H    LEU 100           H        LEU 100   8.318  -2.661  -3.369
  781    HA   LEU 100           HA       LEU 100  10.501  -3.792  -2.048
  782   1HB   LEU 100          2HB       LEU 100   7.845  -3.795  -1.639
  783   2HB   LEU 100          1HB       LEU 100   8.030  -5.408  -2.299
  784    HG   LEU 100           HG       LEU 100   8.156  -5.707   0.016
  785   1HD1  LEU 100          1HD1      LEU 100  10.103  -6.615  -1.433
  786   2HD1  LEU 100          2HD1      LEU 100  10.222  -6.692   0.325
  787   3HD1  LEU 100          3HD1      LEU 100  11.074  -5.427  -0.562
  788   1HD2  LEU 100          1HD2      LEU 100  10.193  -3.511   0.267
  789   2HD2  LEU 100          2HD2      LEU 100   9.297  -4.328   1.548
  790   3HD2  LEU 100          3HD2      LEU 100   8.462  -3.231   0.449
  791    H    GLU 101           H        GLU 101  11.867  -5.392  -2.542
  792    HA   GLU 101           HA       GLU 101  11.975  -6.508  -5.115
  793   1HB   GLU 101          2HB       GLU 101  13.381  -7.037  -2.531
  794   2HB   GLU 101          1HB       GLU 101  13.569  -8.187  -3.848
  795   1HG   GLU 101          2HG       GLU 101  14.352  -6.356  -5.297
  796   2HG   GLU 101          1HG       GLU 101  14.234  -5.253  -3.926
  797    H    LYS 102           H        LYS 102  11.496  -8.308  -2.074
  798    HA   LYS 102           HA       LYS 102  10.313 -10.189  -1.590
  799   1HB   LYS 102          2HB       LYS 102   8.551  -8.518  -2.775
  800   2HB   LYS 102          1HB       LYS 102   8.461  -9.884  -3.878
  801   1HG   LYS 102          2HG       LYS 102   8.358 -10.870  -1.211
  802   2HG   LYS 102          1HG       LYS 102   7.194  -9.555  -1.374
  803   1HD   LYS 102          2HD       LYS 102   7.265 -11.512  -3.585
  804   2HD   LYS 102          1HD       LYS 102   6.661 -12.108  -2.037
  805   1HE   LYS 102          2HE       LYS 102   5.327  -9.784  -2.176
  806   2HE   LYS 102          1HE       LYS 102   5.504 -10.122  -3.898
  807   1HZ   LYS 102          1HZ       LYS 102   4.131 -11.892  -3.785
  808   2HZ   LYS 102          2HZ       LYS 102   3.510 -11.066  -2.444
  809   3HZ   LYS 102          3HZ       LYS 102   4.611 -12.330  -2.223
  810    HA   PRO 103           HA       PRO 103  12.195 -12.394  -5.278
  811   1HB   PRO 103          2HB       PRO 103  14.555 -13.132  -4.249
  812   2HB   PRO 103          1HB       PRO 103  14.313 -11.524  -4.943
  813   1HG   PRO 103          2HG       PRO 103  14.340 -12.366  -2.072
  814   2HG   PRO 103          1HG       PRO 103  15.056 -10.929  -2.824
  815   1HD   PRO 103          2HD       PRO 103  12.648 -10.944  -1.488
  816   2HD   PRO 103          1HD       PRO 103  13.092  -9.762  -2.735
  817    H    PHE 104           H        PHE 104  11.093 -13.085  -2.230
  818    HA   PHE 104           HA       PHE 104  11.286 -15.974  -2.732
  819   1HB   PHE 104          2HB       PHE 104  12.777 -14.958  -0.813
  820   2HB   PHE 104          1HB       PHE 104  11.262 -14.961   0.083
  821    HD1  PHE 104           1HD      PHE 104  12.710 -17.390  -2.346
  822    HD2  PHE 104           2HD      PHE 104  11.344 -16.670   1.620
  823    HE1  PHE 104           1HE      PHE 104  13.042 -19.766  -1.805
  824    HE2  PHE 104           2HE      PHE 104  11.674 -19.046   2.169
  825    HZ   PHE 104           HZ       PHE 104  12.523 -20.598   0.455
  826    H    SER 105           H        SER 105   9.673 -13.693  -0.503
  827    HA   SER 105           HA       SER 105   7.079 -14.243  -1.497
  828   1HB   SER 105          2HB       SER 105   6.153 -15.597   0.234
  829   2HB   SER 105          1HB       SER 105   7.634 -16.404  -0.281
  830    HG   SER 105           HG       SER 105   8.034 -16.352   1.793
  831    H    VAL 106           H        VAL 106   5.389 -13.540   0.318
  832    HA   VAL 106           HA       VAL 106   5.734 -10.832   0.771
  833    HB   VAL 106           HB       VAL 106   3.546 -11.932   0.830
  834   1HG1  VAL 106          1HG1      VAL 106   4.141 -12.891   3.606
  835   2HG1  VAL 106          2HG1      VAL 106   4.467 -13.899   2.197
  836   3HG1  VAL 106          3HG1      VAL 106   2.823 -13.354   2.529
  837   1HG2  VAL 106          1HG2      VAL 106   2.683 -10.795   2.945
  838   2HG2  VAL 106          2HG2      VAL 106   3.525  -9.783   1.771
  839   3HG2  VAL 106          3HG2      VAL 106   4.358 -10.319   3.230
  840    H    GLU 107           H        GLU 107   6.475 -13.553   2.900
  841    HA   GLU 107           HA       GLU 107   6.876 -12.509   5.326
  842   1HB   GLU 107          2HB       GLU 107   7.477 -14.832   4.442
  843   2HB   GLU 107          1HB       GLU 107   9.058 -14.151   4.081
  844   1HG   GLU 107          2HG       GLU 107   8.756 -13.375   6.649
  845   2HG   GLU 107          1HG       GLU 107   7.855 -14.891   6.653
  846    H    ARG 108           H        ARG 108   9.002 -11.948   2.564
  847    HA   ARG 108           HA       ARG 108  10.991 -10.526   4.029
  848   1HB   ARG 108          2HB       ARG 108  11.458 -11.588   1.857
  849   2HB   ARG 108          1HB       ARG 108  10.352 -10.469   1.072
  850   1HG   ARG 108          2HG       ARG 108  12.197  -9.277   0.661
  851   2HG   ARG 108          1HG       ARG 108  12.028  -8.749   2.336
  852   1HD   ARG 108          2HD       ARG 108  14.312  -9.512   1.802
  853   2HD   ARG 108          1HD       ARG 108  13.554 -10.469   3.074
  854    HE   ARG 108           HE       ARG 108  13.094 -11.707   0.596
  855   1HH1  ARG 108          1HH1      ARG 108  15.700 -11.059   2.824
  856   2HH1  ARG 108          2HH1      ARG 108  16.613 -12.455   2.359
  857   1HH2  ARG 108          1HH2      ARG 108  14.291 -13.545  -0.017
  858   2HH2  ARG 108          2HH2      ARG 108  15.812 -13.868   0.746
  859    H    PHE 109           H        PHE 109   8.174  -9.593   2.130
  860    HA   PHE 109           HA       PHE 109   8.508  -6.825   2.128
  861   1HB   PHE 109          2HB       PHE 109   6.838  -7.762   0.717
  862   2HB   PHE 109          1HB       PHE 109   6.050  -8.575   2.063
  863    HD1  PHE 109           1HD      PHE 109   7.173  -5.043   1.840
  864    HD2  PHE 109           2HD      PHE 109   3.882  -7.735   2.010
  865    HE1  PHE 109           1HE      PHE 109   5.634  -3.139   2.084
  866    HE2  PHE 109           2HE      PHE 109   2.336  -5.837   2.254
  867    HZ   PHE 109           HZ       PHE 109   3.212  -3.535   2.292
  868    H    LEU 110           H        LEU 110   7.378  -8.987   4.623
  869    HA   LEU 110           HA       LEU 110   6.072  -7.180   6.296
  870   1HB   LEU 110          2HB       LEU 110   6.970  -9.865   6.421
  871   2HB   LEU 110          1HB       LEU 110   7.438  -9.054   7.904
  872    HG   LEU 110           HG       LEU 110   4.629  -9.011   6.819
  873   1HD1  LEU 110          1HD1      LEU 110   4.298 -10.636   8.802
  874   2HD1  LEU 110          2HD1      LEU 110   6.018 -10.968   8.595
  875   3HD1  LEU 110          3HD1      LEU 110   4.896 -11.257   7.264
  876   1HD2  LEU 110          1HD2      LEU 110   5.011  -7.204   8.313
  877   2HD2  LEU 110          2HD2      LEU 110   5.876  -8.240   9.448
  878   3HD2  LEU 110          3HD2      LEU 110   4.138  -8.441   9.216
  879    H    LEU 111           H        LEU 111   9.497  -8.075   6.148
  880    HA   LEU 111           HA       LEU 111  10.430  -6.723   8.375
  881   1HB   LEU 111          2HB       LEU 111  11.741  -7.198   5.710
  882   2HB   LEU 111          1HB       LEU 111  12.586  -6.524   7.089
  883    HG   LEU 111           HG       LEU 111  11.455  -8.828   8.117
  884   1HD1  LEU 111          1HD1      LEU 111  10.940  -9.366   5.666
  885   2HD1  LEU 111          2HD1      LEU 111  11.756 -10.597   6.630
  886   3HD1  LEU 111          3HD1      LEU 111  12.679  -9.610   5.496
  887   1HD2  LEU 111          1HD2      LEU 111  13.575  -8.488   8.836
  888   2HD2  LEU 111          2HD2      LEU 111  14.138  -7.930   7.260
  889   3HD2  LEU 111          3HD2      LEU 111  13.937  -9.656   7.566
  890    H    THR 112           H        THR 112  10.200  -5.487   5.043
  891    HA   THR 112           HA       THR 112  11.116  -2.902   5.572
  892    HB   THR 112           HB       THR 112   9.192  -3.876   3.455
  893    HG1  THR 112           1HG      THR 112  11.115  -3.834   2.179
  894   1HG2  THR 112          1HG2      THR 112  10.811  -1.650   2.653
  895   2HG2  THR 112          2HG2      THR 112   9.817  -1.222   4.045
  896   3HG2  THR 112          3HG2      THR 112   9.061  -1.851   2.580
  897    H    ILE 113           H        ILE 113   7.849  -4.255   5.684
  898    HA   ILE 113           HA       ILE 113   6.340  -1.979   5.965
  899    HB   ILE 113           HB       ILE 113   6.029  -4.754   7.019
  900   1HG1  ILE 113          2HG1      ILE 113   5.465  -4.188   4.681
  901   2HG1  ILE 113          1HG1      ILE 113   4.057  -4.732   5.587
  902   1HG2  ILE 113          1HG2      ILE 113   4.440  -2.377   7.916
  903   2HG2  ILE 113          2HG2      ILE 113   5.107  -3.698   8.875
  904   3HG2  ILE 113          3HG2      ILE 113   3.711  -3.982   7.836
  905   1HD1  ILE 113          1HD1      ILE 113   3.675  -2.188   5.975
  906   2HD1  ILE 113          2HD1      ILE 113   3.218  -2.933   4.443
  907   3HD1  ILE 113          3HD1      ILE 113   4.719  -2.017   4.564
  908    H    LYS 114           H        LYS 114   7.695  -3.855   8.695
  909    HA   LYS 114           HA       LYS 114   6.932  -2.207  10.756
  910   1HB   LYS 114          2HB       LYS 114   8.092  -4.368  11.066
  911   2HB   LYS 114          1HB       LYS 114   9.585  -3.639  10.493
  912   1HG   LYS 114          2HG       LYS 114   8.236  -2.329  12.777
  913   2HG   LYS 114          1HG       LYS 114   9.001  -3.890  13.073
  914   1HD   LYS 114          2HD       LYS 114  10.343  -1.472  11.865
  915   2HD   LYS 114          1HD       LYS 114  10.530  -2.029  13.528
  916   1HE   LYS 114          2HE       LYS 114  11.181  -4.286  12.295
  917   2HE   LYS 114          1HE       LYS 114  11.609  -3.163  11.004
  918   1HZ   LYS 114          1HZ       LYS 114  12.567  -2.683  13.747
  919   2HZ   LYS 114          2HZ       LYS 114  13.241  -2.186  12.277
  920   3HZ   LYS 114          3HZ       LYS 114  13.365  -3.804  12.761
  921    H    HIS 115           H        HIS 115  10.118  -2.141   9.186
  922    HA   HIS 115           HA       HIS 115  11.044   0.230  10.216
  923   1HB   HIS 115          2HB       HIS 115  12.138  -1.528   8.611
  924   2HB   HIS 115          1HB       HIS 115  11.605  -0.414   7.358
  925    HD1  HIS 115           1HD      HIS 115  14.232  -0.119   6.918
  926    HD2  HIS 115           2HD      HIS 115  12.802   1.387  10.517
  927    HE1  HIS 115           1HE      HIS 115  16.024   1.433   7.755
  928    HE2  HIS 115           2HE      HIS 115  15.182   2.251   9.984
  929    H    ALA 116           H        ALA 116   8.639  -0.266   7.740
  930    HA   ALA 116           HA       ALA 116   8.717   2.329   6.601
  931   1HB   ALA 116          1HB       ALA 116   6.090   1.053   6.608
  932   2HB   ALA 116          2HB       ALA 116   7.385  -0.006   6.045
  933   3HB   ALA 116          3HB       ALA 116   7.108   1.546   5.254
  934    H    PHE 117           H        PHE 117   6.935   0.904   9.291
  935    HA   PHE 117           HA       PHE 117   5.325   3.192   9.812
  936   1HB   PHE 117          2HB       PHE 117   5.929   0.627  11.215
  937   2HB   PHE 117          1HB       PHE 117   5.170   1.927  12.129
  938    HD1  PHE 117           1HD      PHE 117   2.931   2.647  11.637
  939    HD2  PHE 117           2HD      PHE 117   4.746  -0.498   9.419
  940    HE1  PHE 117           1HE      PHE 117   0.728   2.016  10.747
  941    HE2  PHE 117           2HE      PHE 117   2.547  -1.134   8.524
  942    HZ   PHE 117           HZ       PHE 117   0.535   0.128   9.185
  943    H    GLU 118           H        GLU 118   8.501   2.147  10.822
  944    HA   GLU 118           HA       GLU 118   8.673   4.167  12.899
  945   1HB   GLU 118          2HB       GLU 118  10.342   1.889  12.007
  946   2HB   GLU 118          1HB       GLU 118  11.160   3.227  12.802
  947   1HG   GLU 118          2HG       GLU 118   8.778   2.424  14.229
  948   2HG   GLU 118          1HG       GLU 118   9.905   1.085  14.020
  949    H    GLU 119           H        GLU 119   9.953   3.563   9.676
  950    HA   GLU 119           HA       GLU 119  11.711   5.819   9.697
  951   1HB   GLU 119          2HB       GLU 119  10.717   4.028   7.493
  952   2HB   GLU 119          1HB       GLU 119  11.829   5.362   7.213
  953   1HG   GLU 119          2HG       GLU 119  12.718   3.644   9.367
  954   2HG   GLU 119          1HG       GLU 119  12.493   2.759   7.859
  955    H    TYR 120           H        TYR 120   8.401   5.635   9.541
  956    HA   TYR 120           HA       TYR 120   8.253   8.328   8.431
  957   1HB   TYR 120          2HB       TYR 120   7.576   6.158   6.863
  958   2HB   TYR 120          1HB       TYR 120   6.024   6.668   7.519
  959    HD1  TYR 120           1HD      TYR 120   5.951   9.458   7.550
  960    HD2  TYR 120           2HD      TYR 120   7.962   6.968   4.749
  961    HE1  TYR 120           1HE      TYR 120   5.837  11.257   5.878
  962    HE2  TYR 120           2HE      TYR 120   7.853   8.759   3.068
  963    HH   TYR 120           HH       TYR 120   5.914  11.545   3.475
  964    H    SER 121           H        SER 121   8.123   7.676  11.085
  965    HA   SER 121           HA       SER 121   5.719   8.867  11.893
  966   1HB   SER 121          2HB       SER 121   5.202   6.284  11.262
  967   2HB   SER 121          1HB       SER 121   5.648   6.105  12.958
  968    HG   SER 121           HG       SER 121   4.094   7.908  13.293
  Start of MODEL   37
    1   1H    MET   1          1HT       MET   1  -1.470   1.321  18.124
    2   2H    MET   1          2HT       MET   1  -3.030   1.386  18.835
    3   3H    MET   1          3HT       MET   1  -2.644   2.410  17.513
    4    HA   MET   1           HA       MET   1  -2.579  -0.518  17.336
    5   1HB   MET   1          2HB       MET   1  -4.823   0.851  17.967
    6   2HB   MET   1          1HB       MET   1  -4.861   1.005  16.216
    7   1HG   MET   1          2HG       MET   1  -5.516  -1.097  15.948
    8   2HG   MET   1          1HG       MET   1  -4.277  -1.704  17.046
    9   1HE   MET   1          1HE       MET   1  -7.121  -2.866  16.548
   10   2HE   MET   1          2HE       MET   1  -7.888  -3.117  18.117
   11   3HE   MET   1          3HE       MET   1  -6.234  -3.666  17.844
   12    H    LYS   2           H        LYS   2  -1.732  -1.144  15.456
   13    HA   LYS   2           HA       LYS   2  -1.126   0.888  13.449
   14   1HB   LYS   2          2HB       LYS   2  -0.219  -1.991  13.606
   15   2HB   LYS   2          1HB       LYS   2   0.384  -0.773  12.491
   16   1HG   LYS   2          2HG       LYS   2   0.706  -0.797  15.483
   17   2HG   LYS   2          1HG       LYS   2   1.961  -1.078  14.275
   18   1HD   LYS   2          2HD       LYS   2   1.042   1.334  13.477
   19   2HD   LYS   2          1HD       LYS   2   0.756   1.445  15.214
   20   1HE   LYS   2          2HE       LYS   2   3.378   0.358  14.454
   21   2HE   LYS   2          1HE       LYS   2   3.109   2.037  13.991
   22   1HZ   LYS   2          1HZ       LYS   2   3.004   0.868  16.710
   23   2HZ   LYS   2          2HZ       LYS   2   2.402   2.409  16.356
   24   3HZ   LYS   2          3HZ       LYS   2   4.045   2.069  16.136
   25    H    ARG   3           H        ARG   3  -1.532   0.521  11.197
   26    HA   ARG   3           HA       ARG   3  -3.240  -1.598  10.326
   27   1HB   ARG   3          2HB       ARG   3  -4.973   0.303   9.558
   28   2HB   ARG   3          1HB       ARG   3  -5.153  -0.613  11.045
   29   1HG   ARG   3          2HG       ARG   3  -5.513   1.569  11.712
   30   2HG   ARG   3          1HG       ARG   3  -3.824   1.296  12.138
   31   1HD   ARG   3          2HD       ARG   3  -3.044   2.557  10.326
   32   2HD   ARG   3          1HD       ARG   3  -4.597   2.487   9.497
   33    HE   ARG   3           HE       ARG   3  -3.774   4.442  11.365
   34   1HH1  ARG   3          1HH1      ARG   3  -6.572   2.592  10.401
   35   2HH1  ARG   3          2HH1      ARG   3  -7.703   3.778  10.960
   36   1HH2  ARG   3          1HH2      ARG   3  -5.259   6.003  12.098
   37   2HH2  ARG   3          2HH2      ARG   3  -6.959   5.716  11.922
   38    H    VAL   4           H        VAL   4  -2.747  -1.972   8.262
   39    HA   VAL   4           HA       VAL   4  -1.648   0.256   6.671
   40    HB   VAL   4           HB       VAL   4  -1.085  -2.682   6.260
   41   1HG1  VAL   4          1HG1      VAL   4   0.859  -0.801   5.240
   42   2HG1  VAL   4          2HG1      VAL   4  -0.743  -0.499   4.569
   43   3HG1  VAL   4          3HG1      VAL   4  -0.006  -2.090   4.405
   44   1HG2  VAL   4          1HG2      VAL   4   0.699  -0.622   7.556
   45   2HG2  VAL   4          2HG2      VAL   4   1.061  -2.330   7.301
   46   3HG2  VAL   4          3HG2      VAL   4  -0.209  -1.857   8.429
   47    H    LEU   5           H        LEU   5  -2.363   0.547   4.576
   48    HA   LEU   5           HA       LEU   5  -4.899  -0.747   3.947
   49   1HB   LEU   5          2HB       LEU   5  -4.807   1.694   3.882
   50   2HB   LEU   5          1HB       LEU   5  -3.525   1.627   2.688
   51    HG   LEU   5           HG       LEU   5  -5.108   0.529   1.111
   52   1HD1  LEU   5          1HD1      LEU   5  -7.347   0.222   1.571
   53   2HD1  LEU   5          2HD1      LEU   5  -7.339   1.360   2.916
   54   3HD1  LEU   5          3HD1      LEU   5  -6.595  -0.228   3.100
   55   1HD2  LEU   5          1HD2      LEU   5  -6.675   2.714   1.121
   56   2HD2  LEU   5          2HD2      LEU   5  -5.015   2.707   0.524
   57   3HD2  LEU   5          3HD2      LEU   5  -5.363   3.274   2.157
   58    H    VAL   6           H        VAL   6  -5.139  -2.214   2.387
   59    HA   VAL   6           HA       VAL   6  -2.849  -2.689   0.586
   60    HB   VAL   6           HB       VAL   6  -4.902  -4.738   1.408
   61   1HG1  VAL   6          1HG1      VAL   6  -3.892  -5.384  -0.617
   62   2HG1  VAL   6          2HG1      VAL   6  -3.038  -6.283   0.637
   63   3HG1  VAL   6          3HG1      VAL   6  -2.296  -4.855  -0.085
   64   1HG2  VAL   6          1HG2      VAL   6  -3.652  -5.396   3.187
   65   2HG2  VAL   6          2HG2      VAL   6  -3.234  -3.684   3.197
   66   3HG2  VAL   6          3HG2      VAL   6  -2.137  -4.854   2.465
   67    H    VAL   7           H        VAL   7  -3.353  -1.743  -1.310
   68    HA   VAL   7           HA       VAL   7  -6.082  -1.908  -2.315
   69    HB   VAL   7           HB       VAL   7  -3.691  -0.532  -3.555
   70   1HG1  VAL   7          1HG1      VAL   7  -6.529  -0.810  -4.322
   71   2HG1  VAL   7          2HG1      VAL   7  -5.097  -0.579  -5.324
   72   3HG1  VAL   7          3HG1      VAL   7  -5.823   0.798  -4.494
   73   1HG2  VAL   7          1HG2      VAL   7  -5.894   0.642  -1.861
   74   2HG2  VAL   7          2HG2      VAL   7  -4.587   1.534  -2.639
   75   3HG2  VAL   7          3HG2      VAL   7  -4.225   0.389  -1.347
   76    H    ASP   8           H        ASP   8  -6.731  -3.402  -3.691
   77    HA   ASP   8           HA       ASP   8  -5.145  -4.370  -5.836
   78   1HB   ASP   8          2HB       ASP   8  -4.032  -5.669  -4.126
   79   2HB   ASP   8          1HB       ASP   8  -5.574  -6.220  -3.479
   80    H    ASP   9           H        ASP   9  -6.314  -5.901  -7.179
   81    HA   ASP   9           HA       ASP   9  -9.180  -5.463  -6.986
   82   1HB   ASP   9          2HB       ASP   9  -7.864  -5.125  -9.120
   83   2HB   ASP   9          1HB       ASP   9  -7.686  -6.875  -9.197
   84    H    GLU  10           H        GLU  10  -8.486  -7.084  -4.970
   85    HA   GLU  10           HA       GLU  10  -9.180  -9.800  -5.861
   86   1HB   GLU  10          2HB       GLU  10  -7.288  -8.793  -3.933
   87   2HB   GLU  10          1HB       GLU  10  -8.435  -9.866  -3.144
   88   1HG   GLU  10          2HG       GLU  10  -7.913 -11.632  -4.712
   89   2HG   GLU  10          1HG       GLU  10  -6.827 -10.558  -5.591
   90    H    GLU  11           H        GLU  11 -10.167 -10.915  -3.616
   91    HA   GLU  11           HA       GLU  11 -12.817  -9.893  -3.523
   92   1HB   GLU  11          2HB       GLU  11 -11.807 -12.328  -3.113
   93   2HB   GLU  11          1HB       GLU  11 -11.875 -11.797  -1.438
   94   1HG   GLU  11          2HG       GLU  11 -13.869 -13.052  -2.127
   95   2HG   GLU  11          1HG       GLU  11 -14.242 -11.409  -1.603
   96    H    SER  12           H        SER  12 -10.563 -10.421  -0.808
   97    HA   SER  12           HA       SER  12 -11.493  -7.885   0.353
   98   1HB   SER  12          2HB       SER  12 -12.700  -9.457   1.631
   99   2HB   SER  12          1HB       SER  12 -11.345 -10.585   1.684
  100    HG   SER  12           HG       SER  12 -11.512  -8.069   2.989
  101    H    ILE  13           H        ILE  13  -9.279 -10.363   1.589
  102    HA   ILE  13           HA       ILE  13  -7.193  -8.316   1.786
  103    HB   ILE  13           HB       ILE  13  -7.006 -11.094   2.908
  104   1HG1  ILE  13          2HG1      ILE  13  -9.116 -10.008   3.692
  105   2HG1  ILE  13          1HG1      ILE  13  -7.968 -10.331   4.987
  106   1HG2  ILE  13          1HG2      ILE  13  -4.931 -10.158   3.113
  107   2HG2  ILE  13          2HG2      ILE  13  -5.663  -9.645   4.634
  108   3HG2  ILE  13          3HG2      ILE  13  -5.565  -8.520   3.278
  109   1HD1  ILE  13          1HD1      ILE  13  -7.333  -7.773   4.188
  110   2HD1  ILE  13          2HD1      ILE  13  -8.293  -8.224   5.597
  111   3HD1  ILE  13          3HD1      ILE  13  -9.092  -7.822   4.078
  112    H    THR  14           H        THR  14  -4.954  -8.979   1.327
  113    HA   THR  14           HA       THR  14  -4.845 -10.387  -1.215
  114    HB   THR  14           HB       THR  14  -2.561  -9.483  -1.375
  115    HG1  THR  14           1HG      THR  14  -1.586  -8.614   0.280
  116   1HG2  THR  14          1HG2      THR  14  -3.043  -7.125  -1.488
  117   2HG2  THR  14          2HG2      THR  14  -4.478  -7.339  -0.486
  118   3HG2  THR  14          3HG2      THR  14  -4.419  -8.042  -2.102
  119    H    SER  15           H        SER  15  -3.644 -12.229  -1.591
  120    HA   SER  15           HA       SER  15  -3.483 -14.147   0.385
  121   1HB   SER  15          2HB       SER  15  -1.643 -15.105  -1.316
  122   2HB   SER  15          1HB       SER  15  -3.370 -15.132  -1.673
  123    HG   SER  15           HG       SER  15  -1.537 -13.120  -2.484
  124    H    SER  16           H        SER  16  -2.009 -14.818   1.835
  125    HA   SER  16           HA       SER  16  -0.019 -15.038   2.956
  126   1HB   SER  16          2HB       SER  16   1.280 -12.829   1.404
  127   2HB   SER  16          1HB       SER  16   2.003 -14.273   2.110
  128    HG   SER  16           HG       SER  16   1.507 -15.380   0.375
  129    H    LEU  17           H        LEU  17  -1.198 -11.793   2.215
  130    HA   LEU  17           HA       LEU  17   0.007 -10.433   4.332
  131   1HB   LEU  17          2HB       LEU  17  -1.915  -9.887   2.325
  132   2HB   LEU  17          1HB       LEU  17  -2.630  -9.402   3.847
  133    HG   LEU  17           HG       LEU  17  -0.525  -8.125   2.272
  134   1HD1  LEU  17          1HD1      LEU  17  -2.509  -6.951   2.636
  135   2HD1  LEU  17          2HD1      LEU  17  -1.319  -6.185   3.688
  136   3HD1  LEU  17          3HD1      LEU  17  -2.505  -7.304   4.363
  137   1HD2  LEU  17          1HD2      LEU  17   0.514  -7.158   4.415
  138   2HD2  LEU  17          2HD2      LEU  17   1.059  -8.743   3.870
  139   3HD2  LEU  17          3HD2      LEU  17  -0.091  -8.617   5.200
  140    H    SER  18           H        SER  18  -3.243 -11.880   4.162
  141    HA   SER  18           HA       SER  18  -4.229 -11.286   6.629
  142   1HB   SER  18          2HB       SER  18  -5.426 -13.524   6.501
  143   2HB   SER  18          1HB       SER  18  -5.618 -12.468   5.102
  144    HG   SER  18           HG       SER  18  -4.086 -13.698   4.009
  145    H    ALA  19           H        ALA  19  -2.645 -14.422   6.003
  146    HA   ALA  19           HA       ALA  19  -2.384 -15.278   8.599
  147   1HB   ALA  19          1HB       ALA  19  -0.675 -15.755   6.180
  148   2HB   ALA  19          2HB       ALA  19  -1.860 -16.826   6.927
  149   3HB   ALA  19          3HB       ALA  19  -0.320 -16.519   7.729
  150    H    ILE  20           H        ILE  20  -0.219 -13.145   6.803
  151    HA   ILE  20           HA       ILE  20   1.818 -13.007   8.753
  152    HB   ILE  20           HB       ILE  20   1.054 -11.203   6.472
  153   1HG1  ILE  20          2HG1      ILE  20   3.566 -12.807   6.864
  154   2HG1  ILE  20          1HG1      ILE  20   2.110 -13.506   6.164
  155   1HG2  ILE  20          1HG2      ILE  20   3.182 -10.797   8.538
  156   2HG2  ILE  20          2HG2      ILE  20   2.021  -9.636   7.892
  157   3HG2  ILE  20          3HG2      ILE  20   3.373 -10.178   6.897
  158   1HD1  ILE  20          1HD1      ILE  20   3.830 -12.692   4.534
  159   2HD1  ILE  20          2HD1      ILE  20   3.441 -11.054   5.060
  160   3HD1  ILE  20          3HD1      ILE  20   2.201 -12.056   4.305
  161    H    LEU  21           H        LEU  21  -0.471 -10.405   7.873
  162    HA   LEU  21           HA       LEU  21  -0.036  -8.700   9.954
  163   1HB   LEU  21          2HB       LEU  21  -2.756  -9.338   8.831
  164   2HB   LEU  21          1HB       LEU  21  -2.263  -7.843   9.606
  165    HG   LEU  21           HG       LEU  21  -0.569  -8.511   7.337
  166   1HD1  LEU  21          1HD1      LEU  21  -3.123  -9.291   6.895
  167   2HD1  LEU  21          2HD1      LEU  21  -2.019  -8.713   5.648
  168   3HD1  LEU  21          3HD1      LEU  21  -3.183  -7.607   6.375
  169   1HD2  LEU  21          1HD2      LEU  21  -2.119  -6.166   8.351
  170   2HD2  LEU  21          2HD2      LEU  21  -1.413  -6.144   6.735
  171   3HD2  LEU  21          3HD2      LEU  21  -0.377  -6.355   8.147
  172    H    GLU  22           H        GLU  22  -1.793 -11.717  10.035
  173    HA   GLU  22           HA       GLU  22  -3.053 -11.303  12.553
  174   1HB   GLU  22          2HB       GLU  22  -2.583 -13.669  10.794
  175   2HB   GLU  22          1HB       GLU  22  -3.151 -13.909  12.441
  176   1HG   GLU  22          2HG       GLU  22  -4.851 -11.983  11.560
  177   2HG   GLU  22          1HG       GLU  22  -4.564 -12.905  10.086
  178    H    GLU  23           H        GLU  23   0.050 -12.534  11.530
  179    HA   GLU  23           HA       GLU  23   0.716 -13.539  14.160
  180   1HB   GLU  23          2HB       GLU  23   1.637 -14.810  12.401
  181   2HB   GLU  23          1HB       GLU  23   2.163 -13.381  11.526
  182   1HG   GLU  23          2HG       GLU  23   4.121 -13.331  12.573
  183   2HG   GLU  23          1HG       GLU  23   3.385 -13.600  14.151
  184    H    GLU  24           H        GLU  24   1.402 -10.745  12.142
  185    HA   GLU  24           HA       GLU  24   3.364  -9.654  13.935
  186   1HB   GLU  24          2HB       GLU  24   1.891  -8.405  11.612
  187   2HB   GLU  24          1HB       GLU  24   3.222  -7.651  12.480
  188   1HG   GLU  24          2HG       GLU  24   3.442 -10.282  11.041
  189   2HG   GLU  24          1HG       GLU  24   3.841  -8.726  10.315
  190    H    GLY  25           H        GLY  25  -0.064  -9.137  13.280
  191   1HA   GLY  25          2HA       GLY  25  -1.571  -8.506  15.016
  192   2HA   GLY  25          1HA       GLY  25  -0.243  -7.685  15.816
  193    H    TYR  26           H        TYR  26  -0.870  -7.350  12.396
  194    HA   TYR  26           HA       TYR  26  -1.269  -4.494  12.774
  195   1HB   TYR  26          2HB       TYR  26  -0.770  -6.230  10.369
  196   2HB   TYR  26          1HB       TYR  26  -1.265  -4.553  10.196
  197    HD1  TYR  26           1HD      TYR  26   0.186  -2.899  11.774
  198    HD2  TYR  26           2HD      TYR  26   1.489  -6.643  10.233
  199    HE1  TYR  26           1HE      TYR  26   2.524  -2.174  12.008
  200    HE2  TYR  26           2HE      TYR  26   3.831  -5.930  10.464
  201    HH   TYR  26           HH       TYR  26   4.802  -3.368  12.294
  202    H    HIS  27           H        HIS  27  -2.842  -3.665  10.831
  203    HA   HIS  27           HA       HIS  27  -5.349  -5.167  10.936
  204   1HB   HIS  27          2HB       HIS  27  -4.855  -2.911  12.535
  205   2HB   HIS  27          1HB       HIS  27  -5.866  -2.338  11.215
  206    HD1  HIS  27           1HD      HIS  27  -8.312  -2.779  11.418
  207    HD2  HIS  27           2HD      HIS  27  -6.066  -5.152  13.985
  208    HE1  HIS  27           1HE      HIS  27  -9.986  -3.989  12.852
  209    HE2  HIS  27           2HE      HIS  27  -8.606  -5.496  14.327
  210    HA   PRO  28           HA       PRO  28  -4.646  -3.633   6.702
  211   1HB   PRO  28          2HB       PRO  28  -5.713  -5.737   5.421
  212   2HB   PRO  28          1HB       PRO  28  -4.085  -5.788   6.112
  213   1HG   PRO  28          2HG       PRO  28  -6.644  -6.886   7.211
  214   2HG   PRO  28          1HG       PRO  28  -5.032  -7.623   7.182
  215   1HD   PRO  28          2HD       PRO  28  -6.095  -6.367   9.372
  216   2HD   PRO  28          1HD       PRO  28  -4.353  -6.496   9.059
  217    H    ASP  29           H        ASP  29  -5.978  -2.346   5.605
  218    HA   ASP  29           HA       ASP  29  -8.837  -2.575   6.131
  219   1HB   ASP  29          2HB       ASP  29  -7.413  -0.398   6.537
  220   2HB   ASP  29          1HB       ASP  29  -7.739  -0.156   4.824
  221    H    THR  30           H        THR  30  -6.613  -3.147   3.836
  222    HA   THR  30           HA       THR  30  -6.601  -3.535   1.600
  223    HB   THR  30           HB       THR  30  -8.445  -5.014   0.856
  224    HG1  THR  30           1HG      THR  30 -10.108  -4.012   2.095
  225   1HG2  THR  30          1HG2      THR  30  -8.149  -6.785   2.557
  226   2HG2  THR  30          2HG2      THR  30  -7.292  -5.620   3.566
  227   3HG2  THR  30          3HG2      THR  30  -6.634  -6.078   1.995
  228    H    ALA  31           H        ALA  31  -7.978  -3.484  -0.483
  229    HA   ALA  31           HA       ALA  31  -9.964  -1.414  -0.646
  230   1HB   ALA  31          1HB       ALA  31  -7.397  -0.515  -0.707
  231   2HB   ALA  31          2HB       ALA  31  -8.762   0.294  -1.475
  232   3HB   ALA  31          3HB       ALA  31  -7.721  -0.769  -2.422
  233    H    LYS  32           H        LYS  32  -9.793  -0.866  -3.358
  234    HA   LYS  32           HA       LYS  32  -9.914  -3.521  -4.623
  235   1HB   LYS  32          2HB       LYS  32 -11.858  -1.380  -5.406
  236   2HB   LYS  32          1HB       LYS  32 -11.989  -3.122  -5.598
  237   1HG   LYS  32          2HG       LYS  32 -12.446  -3.409  -3.267
  238   2HG   LYS  32          1HG       LYS  32 -12.112  -1.706  -2.947
  239   1HD   LYS  32          2HD       LYS  32 -14.495  -2.032  -3.001
  240   2HD   LYS  32          1HD       LYS  32 -14.015  -1.111  -4.428
  241   1HE   LYS  32          2HE       LYS  32 -13.990  -3.274  -5.696
  242   2HE   LYS  32          1HE       LYS  32 -14.703  -4.041  -4.278
  243   1HZ   LYS  32          1HZ       LYS  32 -16.136  -3.012  -6.260
  244   2HZ   LYS  32          2HZ       LYS  32 -16.049  -1.657  -5.250
  245   3HZ   LYS  32          3HZ       LYS  32 -16.698  -3.106  -4.668
  246    H    THR  33           H        THR  33  -9.516  -0.051  -5.020
  247    HA   THR  33           HA       THR  33  -7.584  -0.424  -7.093
  248    HB   THR  33           HB       THR  33  -8.935   1.139  -8.674
  249    HG1  THR  33           1HG      THR  33 -10.924   1.471  -8.154
  250   1HG2  THR  33          1HG2      THR  33  -8.466  -1.455  -8.849
  251   2HG2  THR  33          2HG2      THR  33  -9.538  -0.617  -9.971
  252   3HG2  THR  33          3HG2      THR  33 -10.214  -1.530  -8.622
  253    H    LEU  34           H        LEU  34  -7.092   1.919  -8.061
  254    HA   LEU  34           HA       LEU  34  -6.222   3.468  -5.882
  255   1HB   LEU  34          2HB       LEU  34  -6.473   4.141  -8.813
  256   2HB   LEU  34          1HB       LEU  34  -5.707   5.195  -7.638
  257    HG   LEU  34           HG       LEU  34  -4.794   2.408  -8.356
  258   1HD1  LEU  34          1HD1      LEU  34  -3.256   3.301  -9.755
  259   2HD1  LEU  34          2HD1      LEU  34  -3.115   4.795  -8.828
  260   3HD1  LEU  34          3HD1      LEU  34  -4.487   4.555  -9.909
  261   1HD2  LEU  34          1HD2      LEU  34  -4.220   4.123  -6.095
  262   2HD2  LEU  34          2HD2      LEU  34  -2.765   3.746  -7.016
  263   3HD2  LEU  34          3HD2      LEU  34  -3.768   2.443  -6.381
  264    H    ARG  35           H        ARG  35  -8.989   3.806  -8.057
  265    HA   ARG  35           HA       ARG  35  -9.886   6.300  -7.105
  266   1HB   ARG  35          2HB       ARG  35 -10.745   4.405  -8.993
  267   2HB   ARG  35          1HB       ARG  35 -12.076   4.560  -7.856
  268   1HG   ARG  35          2HG       ARG  35 -11.379   7.170  -8.300
  269   2HG   ARG  35          1HG       ARG  35 -11.105   6.424  -9.875
  270   1HD   ARG  35          2HD       ARG  35 -13.298   6.114 -10.241
  271   2HD   ARG  35          1HD       ARG  35 -13.599   5.603  -8.581
  272    HE   ARG  35           HE       ARG  35 -13.114   8.419  -8.829
  273   1HH1  ARG  35          1HH1      ARG  35 -15.542   5.921  -9.051
  274   2HH1  ARG  35          2HH1      ARG  35 -16.859   6.999  -8.730
  275   1HH2  ARG  35          1HH2      ARG  35 -14.844   9.837  -8.405
  276   2HH2  ARG  35          2HH2      ARG  35 -16.462   9.223  -8.364
  277    H    GLU  36           H        GLU  36 -10.917   2.997  -6.275
  278    HA   GLU  36           HA       GLU  36 -12.631   3.750  -4.165
  279   1HB   GLU  36          2HB       GLU  36 -12.211   1.435  -5.461
  280   2HB   GLU  36          1HB       GLU  36 -11.247   1.122  -4.024
  281   1HG   GLU  36          2HG       GLU  36 -13.215   0.311  -3.283
  282   2HG   GLU  36          1HG       GLU  36 -13.455   1.998  -2.834
  283    H    ALA  37           H        ALA  37  -9.191   3.226  -4.382
  284    HA   ALA  37           HA       ALA  37  -8.747   3.064  -1.556
  285   1HB   ALA  37          1HB       ALA  37  -6.321   3.609  -2.374
  286   2HB   ALA  37          2HB       ALA  37  -7.003   3.288  -3.969
  287   3HB   ALA  37          3HB       ALA  37  -7.046   2.039  -2.724
  288    H    GLU  38           H        GLU  38  -9.194   5.622  -3.824
  289    HA   GLU  38           HA       GLU  38  -7.858   7.641  -2.285
  290   1HB   GLU  38          2HB       GLU  38  -9.770   7.734  -4.607
  291   2HB   GLU  38          1HB       GLU  38  -9.199   9.193  -3.809
  292   1HG   GLU  38          2HG       GLU  38  -7.076   8.975  -4.614
  293   2HG   GLU  38          1HG       GLU  38  -7.188   7.220  -4.749
  294    H    LYS  39           H        LYS  39 -11.168   6.510  -2.710
  295    HA   LYS  39           HA       LYS  39 -12.385   8.460  -1.052
  296   1HB   LYS  39          2HB       LYS  39 -13.714   7.181  -2.626
  297   2HB   LYS  39          1HB       LYS  39 -13.277   5.677  -1.827
  298   1HG   LYS  39          2HG       LYS  39 -14.676   7.808  -0.280
  299   2HG   LYS  39          1HG       LYS  39 -15.592   6.779  -1.383
  300   1HD   LYS  39          2HD       LYS  39 -14.287   4.859  -0.138
  301   2HD   LYS  39          1HD       LYS  39 -14.163   6.075   1.134
  302   1HE   LYS  39          2HE       LYS  39 -16.367   5.982   1.617
  303   2HE   LYS  39          1HE       LYS  39 -16.832   5.750  -0.067
  304   1HZ   LYS  39          1HZ       LYS  39 -15.518   3.593   1.464
  305   2HZ   LYS  39          2HZ       LYS  39 -16.464   3.474   0.067
  306   3HZ   LYS  39          3HZ       LYS  39 -17.190   3.830   1.552
  307    H    LYS  40           H        LYS  40 -10.967   5.294  -0.463
  308    HA   LYS  40           HA       LYS  40 -11.792   5.120   2.263
  309   1HB   LYS  40          2HB       LYS  40  -9.612   3.672   0.755
  310   2HB   LYS  40          1HB       LYS  40 -10.128   3.274   2.388
  311   1HG   LYS  40          2HG       LYS  40 -12.000   3.262   0.039
  312   2HG   LYS  40          1HG       LYS  40 -11.077   1.846   0.546
  313   1HD   LYS  40          2HD       LYS  40 -12.600   3.240   2.658
  314   2HD   LYS  40          1HD       LYS  40 -13.553   2.398   1.435
  315   1HE   LYS  40          2HE       LYS  40 -11.269   1.098   2.896
  316   2HE   LYS  40          1HE       LYS  40 -12.924   1.068   3.503
  317   1HZ   LYS  40          1HZ       LYS  40 -13.591  -0.347   1.880
  318   2HZ   LYS  40          2HZ       LYS  40 -11.970  -0.822   1.956
  319   3HZ   LYS  40          3HZ       LYS  40 -12.485   0.231   0.738
  320    H    ILE  41           H        ILE  41  -9.057   6.505   0.595
  321    HA   ILE  41           HA       ILE  41  -7.591   6.935   3.073
  322    HB   ILE  41           HB       ILE  41  -6.927   7.756   0.243
  323   1HG1  ILE  41          2HG1      ILE  41  -5.467   5.683   1.846
  324   2HG1  ILE  41          1HG1      ILE  41  -6.949   5.249   1.000
  325   1HG2  ILE  41          1HG2      ILE  41  -5.305   7.946   2.775
  326   2HG2  ILE  41          2HG2      ILE  41  -5.880   9.281   1.776
  327   3HG2  ILE  41          3HG2      ILE  41  -4.655   8.175   1.152
  328   1HD1  ILE  41          1HD1      ILE  41  -5.741   4.916  -0.819
  329   2HD1  ILE  41          2HD1      ILE  41  -4.293   5.522  -0.015
  330   3HD1  ILE  41          3HD1      ILE  41  -5.370   6.640  -0.852
  331    H    LYS  42           H        LYS  42  -9.776   8.613   0.988
  332    HA   LYS  42           HA       LYS  42  -9.048  11.249   1.894
  333   1HB   LYS  42          2HB       LYS  42 -11.086  10.115   0.057
  334   2HB   LYS  42          1HB       LYS  42 -11.382  11.710   0.738
  335   1HG   LYS  42          2HG       LYS  42  -8.704  11.271  -0.410
  336   2HG   LYS  42          1HG       LYS  42 -10.050  11.289  -1.551
  337   1HD   LYS  42          2HD       LYS  42 -10.166  13.432   0.433
  338   2HD   LYS  42          1HD       LYS  42  -8.735  13.499  -0.598
  339   1HE   LYS  42          2HE       LYS  42 -10.536  14.792  -1.579
  340   2HE   LYS  42          1HE       LYS  42 -10.176  13.388  -2.582
  341   1HZ   LYS  42          1HZ       LYS  42 -12.361  13.417  -0.580
  342   2HZ   LYS  42          2HZ       LYS  42 -12.098  12.286  -1.811
  343   3HZ   LYS  42          3HZ       LYS  42 -12.591  13.856  -2.197
  344    H    GLU  43           H        GLU  43 -10.562   8.781   3.429
  345    HA   GLU  43           HA       GLU  43 -12.292  10.602   4.954
  346   1HB   GLU  43          2HB       GLU  43 -12.596   7.635   4.490
  347   2HB   GLU  43          1HB       GLU  43 -13.593   8.576   5.590
  348   1HG   GLU  43          2HG       GLU  43 -14.365   9.940   3.702
  349   2HG   GLU  43          1HG       GLU  43 -13.396   8.952   2.610
  350    H    LEU  44           H        LEU  44 -10.069   7.869   5.127
  351    HA   LEU  44           HA       LEU  44  -9.642   8.477   7.976
  352   1HB   LEU  44          2HB       LEU  44 -10.437   6.315   8.033
  353   2HB   LEU  44          1HB       LEU  44  -9.772   5.913   6.464
  354    HG   LEU  44           HG       LEU  44  -7.895   6.374   8.738
  355   1HD1  LEU  44          1HD1      LEU  44  -8.178   3.725   8.887
  356   2HD1  LEU  44          2HD1      LEU  44  -9.841   4.166   8.495
  357   3HD1  LEU  44          3HD1      LEU  44  -9.061   4.845   9.925
  358   1HD2  LEU  44          1HD2      LEU  44  -6.902   4.336   7.387
  359   2HD2  LEU  44          2HD2      LEU  44  -6.689   5.999   6.840
  360   3HD2  LEU  44          3HD2      LEU  44  -7.936   4.986   6.117
  361    H    PHE  45           H        PHE  45  -7.445   8.255   8.759
  362    HA   PHE  45           HA       PHE  45  -5.511   9.054   6.714
  363   1HB   PHE  45          2HB       PHE  45  -5.933  10.372   8.880
  364   2HB   PHE  45          1HB       PHE  45  -5.037   9.090   9.687
  365    HD1  PHE  45           1HD      PHE  45  -4.807  12.170   7.961
  366    HD2  PHE  45           2HD      PHE  45  -2.684   8.570   8.761
  367    HE1  PHE  45           1HE      PHE  45  -2.695  13.292   7.382
  368    HE2  PHE  45           2HE      PHE  45  -0.568   9.684   8.185
  369    HZ   PHE  45           HZ       PHE  45  -0.571  12.049   7.494
  370    H    PHE  46           H        PHE  46  -4.837   7.158   5.782
  371    HA   PHE  46           HA       PHE  46  -4.064   4.885   7.354
  372   1HB   PHE  46          2HB       PHE  46  -4.004   5.572   4.438
  373   2HB   PHE  46          1HB       PHE  46  -3.115   4.171   5.026
  374    HD1  PHE  46           1HD      PHE  46  -6.078   5.145   3.586
  375    HD2  PHE  46           2HD      PHE  46  -4.611   2.704   6.744
  376    HE1  PHE  46           1HE      PHE  46  -8.140   3.803   3.498
  377    HE2  PHE  46           2HE      PHE  46  -6.670   1.358   6.667
  378    HZ   PHE  46           HZ       PHE  46  -8.441   1.915   5.046
  379    HA   PRO  47           HA       PRO  47   0.086   6.436   8.048
  380   1HB   PRO  47          2HB       PRO  47   1.031   4.320   9.424
  381   2HB   PRO  47          1HB       PRO  47  -0.109   5.467  10.139
  382   1HG   PRO  47          2HG       PRO  47  -0.631   2.766   8.958
  383   2HG   PRO  47          1HG       PRO  47  -1.278   3.480  10.447
  384   1HD   PRO  47          2HD       PRO  47  -2.668   3.399   8.105
  385   2HD   PRO  47          1HD       PRO  47  -2.889   4.671   9.322
  386    H    VAL  48           H        VAL  48  -0.684   3.314   6.664
  387    HA   VAL  48           HA       VAL  48   1.652   3.515   4.923
  388    HB   VAL  48           HB       VAL  48   0.943   0.895   6.212
  389   1HG1  VAL  48          1HG1      VAL  48   3.092   1.923   4.446
  390   2HG1  VAL  48          2HG1      VAL  48   2.283   0.357   4.455
  391   3HG1  VAL  48          3HG1      VAL  48   3.531   0.710   5.648
  392   1HG2  VAL  48          1HG2      VAL  48   1.517   2.053   8.106
  393   2HG2  VAL  48          2HG2      VAL  48   2.627   3.120   7.248
  394   3HG2  VAL  48          3HG2      VAL  48   3.089   1.451   7.579
  395    H    ILE  49           H        ILE  49   1.143   3.088   2.880
  396    HA   ILE  49           HA       ILE  49  -1.378   1.690   2.304
  397    HB   ILE  49           HB       ILE  49   0.086   3.606   0.485
  398   1HG1  ILE  49          2HG1      ILE  49  -0.750   4.732   2.534
  399   2HG1  ILE  49          1HG1      ILE  49  -1.573   5.277   1.076
  400   1HG2  ILE  49          1HG2      ILE  49  -2.700   2.462   0.346
  401   2HG2  ILE  49          2HG2      ILE  49  -1.330   1.972  -0.651
  402   3HG2  ILE  49          3HG2      ILE  49  -1.988   3.602  -0.796
  403   1HD1  ILE  49          1HD1      ILE  49  -2.609   3.480   3.238
  404   2HD1  ILE  49          2HD1      ILE  49  -3.389   3.607   1.661
  405   3HD1  ILE  49          3HD1      ILE  49  -3.246   5.031   2.693
  406    H    VAL  50           H        VAL  50  -1.390   0.184   0.547
  407    HA   VAL  50           HA       VAL  50   1.214  -0.568  -0.534
  408    HB   VAL  50           HB       VAL  50  -0.560  -2.568   0.865
  409   1HG1  VAL  50          1HG1      VAL  50   2.181  -3.325   0.197
  410   2HG1  VAL  50          2HG1      VAL  50   1.173  -3.014  -1.216
  411   3HG1  VAL  50          3HG1      VAL  50   0.674  -4.214  -0.024
  412   1HG2  VAL  50          1HG2      VAL  50   1.220  -2.719   2.511
  413   2HG2  VAL  50          2HG2      VAL  50   0.600  -1.071   2.419
  414   3HG2  VAL  50          3HG2      VAL  50   2.136  -1.479   1.654
  415    H    LEU  51           H        LEU  51   0.729  -0.193  -2.592
  416    HA   LEU  51           HA       LEU  51  -1.774  -0.934  -3.775
  417   1HB   LEU  51          2HB       LEU  51  -0.151   0.968  -4.455
  418   2HB   LEU  51          1HB       LEU  51   0.723  -0.286  -5.313
  419    HG   LEU  51           HG       LEU  51  -1.048  -0.643  -6.831
  420   1HD1  LEU  51          1HD1      LEU  51  -2.933  -0.739  -5.380
  421   2HD1  LEU  51          2HD1      LEU  51  -3.248   0.522  -6.572
  422   3HD1  LEU  51          3HD1      LEU  51  -2.754   0.958  -4.937
  423   1HD2  LEU  51          1HD2      LEU  51   0.170   1.798  -6.617
  424   2HD2  LEU  51          2HD2      LEU  51  -1.536   2.231  -6.713
  425   3HD2  LEU  51          3HD2      LEU  51  -0.802   1.255  -7.984
  426    H    ASP  52           H        ASP  52  -1.586  -2.241  -5.959
  427    HA   ASP  52           HA       ASP  52   0.239  -4.497  -5.701
  428   1HB   ASP  52          2HB       ASP  52  -2.103  -4.816  -4.494
  429   2HB   ASP  52          1HB       ASP  52  -2.627  -5.193  -6.131
  430    H    VAL  53           H        VAL  53  -2.568  -3.291  -7.553
  431    HA   VAL  53           HA       VAL  53  -2.944  -3.141  -9.799
  432    HB   VAL  53           HB       VAL  53   0.069  -3.354 -10.016
  433   1HG1  VAL  53          1HG1      VAL  53  -0.519  -3.618 -12.192
  434   2HG1  VAL  53          2HG1      VAL  53  -0.620  -1.859 -12.111
  435   3HG1  VAL  53          3HG1      VAL  53  -2.084  -2.834 -11.980
  436   1HG2  VAL  53          1HG2      VAL  53   0.256  -1.109  -9.656
  437   2HG2  VAL  53          2HG2      VAL  53  -1.135  -1.452  -8.626
  438   3HG2  VAL  53          3HG2      VAL  53  -1.374  -0.767 -10.234
  439    H    TRP  54           H        TRP  54  -3.441  -5.578  -8.800
  440    HA   TRP  54           HA       TRP  54  -2.019  -7.689 -10.076
  441   1HB   TRP  54          2HB       TRP  54  -3.210  -8.142  -8.029
  442   2HB   TRP  54          1HB       TRP  54  -4.729  -7.602  -8.733
  443    HD1  TRP  54           HD       TRP  54  -6.239  -9.614  -9.151
  444    HE1  TRP  54           1HE      TRP  54  -5.924 -12.029  -9.982
  445    HE3  TRP  54           3HE      TRP  54  -1.162  -9.610  -9.746
  446    HZ2  TRP  54           2HZ      TRP  54  -3.804 -13.711 -10.784
  447    HZ3  TRP  54           3HZ      TRP  54  -0.067 -11.663 -10.549
  448    HH2  TRP  54           HH       TRP  54  -1.362 -13.670 -11.056
  449    H    MET  55           H        MET  55  -5.502  -7.221 -10.477
  450    HA   MET  55           HA       MET  55  -5.385  -8.146 -13.183
  451   1HB   MET  55          2HB       MET  55  -7.319  -8.114 -11.234
  452   2HB   MET  55          1HB       MET  55  -7.879  -6.861 -12.333
  453   1HG   MET  55          2HG       MET  55  -8.855  -9.010 -12.882
  454   2HG   MET  55          1HG       MET  55  -7.816  -8.436 -14.184
  455   1HE   MET  55          1HE       MET  55  -7.766 -12.440 -12.353
  456   2HE   MET  55          2HE       MET  55  -8.798 -11.714 -13.585
  457   3HE   MET  55          3HE       MET  55  -8.833 -11.100 -11.932
  458    HA   PRO  56           HA       PRO  56  -6.554  -3.595 -14.196
  459   1HB   PRO  56          2HB       PRO  56  -6.357  -1.709 -12.300
  460   2HB   PRO  56          1HB       PRO  56  -7.789  -2.739 -12.433
  461   1HG   PRO  56          2HG       PRO  56  -5.448  -2.983 -10.578
  462   2HG   PRO  56          1HG       PRO  56  -7.178  -3.136 -10.217
  463   1HD   PRO  56          2HD       PRO  56  -5.535  -5.273 -10.602
  464   2HD   PRO  56          1HD       PRO  56  -7.269  -5.304 -10.975
  465    H    ASP  57           H        ASP  57  -5.331  -1.306 -14.090
  466    HA   ASP  57           HA       ASP  57  -2.531  -1.492 -13.453
  467   1HB   ASP  57          2HB       ASP  57  -3.434  -1.437 -16.335
  468   2HB   ASP  57          1HB       ASP  57  -1.796  -1.065 -15.810
  469    H    GLY  58           H        GLY  58  -4.363   0.243 -12.457
  470   1HA   GLY  58          2HA       GLY  58  -4.814   2.627 -13.817
  471   2HA   GLY  58          1HA       GLY  58  -4.687   2.481 -12.071
  472    H    ASP  59           H        ASP  59  -3.854   4.771 -13.287
  473    HA   ASP  59           HA       ASP  59  -1.005   4.656 -13.758
  474   1HB   ASP  59          2HB       ASP  59  -2.718   7.124 -13.431
  475   2HB   ASP  59          1HB       ASP  59  -1.150   7.005 -14.222
  476    H    GLY  60           H        GLY  60  -0.586   3.692 -11.605
  477   1HA   GLY  60          2HA       GLY  60  -1.037   4.977  -9.177
  478   2HA   GLY  60          1HA       GLY  60   0.299   3.882  -9.496
  479    H    VAL  61           H        VAL  61   1.188   5.793 -11.694
  480    HA   VAL  61           HA       VAL  61   3.200   7.107 -10.336
  481    HB   VAL  61           HB       VAL  61   1.970   8.002 -12.943
  482   1HG1  VAL  61          1HG1      VAL  61   4.583   8.492 -11.581
  483   2HG1  VAL  61          2HG1      VAL  61   3.472   9.647 -12.319
  484   3HG1  VAL  61          3HG1      VAL  61   4.445   8.586 -13.337
  485   1HG2  VAL  61          1HG2      VAL  61   3.896   5.783 -12.319
  486   2HG2  VAL  61          2HG2      VAL  61   3.831   6.543 -13.910
  487   3HG2  VAL  61          3HG2      VAL  61   2.410   5.722 -13.268
  488    H    ASN  62           H        ASN  62   0.019   8.308 -11.307
  489    HA   ASN  62           HA       ASN  62   0.549  10.913 -10.143
  490   1HB   ASN  62          2HB       ASN  62  -1.244   9.875 -12.115
  491   2HB   ASN  62          1HB       ASN  62  -2.190  10.660 -10.854
  492   1HD2  ASN  62          1HD2      ASN  62   0.126  11.083 -13.385
  493   2HD2  ASN  62          2HD2      ASN  62   0.091  12.810 -13.415
  494    H    PHE  63           H        PHE  63  -0.124   8.066  -8.771
  495    HA   PHE  63           HA       PHE  63  -2.232   8.969  -6.983
  496   1HB   PHE  63          2HB       PHE  63  -2.113   6.607  -7.882
  497   2HB   PHE  63          1HB       PHE  63  -0.706   6.366  -6.852
  498    HD1  PHE  63           1HD      PHE  63  -3.837   8.220  -6.107
  499    HD2  PHE  63           2HD      PHE  63  -1.427   4.812  -5.276
  500    HE1  PHE  63           1HE      PHE  63  -5.317   7.635  -4.235
  501    HE2  PHE  63           2HE      PHE  63  -2.906   4.221  -3.402
  502    HZ   PHE  63           HZ       PHE  63  -4.853   5.636  -2.878
  503    H    ILE  64           H        ILE  64   1.218   8.280  -6.924
  504    HA   ILE  64           HA       ILE  64   1.826   8.234  -4.270
  505    HB   ILE  64           HB       ILE  64   3.384   9.792  -6.337
  506   1HG1  ILE  64          2HG1      ILE  64   4.604   7.325  -5.969
  507   2HG1  ILE  64          1HG1      ILE  64   2.887   6.936  -6.001
  508   1HG2  ILE  64          1HG2      ILE  64   5.229   8.729  -4.689
  509   2HG2  ILE  64          2HG2      ILE  64   3.907   8.988  -3.551
  510   3HG2  ILE  64          3HG2      ILE  64   4.545  10.341  -4.483
  511   1HD1  ILE  64          1HD1      ILE  64   4.239   8.591  -8.110
  512   2HD1  ILE  64          2HD1      ILE  64   2.633   7.871  -8.159
  513   3HD1  ILE  64          3HD1      ILE  64   4.059   6.841  -8.206
  514    H    ASP  65           H        ASP  65   1.226  11.123  -6.232
  515    HA   ASP  65           HA       ASP  65   1.773  13.005  -4.208
  516   1HB   ASP  65          2HB       ASP  65   1.178  13.176  -6.864
  517   2HB   ASP  65          1HB       ASP  65  -0.330  13.737  -6.147
  518    H    PHE  66           H        PHE  66  -1.270  11.509  -5.264
  519    HA   PHE  66           HA       PHE  66  -3.003  12.821  -3.532
  520   1HB   PHE  66          2HB       PHE  66  -3.861  11.426  -5.309
  521   2HB   PHE  66          1HB       PHE  66  -3.094   9.999  -4.623
  522    HD1  PHE  66           1HD      PHE  66  -3.997   8.954  -2.604
  523    HD2  PHE  66           2HD      PHE  66  -5.936  12.254  -4.463
  524    HE1  PHE  66           1HE      PHE  66  -6.046   8.457  -1.341
  525    HE2  PHE  66           2HE      PHE  66  -7.990  11.763  -3.202
  526    HZ   PHE  66           HZ       PHE  66  -8.048   9.861  -1.639
  527    H    ILE  67           H        ILE  67  -0.766  10.199  -2.976
  528    HA   ILE  67           HA       ILE  67  -1.768   9.354  -0.465
  529    HB   ILE  67           HB       ILE  67   1.146   9.218  -1.184
  530   1HG1  ILE  67          2HG1      ILE  67   0.203   8.467  -3.210
  531   2HG1  ILE  67          1HG1      ILE  67   0.543   7.000  -2.305
  532   1HG2  ILE  67          1HG2      ILE  67   1.001   8.208   0.824
  533   2HG2  ILE  67          2HG2      ILE  67   0.506   6.826  -0.155
  534   3HG2  ILE  67          3HG2      ILE  67  -0.711   7.830   0.634
  535   1HD1  ILE  67          1HD1      ILE  67  -1.557   6.374  -2.556
  536   2HD1  ILE  67          2HD1      ILE  67  -1.906   7.863  -3.433
  537   3HD1  ILE  67          3HD1      ILE  67  -2.099   7.806  -1.681
  538    H    LYS  68           H        LYS  68   0.946  11.500  -1.335
  539    HA   LYS  68           HA       LYS  68   1.397  12.322   1.366
  540   1HB   LYS  68          2HB       LYS  68   2.290  13.595  -1.230
  541   2HB   LYS  68          1HB       LYS  68   2.898  14.008   0.367
  542   1HG   LYS  68          2HG       LYS  68   3.209  11.235   0.129
  543   2HG   LYS  68          1HG       LYS  68   3.724  11.918  -1.414
  544   1HD   LYS  68          2HD       LYS  68   4.667  13.093   1.177
  545   2HD   LYS  68          1HD       LYS  68   5.460  11.674   0.488
  546   1HE   LYS  68          2HE       LYS  68   4.985  14.036  -1.262
  547   2HE   LYS  68          1HE       LYS  68   6.283  14.118  -0.070
  548   1HZ   LYS  68          1HZ       LYS  68   7.515  12.606  -1.174
  549   2HZ   LYS  68          2HZ       LYS  68   6.611  13.132  -2.505
  550   3HZ   LYS  68          3HZ       LYS  68   6.178  11.709  -1.699
  551    H    GLU  69           H        GLU  69  -0.796  13.237  -1.096
  552    HA   GLU  69           HA       GLU  69  -1.274  15.923  -0.352
  553   1HB   GLU  69          2HB       GLU  69  -1.948  14.874  -2.521
  554   2HB   GLU  69          1HB       GLU  69  -3.198  14.000  -1.653
  555   1HG   GLU  69          2HG       GLU  69  -4.447  15.903  -1.259
  556   2HG   GLU  69          1HG       GLU  69  -3.066  16.976  -1.485
  557    H    ASN  70           H        ASN  70  -2.958  12.900   0.419
  558    HA   ASN  70           HA       ASN  70  -4.256  14.278   2.674
  559   1HB   ASN  70          2HB       ASN  70  -5.692  11.956   2.339
  560   2HB   ASN  70          1HB       ASN  70  -6.147  13.531   1.700
  561   1HD2  ASN  70          1HD2      ASN  70  -4.939  14.023  -0.448
  562   2HD2  ASN  70          2HD2      ASN  70  -4.984  12.754  -1.618
  563    H    SER  71           H        SER  71  -1.587  12.811   2.429
  564    HA   SER  71           HA       SER  71  -1.689  11.570   4.989
  565   1HB   SER  71          2HB       SER  71  -2.065   9.889   2.648
  566   2HB   SER  71          1HB       SER  71  -0.636   9.411   3.563
  567    HG   SER  71           HG       SER  71  -1.880   9.043   5.329
  568    HA   PRO  72           HA       PRO  72   2.423  13.167   3.489
  569   1HB   PRO  72          2HB       PRO  72   2.349  14.998   5.738
  570   2HB   PRO  72          1HB       PRO  72   2.444  15.368   4.016
  571   1HG   PRO  72          2HG       PRO  72   0.252  15.899   5.547
  572   2HG   PRO  72          1HG       PRO  72   0.177  15.584   3.806
  573   1HD   PRO  72          2HD       PRO  72  -0.423  13.751   6.094
  574   2HD   PRO  72          1HD       PRO  72  -1.267  13.932   4.541
  575    H    ASP  73           H        ASP  73   1.110  11.995   6.401
  576    HA   ASP  73           HA       ASP  73   3.794  11.378   7.440
  577   1HB   ASP  73          2HB       ASP  73   2.239  12.785   8.870
  578   2HB   ASP  73          1HB       ASP  73   1.243  11.342   9.040
  579    H    SER  74           H        SER  74   2.378   9.888   5.383
  580    HA   SER  74           HA       SER  74   1.902   7.351   6.801
  581   1HB   SER  74          2HB       SER  74  -0.050   8.172   5.542
  582   2HB   SER  74          1HB       SER  74   0.916   8.210   4.069
  583    HG   SER  74           HG       SER  74   0.235   6.233   3.855
  584    H    VAL  75           H        VAL  75   2.080   5.736   4.438
  585    HA   VAL  75           HA       VAL  75   4.768   6.172   3.416
  586    HB   VAL  75           HB       VAL  75   4.095   3.604   4.853
  587   1HG1  VAL  75          1HG1      VAL  75   6.110   4.371   2.888
  588   2HG1  VAL  75          2HG1      VAL  75   5.632   2.770   3.450
  589   3HG1  VAL  75          3HG1      VAL  75   6.815   3.707   4.362
  590   1HG2  VAL  75          1HG2      VAL  75   4.524   5.109   6.571
  591   2HG2  VAL  75          2HG2      VAL  75   5.710   6.008   5.626
  592   3HG2  VAL  75          3HG2      VAL  75   6.114   4.412   6.259
  593    H    VAL  76           H        VAL  76   5.069   5.449   1.444
  594    HA   VAL  76           HA       VAL  76   2.872   3.946   0.192
  595    HB   VAL  76           HB       VAL  76   5.015   5.551  -1.201
  596   1HG1  VAL  76          1HG1      VAL  76   3.835   3.719  -2.468
  597   2HG1  VAL  76          2HG1      VAL  76   3.701   5.337  -3.160
  598   3HG1  VAL  76          3HG1      VAL  76   2.350   4.646  -2.261
  599   1HG2  VAL  76          1HG2      VAL  76   3.088   6.622   0.394
  600   2HG2  VAL  76          2HG2      VAL  76   2.274   6.593  -1.168
  601   3HG2  VAL  76          3HG2      VAL  76   3.811   7.437  -0.992
  602    H    ILE  77           H        ILE  77   3.214   1.853  -0.065
  603    HA   ILE  77           HA       ILE  77   5.928   0.937  -0.764
  604    HB   ILE  77           HB       ILE  77   3.882  -0.743   0.675
  605   1HG1  ILE  77          2HG1      ILE  77   4.508   1.232   2.048
  606   2HG1  ILE  77          1HG1      ILE  77   5.057  -0.286   2.749
  607   1HG2  ILE  77          1HG2      ILE  77   5.415  -2.184  -0.282
  608   2HG2  ILE  77          2HG2      ILE  77   6.105  -1.920   1.319
  609   3HG2  ILE  77          3HG2      ILE  77   6.757  -1.060  -0.076
  610   1HD1  ILE  77          1HD1      ILE  77   7.192   0.514   1.205
  611   2HD1  ILE  77          2HD1      ILE  77   7.035   0.695   2.952
  612   3HD1  ILE  77          3HD1      ILE  77   6.576   2.020   1.884
  613    H    VAL  78           H        VAL  78   4.210   1.752  -2.752
  614    HA   VAL  78           HA       VAL  78   2.447   0.005  -3.914
  615    HB   VAL  78           HB       VAL  78   4.566   1.606  -5.370
  616   1HG1  VAL  78          1HG1      VAL  78   1.866   0.819  -6.431
  617   2HG1  VAL  78          2HG1      VAL  78   3.292  -0.191  -6.665
  618   3HG1  VAL  78          3HG1      VAL  78   3.256   1.448  -7.313
  619   1HG2  VAL  78          1HG2      VAL  78   2.119   2.358  -3.944
  620   2HG2  VAL  78          2HG2      VAL  78   2.245   3.014  -5.577
  621   3HG2  VAL  78          3HG2      VAL  78   3.517   3.332  -4.398
  622    H    ILE  79           H        ILE  79   2.889  -2.160  -3.696
  623    HA   ILE  79           HA       ILE  79   5.412  -3.293  -4.399
  624    HB   ILE  79           HB       ILE  79   2.803  -4.743  -3.989
  625   1HG1  ILE  79          2HG1      ILE  79   4.929  -3.918  -2.001
  626   2HG1  ILE  79          1HG1      ILE  79   3.256  -3.377  -2.041
  627   1HG2  ILE  79          1HG2      ILE  79   5.112  -6.173  -3.120
  628   2HG2  ILE  79          2HG2      ILE  79   5.377  -5.620  -4.773
  629   3HG2  ILE  79          3HG2      ILE  79   3.961  -6.596  -4.387
  630   1HD1  ILE  79          1HD1      ILE  79   3.142  -4.943  -0.395
  631   2HD1  ILE  79          2HD1      ILE  79   4.396  -5.952  -1.113
  632   3HD1  ILE  79          3HD1      ILE  79   2.770  -5.949  -1.795
  633    H    THR  80           H        THR  80   2.877  -5.156  -5.689
  634    HA   THR  80           HA       THR  80   2.246  -5.735  -7.794
  635    HB   THR  80           HB       THR  80   2.044  -4.125  -9.431
  636    HG1  THR  80           1HG      THR  80   3.614  -2.791 -10.031
  637   1HG2  THR  80          1HG2      THR  80   1.634  -3.142  -6.912
  638   2HG2  THR  80          2HG2      THR  80   1.158  -2.360  -8.418
  639   3HG2  THR  80          3HG2      THR  80   2.679  -1.924  -7.641
  640    H    GLY  81           H        GLY  81   3.307  -7.485  -8.443
  641   1HA   GLY  81          2HA       GLY  81   6.178  -7.475  -8.767
  642   2HA   GLY  81          1HA       GLY  81   5.107  -8.850  -8.981
  643    H    HIS  82           H        HIS  82   4.613  -9.487 -10.994
  644    HA   HIS  82           HA       HIS  82   6.028  -8.535 -13.201
  645   1HB   HIS  82          2HB       HIS  82   3.977 -10.533 -12.690
  646   2HB   HIS  82          1HB       HIS  82   3.768  -9.774 -14.265
  647    HD1  HIS  82           1HD      HIS  82   4.704 -11.387 -15.895
  648    HD2  HIS  82           2HD      HIS  82   7.155 -10.942 -12.570
  649    HE1  HIS  82           1HE      HIS  82   6.756 -12.754 -16.386
  650    HE2  HIS  82           2HE      HIS  82   8.186 -12.541 -14.323
  651    H    GLY  83           H        GLY  83   4.996  -7.740 -15.268
  652   1HA   GLY  83          2HA       GLY  83   2.938  -6.528 -16.078
  653   2HA   GLY  83          1HA       GLY  83   3.091  -5.580 -14.606
  654    H    SER  84           H        SER  84   5.383  -4.587 -14.354
  655    HA   SER  84           HA       SER  84   6.956  -4.015 -16.600
  656   1HB   SER  84          2HB       SER  84   4.945  -2.833 -17.402
  657   2HB   SER  84          1HB       SER  84   4.949  -1.845 -15.942
  658    HG   SER  84           HG       SER  84   7.154  -1.968 -17.712
  659    H    VAL  85           H        VAL  85   8.800  -3.862 -15.504
  660    HA   VAL  85           HA       VAL  85   9.058  -2.955 -12.859
  661    HB   VAL  85           HB       VAL  85  11.509  -2.858 -13.342
  662   1HG1  VAL  85          1HG1      VAL  85  10.697  -5.434 -14.511
  663   2HG1  VAL  85          2HG1      VAL  85   9.915  -5.009 -12.988
  664   3HG1  VAL  85          3HG1      VAL  85  11.674  -5.090 -13.083
  665   1HG2  VAL  85          1HG2      VAL  85  12.393  -3.042 -15.421
  666   2HG2  VAL  85          2HG2      VAL  85  10.843  -2.337 -15.884
  667   3HG2  VAL  85          3HG2      VAL  85  11.090  -4.079 -16.002
  668    H    ASP  86           H        ASP  86   8.907  -1.243 -15.847
  669    HA   ASP  86           HA       ASP  86  10.287   1.108 -15.014
  670   1HB   ASP  86          2HB       ASP  86   8.263   0.705 -17.225
  671   2HB   ASP  86          1HB       ASP  86   9.252   2.145 -17.009
  672    H    THR  87           H        THR  87   7.328  -0.166 -14.060
  673    HA   THR  87           HA       THR  87   5.968   2.364 -13.730
  674    HB   THR  87           HB       THR  87   4.942  -0.051 -14.061
  675    HG1  THR  87           1HG      THR  87   3.051   0.731 -13.032
  676   1HG2  THR  87          1HG2      THR  87   6.015  -0.742 -11.779
  677   2HG2  THR  87          2HG2      THR  87   4.396  -1.287 -12.215
  678   3HG2  THR  87          3HG2      THR  87   4.602   0.071 -11.107
  679    H    ALA  88           H        ALA  88   7.900   0.149 -11.863
  680    HA   ALA  88           HA       ALA  88   7.436   1.150  -9.286
  681   1HB   ALA  88          1HB       ALA  88  10.018   0.008 -10.341
  682   2HB   ALA  88          2HB       ALA  88   8.637  -0.966  -9.841
  683   3HB   ALA  88          3HB       ALA  88   9.475   0.046  -8.665
  684    H    VAL  89           H        VAL  89  10.113   1.805 -11.511
  685    HA   VAL  89           HA       VAL  89  11.242   3.901 -10.026
  686    HB   VAL  89           HB       VAL  89  12.548   4.414 -11.993
  687   1HG1  VAL  89          1HG1      VAL  89  12.765   2.169 -10.680
  688   2HG1  VAL  89          2HG1      VAL  89  13.692   2.421 -12.159
  689   3HG1  VAL  89          3HG1      VAL  89  12.216   1.455 -12.198
  690   1HG2  VAL  89          1HG2      VAL  89  12.090   3.338 -14.163
  691   2HG2  VAL  89          2HG2      VAL  89  10.792   4.425 -13.669
  692   3HG2  VAL  89          3HG2      VAL  89  10.593   2.681 -13.504
  693    H    LYS  90           H        LYS  90   8.504   3.802 -12.132
  694    HA   LYS  90           HA       LYS  90   8.468   6.692 -12.499
  695   1HB   LYS  90          2HB       LYS  90   7.820   5.035 -14.309
  696   2HB   LYS  90          1HB       LYS  90   6.366   4.722 -13.373
  697   1HG   LYS  90          2HG       LYS  90   5.708   7.055 -13.582
  698   2HG   LYS  90          1HG       LYS  90   7.183   7.397 -14.487
  699   1HD   LYS  90          2HD       LYS  90   5.491   5.197 -15.504
  700   2HD   LYS  90          1HD       LYS  90   4.834   6.827 -15.653
  701   1HE   LYS  90          2HE       LYS  90   6.363   7.446 -17.196
  702   2HE   LYS  90          1HE       LYS  90   7.654   6.510 -16.444
  703   1HZ   LYS  90          1HZ       LYS  90   7.346   5.293 -18.315
  704   2HZ   LYS  90          2HZ       LYS  90   5.714   5.706 -18.473
  705   3HZ   LYS  90          3HZ       LYS  90   6.183   4.534 -17.349
  706    H    ALA  91           H        ALA  91   8.152   5.396  -9.840
  707    HA   ALA  91           HA       ALA  91   5.862   6.930  -8.979
  708   1HB   ALA  91          1HB       ALA  91   5.004   4.887  -7.671
  709   2HB   ALA  91          2HB       ALA  91   5.922   3.936  -8.838
  710   3HB   ALA  91          3HB       ALA  91   4.626   4.996  -9.390
  711    H    ILE  92           H        ILE  92   8.463   4.688  -8.133
  712    HA   ILE  92           HA       ILE  92   8.518   5.398  -5.379
  713    HB   ILE  92           HB       ILE  92  10.398   4.025  -5.149
  714   1HG1  ILE  92          2HG1      ILE  92  10.871   4.363  -8.123
  715   2HG1  ILE  92          1HG1      ILE  92  11.863   5.011  -6.821
  716   1HG2  ILE  92          1HG2      ILE  92   9.726   2.244  -7.187
  717   2HG2  ILE  92          2HG2      ILE  92   8.247   3.149  -6.868
  718   3HG2  ILE  92          3HG2      ILE  92   9.057   2.297  -5.556
  719   1HD1  ILE  92          1HD1      ILE  92  12.775   2.979  -7.963
  720   2HD1  ILE  92          2HD1      ILE  92  11.436   2.069  -7.264
  721   3HD1  ILE  92          3HD1      ILE  92  12.618   2.845  -6.211
  722    H    LYS  93           H        LYS  93  10.424   6.379  -8.198
  723    HA   LYS  93           HA       LYS  93  12.238   8.027  -6.814
  724   1HB   LYS  93          2HB       LYS  93  12.055   7.180  -9.366
  725   2HB   LYS  93          1HB       LYS  93  11.453   8.819  -9.560
  726   1HG   LYS  93          2HG       LYS  93  13.586   9.464  -8.211
  727   2HG   LYS  93          1HG       LYS  93  14.159   7.880  -8.735
  728   1HD   LYS  93          2HD       LYS  93  13.159  10.071 -10.553
  729   2HD   LYS  93          1HD       LYS  93  14.854   9.668 -10.271
  730   1HE   LYS  93          2HE       LYS  93  14.765   7.808 -11.558
  731   2HE   LYS  93          1HE       LYS  93  13.104   7.439 -11.096
  732   1HZ   LYS  93          1HZ       LYS  93  13.754   8.308 -13.498
  733   2HZ   LYS  93          2HZ       LYS  93  13.516   9.806 -12.747
  734   3HZ   LYS  93          3HZ       LYS  93  12.266   8.667 -12.781
  735    H    LYS  94           H        LYS  94   8.938   8.460  -7.703
  736    HA   LYS  94           HA       LYS  94   8.897  11.306  -7.688
  737   1HB   LYS  94          2HB       LYS  94   7.180   9.838  -8.774
  738   2HB   LYS  94          1HB       LYS  94   6.594   9.427  -7.168
  739   1HG   LYS  94          2HG       LYS  94   5.155  11.107  -7.629
  740   2HG   LYS  94          1HG       LYS  94   6.473  12.076  -6.966
  741   1HD   LYS  94          2HD       LYS  94   7.328  12.331  -9.317
  742   2HD   LYS  94          1HD       LYS  94   5.828  11.581  -9.868
  743   1HE   LYS  94          2HE       LYS  94   5.255  13.793 -10.008
  744   2HE   LYS  94          1HE       LYS  94   4.730  13.434  -8.363
  745   1HZ   LYS  94          1HZ       LYS  94   7.479  14.325  -8.657
  746   2HZ   LYS  94          2HZ       LYS  94   6.333  14.720  -7.479
  747   3HZ   LYS  94          3HZ       LYS  94   6.293  15.486  -8.987
  748    H    GLY  95           H        GLY  95   8.693   8.845  -5.225
  749   1HA   GLY  95          2HA       GLY  95   9.385  10.316  -3.074
  750   2HA   GLY  95          1HA       GLY  95   7.671  10.670  -3.220
  751    H    ALA  96           H        ALA  96   7.374   7.789  -4.309
  752    HA   ALA  96           HA       ALA  96   6.375   6.603  -2.039
  753   1HB   ALA  96          1HB       ALA  96   5.801   4.936  -3.407
  754   2HB   ALA  96          2HB       ALA  96   7.471   4.638  -3.888
  755   3HB   ALA  96          3HB       ALA  96   6.535   5.901  -4.687
  756    H    TYR  97           H        TYR  97   7.224   4.317  -1.285
  757    HA   TYR  97           HA       TYR  97   9.900   4.809  -0.205
  758   1HB   TYR  97          2HB       TYR  97   7.877   4.334   1.267
  759   2HB   TYR  97          1HB       TYR  97   7.964   2.680   0.676
  760    HD1  TYR  97           1HD      TYR  97   9.446   1.136   1.643
  761    HD2  TYR  97           2HD      TYR  97   9.897   5.282   2.483
  762    HE1  TYR  97           1HE      TYR  97  11.102   0.598   3.380
  763    HE2  TYR  97           2HE      TYR  97  11.556   4.756   4.221
  764    HH   TYR  97           HH       TYR  97  11.990   1.695   5.481
  765    H    GLU  98           H        GLU  98   9.422   3.802  -2.909
  766    HA   GLU  98           HA       GLU  98  10.582   2.428  -4.316
  767   1HB   GLU  98          2HB       GLU  98  12.449   1.369  -3.613
  768   2HB   GLU  98          1HB       GLU  98  12.158   2.279  -2.142
  769   1HG   GLU  98          2HG       GLU  98  10.726   0.089  -1.579
  770   2HG   GLU  98          1HG       GLU  98  11.914  -0.617  -2.671
  771    H    PHE  99           H        PHE  99  10.159   0.510  -5.384
  772    HA   PHE  99           HA       PHE  99   7.660  -0.701  -4.723
  773   1HB   PHE  99          2HB       PHE  99   9.522  -0.691  -6.974
  774   2HB   PHE  99          1HB       PHE  99   8.761  -2.255  -6.724
  775    HD1  PHE  99           1HD      PHE  99   7.318   1.117  -6.141
  776    HD2  PHE  99           2HD      PHE  99   7.284  -2.418  -8.511
  777    HE1  PHE  99           1HE      PHE  99   5.298   1.916  -7.300
  778    HE2  PHE  99           2HE      PHE  99   5.268  -1.623  -9.675
  779    HZ   PHE  99           HZ       PHE  99   4.270   0.545  -9.067
  780    H    LEU 100           H        LEU 100   7.223  -2.705  -3.946
  781    HA   LEU 100           HA       LEU 100   9.398  -4.093  -2.612
  782   1HB   LEU 100          2HB       LEU 100   7.025  -3.483  -1.675
  783   2HB   LEU 100          1HB       LEU 100   6.530  -4.940  -2.511
  784    HG   LEU 100           HG       LEU 100   6.916  -5.673  -0.349
  785   1HD1  LEU 100          1HD1      LEU 100   8.219  -6.900  -2.165
  786   2HD1  LEU 100          2HD1      LEU 100   8.677  -7.197  -0.488
  787   3HD1  LEU 100          3HD1      LEU 100   9.649  -6.120  -1.490
  788   1HD2  LEU 100          1HD2      LEU 100   9.088  -3.648  -0.349
  789   2HD2  LEU 100          2HD2      LEU 100   9.243  -5.040   0.723
  790   3HD2  LEU 100          3HD2      LEU 100   7.844  -3.974   0.858
  791    H    GLU 101           H        GLU 101  10.250  -5.974  -3.298
  792    HA   GLU 101           HA       GLU 101   9.916  -6.979  -5.835
  793   1HB   GLU 101          2HB       GLU 101  11.045  -8.059  -3.308
  794   2HB   GLU 101          1HB       GLU 101  10.738  -9.211  -4.601
  795   1HG   GLU 101          2HG       GLU 101  12.233  -8.135  -6.058
  796   2HG   GLU 101          1HG       GLU 101  12.313  -6.697  -5.042
  797    H    LYS 102           H        LYS 102   8.862  -8.849  -2.994
  798    HA   LYS 102           HA       LYS 102   7.147 -10.319  -2.700
  799   1HB   LYS 102          2HB       LYS 102   6.027  -7.959  -3.144
  800   2HB   LYS 102          1HB       LYS 102   5.436  -8.768  -4.588
  801   1HG   LYS 102          2HG       LYS 102   5.084 -10.275  -2.095
  802   2HG   LYS 102          1HG       LYS 102   4.173  -8.768  -2.199
  803   1HD   LYS 102          2HD       LYS 102   4.159 -10.719  -4.472
  804   2HD   LYS 102          1HD       LYS 102   3.100 -10.955  -3.080
  805   1HE   LYS 102          2HE       LYS 102   1.654  -9.608  -4.112
  806   2HE   LYS 102          1HE       LYS 102   2.756  -8.289  -3.718
  807   1HZ   LYS 102          1HZ       LYS 102   2.590  -8.034  -5.961
  808   2HZ   LYS 102          2HZ       LYS 102   2.358  -9.682  -6.263
  809   3HZ   LYS 102          3HZ       LYS 102   3.906  -9.097  -5.914
  810    HA   PRO 103           HA       PRO 103   7.903 -12.315  -6.839
  811   1HB   PRO 103          2HB       PRO 103   9.174 -14.511  -5.916
  812   2HB   PRO 103          1HB       PRO 103  10.021 -12.993  -6.241
  813   1HG   PRO 103          2HG       PRO 103   9.053 -14.101  -3.632
  814   2HG   PRO 103          1HG       PRO 103  10.596 -13.314  -4.009
  815   1HD   PRO 103          2HD       PRO 103   8.529 -12.021  -2.804
  816   2HD   PRO 103          1HD       PRO 103   9.697 -11.201  -3.858
  817    H    PHE 104           H        PHE 104   6.213 -12.988  -4.009
  818    HA   PHE 104           HA       PHE 104   4.178 -14.421  -5.263
  819   1HB   PHE 104          2HB       PHE 104   4.464 -16.667  -4.366
  820   2HB   PHE 104          1HB       PHE 104   5.843 -16.242  -5.371
  821    HD1  PHE 104           1HD      PHE 104   8.012 -15.688  -4.323
  822    HD2  PHE 104           2HD      PHE 104   4.709 -17.123  -2.052
  823    HE1  PHE 104           1HE      PHE 104   9.533 -16.249  -2.472
  824    HE2  PHE 104           2HE      PHE 104   6.224 -17.685  -0.197
  825    HZ   PHE 104           HZ       PHE 104   8.639 -17.248  -0.406
  826    H    SER 105           H        SER 105   5.925 -13.872  -2.250
  827    HA   SER 105           HA       SER 105   3.331 -13.490  -0.913
  828   1HB   SER 105          2HB       SER 105   4.311 -14.401   1.160
  829   2HB   SER 105          1HB       SER 105   4.313 -15.595  -0.138
  830    HG   SER 105           HG       SER 105   6.548 -14.819  -0.521
  831    H    VAL 106           H        VAL 106   3.344 -11.989   0.866
  832    HA   VAL 106           HA       VAL 106   5.082  -9.732   0.350
  833    HB   VAL 106           HB       VAL 106   3.696  -8.546   2.002
  834   1HG1  VAL 106          1HG1      VAL 106   2.192 -10.081  -0.109
  835   2HG1  VAL 106          2HG1      VAL 106   2.974  -8.509  -0.285
  836   3HG1  VAL 106          3HG1      VAL 106   1.556  -8.677   0.748
  837   1HG2  VAL 106          1HG2      VAL 106   1.525 -10.111   2.494
  838   2HG2  VAL 106          2HG2      VAL 106   2.846  -9.829   3.628
  839   3HG2  VAL 106          3HG2      VAL 106   2.844 -11.275   2.620
  840    H    GLU 107           H        GLU 107   5.654 -12.434   2.028
  841    HA   GLU 107           HA       GLU 107   6.318 -11.965   4.590
  842   1HB   GLU 107          2HB       GLU 107   6.772 -14.032   3.171
  843   2HB   GLU 107          1HB       GLU 107   8.292 -13.265   2.732
  844   1HG   GLU 107          2HG       GLU 107   8.627 -13.054   5.289
  845   2HG   GLU 107          1HG       GLU 107   7.397 -14.314   5.372
  846    H    ARG 108           H        ARG 108   8.315 -11.007   1.805
  847    HA   ARG 108           HA       ARG 108  10.341  -9.765   3.371
  848   1HB   ARG 108          2HB       ARG 108   9.833 -10.262   0.594
  849   2HB   ARG 108          1HB       ARG 108  10.255  -8.567   0.798
  850   1HG   ARG 108          2HG       ARG 108  12.395  -9.029   1.240
  851   2HG   ARG 108          1HG       ARG 108  11.987 -10.397   2.275
  852   1HD   ARG 108          2HD       ARG 108  11.326 -11.454  -0.081
  853   2HD   ARG 108          1HD       ARG 108  12.546 -10.309  -0.634
  854    HE   ARG 108           HE       ARG 108  14.165 -11.603   0.345
  855   1HH1  ARG 108          1HH1      ARG 108  11.036 -12.607   1.523
  856   2HH1  ARG 108          2HH1      ARG 108  11.651 -14.012   2.328
  857   1HH2  ARG 108          1HH2      ARG 108  14.975 -13.452   1.401
  858   2HH2  ARG 108          2HH2      ARG 108  13.887 -14.492   2.258
  859    H    PHE 109           H        PHE 109   7.370  -8.690   1.867
  860    HA   PHE 109           HA       PHE 109   7.651  -5.927   2.080
  861   1HB   PHE 109          2HB       PHE 109   5.789  -6.517   0.851
  862   2HB   PHE 109          1HB       PHE 109   5.365  -7.830   1.926
  863    HD1  PHE 109           1HD      PHE 109   5.143  -4.211   1.387
  864    HD2  PHE 109           2HD      PHE 109   3.893  -7.501   3.777
  865    HE1  PHE 109           1HE      PHE 109   3.406  -2.800   2.409
  866    HE2  PHE 109           2HE      PHE 109   2.152  -6.097   4.804
  867    HZ   PHE 109           HZ       PHE 109   1.906  -3.745   4.120
  868    H    LEU 110           H        LEU 110   7.151  -8.324   4.512
  869    HA   LEU 110           HA       LEU 110   5.966  -6.766   6.528
  870   1HB   LEU 110          2HB       LEU 110   6.697  -9.371   6.251
  871   2HB   LEU 110          1HB       LEU 110   7.860  -8.798   7.430
  872    HG   LEU 110           HG       LEU 110   4.907  -8.358   7.780
  873   1HD1  LEU 110          1HD1      LEU 110   4.970 -10.339   9.284
  874   2HD1  LEU 110          2HD1      LEU 110   6.563 -10.724   8.631
  875   3HD1  LEU 110          3HD1      LEU 110   5.152 -10.727   7.574
  876   1HD2  LEU 110          1HD2      LEU 110   6.962  -7.238   9.086
  877   2HD2  LEU 110          2HD2      LEU 110   6.780  -8.713  10.035
  878   3HD2  LEU 110          3HD2      LEU 110   5.417  -7.608   9.852
  879    H    LEU 111           H        LEU 111   9.350  -7.418   5.748
  880    HA   LEU 111           HA       LEU 111  10.575  -6.196   7.909
  881   1HB   LEU 111          2HB       LEU 111  11.440  -6.441   5.042
  882   2HB   LEU 111          1HB       LEU 111  12.473  -5.759   6.283
  883    HG   LEU 111           HG       LEU 111  12.082  -7.995   7.529
  884   1HD1  LEU 111          1HD1      LEU 111  10.974  -8.556   4.826
  885   2HD1  LEU 111          2HD1      LEU 111  10.452  -9.139   6.405
  886   3HD1  LEU 111          3HD1      LEU 111  11.891  -9.818   5.647
  887   1HD2  LEU 111          1HD2      LEU 111  14.169  -7.126   6.321
  888   2HD2  LEU 111          2HD2      LEU 111  13.698  -8.212   5.014
  889   3HD2  LEU 111          3HD2      LEU 111  14.047  -8.860   6.615
  890    H    THR 112           H        THR 112   9.914  -4.725   4.733
  891    HA   THR 112           HA       THR 112  10.711  -2.135   5.380
  892    HB   THR 112           HB       THR 112   8.606  -3.052   3.411
  893    HG1  THR 112           1HG      THR 112  10.843  -3.814   3.194
  894   1HG2  THR 112          1HG2      THR 112   9.938  -0.745   2.497
  895   2HG2  THR 112          2HG2      THR 112   9.348  -0.402   4.124
  896   3HG2  THR 112          3HG2      THR 112   8.228  -0.946   2.875
  897    H    ILE 113           H        ILE 113   7.535  -3.672   5.659
  898    HA   ILE 113           HA       ILE 113   5.899  -1.599   6.285
  899    HB   ILE 113           HB       ILE 113   5.985  -4.437   7.145
  900   1HG1  ILE 113          2HG1      ILE 113   4.935  -3.734   5.038
  901   2HG1  ILE 113          1HG1      ILE 113   3.757  -4.452   6.133
  902   1HG2  ILE 113          1HG2      ILE 113   5.403  -3.522   9.254
  903   2HG2  ILE 113          2HG2      ILE 113   3.906  -4.095   8.517
  904   3HG2  ILE 113          3HG2      ILE 113   4.283  -2.372   8.522
  905   1HD1  ILE 113          1HD1      ILE 113   3.805  -1.659   6.605
  906   2HD1  ILE 113          2HD1      ILE 113   2.499  -2.649   5.952
  907   3HD1  ILE 113          3HD1      ILE 113   3.687  -1.927   4.866
  908    H    LYS 114           H        LYS 114   7.873  -3.353   8.692
  909    HA   LYS 114           HA       LYS 114   7.190  -1.943  10.945
  910   1HB   LYS 114          2HB       LYS 114   8.853  -3.921  10.591
  911   2HB   LYS 114          1HB       LYS 114  10.056  -2.646  10.462
  912   1HG   LYS 114          2HG       LYS 114   8.192  -2.774  12.799
  913   2HG   LYS 114          1HG       LYS 114   9.665  -3.745  12.748
  914   1HD   LYS 114          2HD       LYS 114   9.572  -0.749  12.415
  915   2HD   LYS 114          1HD       LYS 114   9.948  -1.579  13.926
  916   1HE   LYS 114          2HE       LYS 114  11.511  -1.625  11.352
  917   2HE   LYS 114          1HE       LYS 114  12.015  -0.968  12.910
  918   1HZ   LYS 114          1HZ       LYS 114  13.046  -2.961  13.021
  919   2HZ   LYS 114          2HZ       LYS 114  11.947  -3.734  11.995
  920   3HZ   LYS 114          3HZ       LYS 114  11.543  -3.465  13.615
  921    H    HIS 115           H        HIS 115  10.018  -1.275   8.908
  922    HA   HIS 115           HA       HIS 115  10.720   1.165  10.006
  923   1HB   HIS 115          2HB       HIS 115  12.023  -0.190   8.322
  924   2HB   HIS 115          1HB       HIS 115  10.980   0.490   7.078
  925    HD1  HIS 115           1HD      HIS 115  10.920   3.362   7.479
  926    HD2  HIS 115           2HD      HIS 115  14.341   1.177   8.367
  927    HE1  HIS 115           1HE      HIS 115  12.807   5.022   7.438
  928    HE2  HIS 115           2HE      HIS 115  14.879   3.661   7.890
  929    H    ALA 116           H        ALA 116   8.137   0.396   7.791
  930    HA   ALA 116           HA       ALA 116   7.653   3.000   6.805
  931   1HB   ALA 116          1HB       ALA 116   5.258   1.376   7.069
  932   2HB   ALA 116          2HB       ALA 116   6.603   0.486   6.355
  933   3HB   ALA 116          3HB       ALA 116   6.054   1.992   5.620
  934    H    PHE 117           H        PHE 117   6.435   1.237   9.616
  935    HA   PHE 117           HA       PHE 117   4.702   3.383  10.434
  936   1HB   PHE 117          2HB       PHE 117   5.496   0.735  11.608
  937   2HB   PHE 117          1HB       PHE 117   4.618   1.913  12.579
  938    HD1  PHE 117           1HD      PHE 117   2.349   2.600  11.933
  939    HD2  PHE 117           2HD      PHE 117   4.420  -0.499   9.881
  940    HE1  PHE 117           1HE      PHE 117   0.226   1.836  10.956
  941    HE2  PHE 117           2HE      PHE 117   2.300  -1.270   8.899
  942    HZ   PHE 117           HZ       PHE 117   0.199  -0.099   9.436
  943    H    GLU 118           H        GLU 118   7.956   2.329  11.114
  944    HA   GLU 118           HA       GLU 118   8.440   3.605  13.533
  945   1HB   GLU 118          2HB       GLU 118  10.302   3.156  11.202
  946   2HB   GLU 118          1HB       GLU 118  10.822   3.674  12.799
  947   1HG   GLU 118          2HG       GLU 118   9.191   1.203  12.588
  948   2HG   GLU 118          1HG       GLU 118  10.876   1.145  12.071
  949    H    GLU 119           H        GLU 119   8.029   4.944  10.366
  950    HA   GLU 119           HA       GLU 119   9.067   7.542  11.221
  951   1HB   GLU 119          2HB       GLU 119   8.090   6.630   8.510
  952   2HB   GLU 119          1HB       GLU 119   8.799   8.199   8.866
  953   1HG   GLU 119          2HG       GLU 119  10.441   5.907   9.660
  954   2HG   GLU 119          1HG       GLU 119  10.164   6.058   7.925
  955    H    TYR 120           H        TYR 120   6.591   6.424  12.313
  956    HA   TYR 120           HA       TYR 120   4.582   8.243  11.188
  957   1HB   TYR 120          2HB       TYR 120   4.177   5.703  11.623
  958   2HB   TYR 120          1HB       TYR 120   3.992   6.196  13.303
  959    HD1  TYR 120           1HD      TYR 120   1.788   6.346  13.949
  960    HD2  TYR 120           2HD      TYR 120   2.843   7.537  10.003
  961    HE1  TYR 120           1HE      TYR 120  -0.554   6.956  13.513
  962    HE2  TYR 120           2HE      TYR 120   0.504   8.152   9.556
  963    HH   TYR 120           HH       TYR 120  -1.885   7.264  10.710
  964    H    SER 121           H        SER 121   6.824   9.088  12.900
  965    HA   SER 121           HA       SER 121   5.243  10.564  14.845
  966   1HB   SER 121          2HB       SER 121   6.160   8.434  15.939
  967   2HB   SER 121          1HB       SER 121   7.753   9.174  15.775
  968    HG   SER 121           HG       SER 121   5.576  10.467  17.043
  Start of MODEL   38
    1   1H    MET   1          1HT       MET   1  -4.180   1.155  14.822
    2   2H    MET   1          2HT       MET   1  -4.328   1.900  16.361
    3   3H    MET   1          3HT       MET   1  -4.235   0.190  16.238
    4    HA   MET   1           HA       MET   1  -2.137   2.170  15.677
    5   1HB   MET   1          2HB       MET   1  -2.932   0.958  18.011
    6   2HB   MET   1          1HB       MET   1  -1.670  -0.129  17.448
    7   1HG   MET   1          2HG       MET   1  -0.224   1.245  18.411
    8   2HG   MET   1          1HG       MET   1  -0.566   2.375  17.103
    9   1HE   MET   1          1HE       MET   1  -2.181   1.064  20.397
   10   2HE   MET   1          2HE       MET   1  -2.227   2.526  21.383
   11   3HE   MET   1          3HE       MET   1  -0.678   1.813  20.934
   12    H    LYS   2           H        LYS   2  -0.538   1.596  14.336
   13    HA   LYS   2           HA       LYS   2   0.674   0.413  12.819
   14   1HB   LYS   2          2HB       LYS   2  -0.050  -1.778  14.744
   15   2HB   LYS   2          1HB       LYS   2   0.960  -2.067  13.335
   16   1HG   LYS   2          2HG       LYS   2   1.734   0.164  15.117
   17   2HG   LYS   2          1HG       LYS   2   1.961  -1.479  15.721
   18   1HD   LYS   2          2HD       LYS   2   2.949  -1.661  13.177
   19   2HD   LYS   2          1HD       LYS   2   3.409  -0.020  13.633
   20   1HE   LYS   2          2HE       LYS   2   3.901  -1.923  15.766
   21   2HE   LYS   2          1HE       LYS   2   4.750  -2.358  14.283
   22   1HZ   LYS   2          1HZ       LYS   2   5.976  -0.848  15.845
   23   2HZ   LYS   2          2HZ       LYS   2   4.860   0.361  15.454
   24   3HZ   LYS   2          3HZ       LYS   2   5.855  -0.293  14.252
   25    H    ARG   3           H        ARG   3  -1.361   1.053  11.522
   26    HA   ARG   3           HA       ARG   3  -2.601  -1.391  10.453
   27   1HB   ARG   3          2HB       ARG   3  -4.548  -0.099   9.869
   28   2HB   ARG   3          1HB       ARG   3  -4.198   0.107  11.578
   29   1HG   ARG   3          2HG       ARG   3  -3.061   2.081   9.705
   30   2HG   ARG   3          1HG       ARG   3  -4.800   2.123   9.993
   31   1HD   ARG   3          2HD       ARG   3  -3.596   1.825  12.512
   32   2HD   ARG   3          1HD       ARG   3  -2.653   3.050  11.663
   33    HE   ARG   3           HE       ARG   3  -4.440   4.477  11.797
   34   1HH1  ARG   3          1HH1      ARG   3  -5.508   1.246  12.566
   35   2HH1  ARG   3          2HH1      ARG   3  -7.075   1.754  13.097
   36   1HH2  ARG   3          1HH2      ARG   3  -6.501   5.150  12.497
   37   2HH2  ARG   3          2HH2      ARG   3  -7.640   3.972  13.059
   38    H    VAL   4           H        VAL   4  -2.628  -1.723   8.246
   39    HA   VAL   4           HA       VAL   4  -1.258   0.319   6.616
   40    HB   VAL   4           HB       VAL   4  -0.915  -2.670   6.316
   41   1HG1  VAL   4          1HG1      VAL   4   0.100  -0.299   4.807
   42   2HG1  VAL   4          2HG1      VAL   4  -0.555  -1.818   4.199
   43   3HG1  VAL   4          3HG1      VAL   4   1.068  -1.770   4.888
   44   1HG2  VAL   4          1HG2      VAL   4   1.055  -0.643   7.374
   45   2HG2  VAL   4          2HG2      VAL   4   1.324  -2.376   7.184
   46   3HG2  VAL   4          3HG2      VAL   4   0.153  -1.790   8.365
   47    H    LEU   5           H        LEU   5  -1.732   0.188   4.298
   48    HA   LEU   5           HA       LEU   5  -4.454  -0.818   3.816
   49   1HB   LEU   5          2HB       LEU   5  -4.170   1.656   3.763
   50   2HB   LEU   5          1HB       LEU   5  -3.054   1.461   2.424
   51    HG   LEU   5           HG       LEU   5  -4.861   0.470   1.070
   52   1HD1  LEU   5          1HD1      LEU   5  -7.218   1.002   2.108
   53   2HD1  LEU   5          2HD1      LEU   5  -6.344   0.795   3.626
   54   3HD1  LEU   5          3HD1      LEU   5  -6.391  -0.517   2.450
   55   1HD2  LEU   5          1HD2      LEU   5  -6.303   2.845   1.680
   56   2HD2  LEU   5          2HD2      LEU   5  -5.192   2.540   0.346
   57   3HD2  LEU   5          3HD2      LEU   5  -4.582   3.176   1.873
   58    H    VAL   6           H        VAL   6  -4.756  -2.280   2.274
   59    HA   VAL   6           HA       VAL   6  -2.526  -2.800   0.412
   60    HB   VAL   6           HB       VAL   6  -4.591  -4.801   1.324
   61   1HG1  VAL   6          1HG1      VAL   6  -3.745  -5.472  -0.764
   62   2HG1  VAL   6          2HG1      VAL   6  -2.825  -6.395   0.423
   63   3HG1  VAL   6          3HG1      VAL   6  -2.102  -4.983  -0.349
   64   1HG2  VAL   6          1HG2      VAL   6  -3.118  -5.620   2.923
   65   2HG2  VAL   6          2HG2      VAL   6  -2.938  -3.873   3.082
   66   3HG2  VAL   6          3HG2      VAL   6  -1.729  -4.807   2.203
   67    H    VAL   7           H        VAL   7  -3.275  -1.438  -1.228
   68    HA   VAL   7           HA       VAL   7  -5.952  -1.779  -2.275
   69    HB   VAL   7           HB       VAL   7  -3.702  -0.191  -3.517
   70   1HG1  VAL   7          1HG1      VAL   7  -6.675  -0.284  -3.873
   71   2HG1  VAL   7          2HG1      VAL   7  -5.402  -0.362  -5.092
   72   3HG1  VAL   7          3HG1      VAL   7  -5.757   1.165  -4.284
   73   1HG2  VAL   7          1HG2      VAL   7  -5.780   0.849  -1.597
   74   2HG2  VAL   7          2HG2      VAL   7  -4.416   1.727  -2.291
   75   3HG2  VAL   7          3HG2      VAL   7  -4.131   0.433  -1.127
   76    H    ASP   8           H        ASP   8  -6.275  -3.681  -3.280
   77    HA   ASP   8           HA       ASP   8  -4.545  -4.302  -5.566
   78   1HB   ASP   8          2HB       ASP   8  -3.881  -5.724  -3.632
   79   2HB   ASP   8          1HB       ASP   8  -5.519  -6.365  -3.575
   80    H    ASP   9           H        ASP   9  -5.596  -5.088  -7.348
   81    HA   ASP   9           HA       ASP   9  -8.495  -4.890  -7.302
   82   1HB   ASP   9          2HB       ASP   9  -7.175  -3.789  -9.088
   83   2HB   ASP   9          1HB       ASP   9  -6.633  -5.372  -9.637
   84    H    GLU  10           H        GLU  10  -7.121  -7.198  -6.039
   85    HA   GLU  10           HA       GLU  10  -8.783  -9.254  -7.187
   86   1HB   GLU  10          2HB       GLU  10  -6.333  -9.142  -8.277
   87   2HB   GLU  10          1HB       GLU  10  -5.961 -10.115  -6.861
   88   1HG   GLU  10          2HG       GLU  10  -8.275 -11.241  -7.916
   89   2HG   GLU  10          1HG       GLU  10  -7.272 -10.857  -9.314
   90    H    GLU  11           H        GLU  11  -8.030 -11.452  -5.917
   91    HA   GLU  11           HA       GLU  11  -7.849 -10.684  -3.077
   92   1HB   GLU  11          2HB       GLU  11  -9.338 -12.574  -2.560
   93   2HB   GLU  11          1HB       GLU  11 -10.116 -11.399  -3.611
   94   1HG   GLU  11          2HG       GLU  11 -10.229 -12.825  -5.363
   95   2HG   GLU  11          1HG       GLU  11  -8.736 -13.656  -4.927
   96    H    SER  12           H        SER  12  -5.549 -11.202  -4.428
   97    HA   SER  12           HA       SER  12  -4.852 -13.981  -3.787
   98   1HB   SER  12          2HB       SER  12  -4.227 -13.489  -6.018
   99   2HB   SER  12          1HB       SER  12  -3.569 -11.914  -5.570
  100    HG   SER  12           HG       SER  12  -1.746 -12.836  -5.084
  101    H    ILE  13           H        ILE  13  -3.559 -10.679  -3.428
  102    HA   ILE  13           HA       ILE  13  -1.595 -11.488  -1.506
  103    HB   ILE  13           HB       ILE  13  -2.560  -8.683  -2.061
  104   1HG1  ILE  13          2HG1      ILE  13  -1.872  -9.804  -4.147
  105   2HG1  ILE  13          1HG1      ILE  13  -0.749  -8.525  -3.695
  106   1HG2  ILE  13          1HG2      ILE  13  -0.174  -9.856  -0.689
  107   2HG2  ILE  13          2HG2      ILE  13  -1.260  -8.578  -0.143
  108   3HG2  ILE  13          3HG2      ILE  13  -0.091  -8.254  -1.423
  109   1HD1  ILE  13          1HD1      ILE  13  -0.276 -11.418  -3.046
  110   2HD1  ILE  13          2HD1      ILE  13   0.874 -10.082  -2.979
  111   3HD1  ILE  13          3HD1      ILE  13   0.279 -10.655  -4.537
  112    H    THR  14           H        THR  14  -4.685  -9.744  -1.341
  113    HA   THR  14           HA       THR  14  -4.691  -9.181   1.386
  114    HB   THR  14           HB       THR  14  -7.116  -8.962   1.181
  115    HG1  THR  14           1HG      THR  14  -6.730 -10.309  -1.279
  116   1HG2  THR  14          1HG2      THR  14  -5.835  -7.145   0.229
  117   2HG2  THR  14          2HG2      THR  14  -7.287  -7.447  -0.726
  118   3HG2  THR  14          3HG2      THR  14  -5.718  -8.008  -1.305
  119    H    SER  15           H        SER  15  -5.101 -12.187  -0.242
  120    HA   SER  15           HA       SER  15  -6.572 -13.538   1.787
  121   1HB   SER  15          2HB       SER  15  -5.940 -14.133  -0.786
  122   2HB   SER  15          1HB       SER  15  -4.782 -15.150   0.072
  123    HG   SER  15           HG       SER  15  -6.714 -15.823   1.343
  124    H    SER  16           H        SER  16  -3.122 -13.288   1.012
  125    HA   SER  16           HA       SER  16  -2.489 -14.739   3.483
  126   1HB   SER  16          2HB       SER  16  -0.080 -14.459   2.362
  127   2HB   SER  16          1HB       SER  16  -1.180 -15.757   1.901
  128    HG   SER  16           HG       SER  16  -1.144 -14.947  -0.024
  129    H    LEU  17           H        LEU  17  -1.296 -11.898   1.685
  130    HA   LEU  17           HA       LEU  17   0.299 -10.742   3.578
  131   1HB   LEU  17          2HB       LEU  17   0.034  -9.881   1.306
  132   2HB   LEU  17          1HB       LEU  17  -1.591  -9.349   1.678
  133    HG   LEU  17           HG       LEU  17   0.410  -7.655   1.642
  134   1HD1  LEU  17          1HD1      LEU  17  -0.789  -6.241   3.222
  135   2HD1  LEU  17          2HD1      LEU  17  -1.681  -7.642   3.812
  136   3HD1  LEU  17          3HD1      LEU  17  -1.902  -7.092   2.152
  137   1HD2  LEU  17          1HD2      LEU  17   1.386  -7.272   3.837
  138   2HD2  LEU  17          2HD2      LEU  17   1.802  -8.878   3.239
  139   3HD2  LEU  17          3HD2      LEU  17   0.553  -8.691   4.471
  140    H    SER  18           H        SER  18  -3.175 -10.006   3.162
  141    HA   SER  18           HA       SER  18  -3.484  -8.332   5.345
  142   1HB   SER  18          2HB       SER  18  -5.170  -9.101   3.468
  143   2HB   SER  18          1HB       SER  18  -5.664 -10.278   4.684
  144    HG   SER  18           HG       SER  18  -6.910  -8.451   4.947
  145    H    ALA  19           H        ALA  19  -3.746 -11.867   5.211
  146    HA   ALA  19           HA       ALA  19  -4.477 -12.261   7.901
  147   1HB   ALA  19          1HB       ALA  19  -4.826 -14.086   6.481
  148   2HB   ALA  19          2HB       ALA  19  -3.468 -14.584   7.492
  149   3HB   ALA  19          3HB       ALA  19  -3.183 -14.021   5.845
  150    H    ILE  20           H        ILE  20  -1.347 -12.059   6.292
  151    HA   ILE  20           HA       ILE  20   0.300 -12.827   8.408
  152    HB   ILE  20           HB       ILE  20   0.739 -11.014   6.052
  153   1HG1  ILE  20          2HG1      ILE  20   2.360 -13.426   6.526
  154   2HG1  ILE  20          1HG1      ILE  20   0.645 -13.700   6.232
  155   1HG2  ILE  20          1HG2      ILE  20   2.728 -11.671   8.215
  156   2HG2  ILE  20          2HG2      ILE  20   2.179 -10.073   7.710
  157   3HG2  ILE  20          3HG2      ILE  20   3.170 -11.048   6.625
  158   1HD1  ILE  20          1HD1      ILE  20   2.425 -12.090   4.425
  159   2HD1  ILE  20          2HD1      ILE  20   0.768 -12.611   4.116
  160   3HD1  ILE  20          3HD1      ILE  20   2.064 -13.803   4.204
  161    H    LEU  21           H        LEU  21  -0.281  -9.459   7.360
  162    HA   LEU  21           HA       LEU  21   0.817  -8.158   9.513
  163   1HB   LEU  21          2HB       LEU  21  -1.670  -7.378   7.999
  164   2HB   LEU  21          1HB       LEU  21  -0.689  -6.297   8.972
  165    HG   LEU  21           HG       LEU  21   0.884  -7.682   6.959
  166   1HD1  LEU  21          1HD1      LEU  21  -1.198  -7.624   5.710
  167   2HD1  LEU  21          2HD1      LEU  21  -0.022  -6.497   5.034
  168   3HD1  LEU  21          3HD1      LEU  21  -1.352  -5.895   6.026
  169   1HD2  LEU  21          1HD2      LEU  21   1.170  -5.474   8.435
  170   2HD2  LEU  21          2HD2      LEU  21   0.521  -4.752   6.963
  171   3HD2  LEU  21          3HD2      LEU  21   1.997  -5.717   6.897
  172    H    GLU  22           H        GLU  22  -2.293  -9.746   9.276
  173    HA   GLU  22           HA       GLU  22  -3.428  -8.711  11.654
  174   1HB   GLU  22          2HB       GLU  22  -4.001 -11.055   9.896
  175   2HB   GLU  22          1HB       GLU  22  -4.793 -10.931  11.460
  176   1HG   GLU  22          2HG       GLU  22  -5.555  -8.635  10.758
  177   2HG   GLU  22          1HG       GLU  22  -4.979  -9.034   9.141
  178    H    GLU  23           H        GLU  23  -1.215 -11.322  10.978
  179    HA   GLU  23           HA       GLU  23  -1.480 -12.538  13.572
  180   1HB   GLU  23          2HB       GLU  23  -0.849 -14.035  11.866
  181   2HB   GLU  23          1HB       GLU  23   0.355 -12.930  11.219
  182   1HG   GLU  23          2HG       GLU  23   1.950 -13.707  12.558
  183   2HG   GLU  23          1HG       GLU  23   0.891 -13.723  13.966
  184    H    GLU  24           H        GLU  24   0.602 -10.218  11.991
  185    HA   GLU  24           HA       GLU  24   2.519 -10.096  14.118
  186   1HB   GLU  24          2HB       GLU  24   2.031  -8.230  11.793
  187   2HB   GLU  24          1HB       GLU  24   3.413  -8.151  12.878
  188   1HG   GLU  24          2HG       GLU  24   2.792 -10.629  11.315
  189   2HG   GLU  24          1HG       GLU  24   3.713  -9.300  10.615
  190    H    GLY  25           H        GLY  25  -0.596  -8.856  13.693
  191   1HA   GLY  25          2HA       GLY  25  -1.782  -7.682  15.349
  192   2HA   GLY  25          1HA       GLY  25  -0.252  -7.134  16.019
  193    H    TYR  26           H        TYR  26  -2.054  -6.867  12.957
  194    HA   TYR  26           HA       TYR  26  -1.477  -3.980  12.993
  195   1HB   TYR  26          2HB       TYR  26  -1.234  -5.954  10.750
  196   2HB   TYR  26          1HB       TYR  26  -1.536  -4.257  10.408
  197    HD1  TYR  26           1HD      TYR  26   0.196  -2.639  10.589
  198    HD2  TYR  26           2HD      TYR  26   0.866  -6.630  11.897
  199    HE1  TYR  26           1HE      TYR  26   2.603  -2.173  10.756
  200    HE2  TYR  26           2HE      TYR  26   3.275  -6.176  12.070
  201    HH   TYR  26           HH       TYR  26   4.746  -4.136  12.394
  202    H    HIS  27           H        HIS  27  -2.895  -3.096  10.922
  203    HA   HIS  27           HA       HIS  27  -5.629  -4.092  11.229
  204   1HB   HIS  27          2HB       HIS  27  -4.628  -1.665  12.331
  205   2HB   HIS  27          1HB       HIS  27  -5.681  -1.234  10.993
  206    HD1  HIS  27           1HD      HIS  27  -6.255  -4.168  13.301
  207    HD2  HIS  27           2HD      HIS  27  -7.856  -0.425  12.468
  208    HE1  HIS  27           1HE      HIS  27  -8.398  -4.048  14.609
  209    HE2  HIS  27           2HE      HIS  27  -9.391  -1.806  14.026
  210    HA   PRO  28           HA       PRO  28  -4.266  -3.406   6.795
  211   1HB   PRO  28          2HB       PRO  28  -5.742  -5.945   6.495
  212   2HB   PRO  28          1HB       PRO  28  -4.145  -5.492   5.891
  213   1HG   PRO  28          2HG       PRO  28  -4.432  -7.212   7.927
  214   2HG   PRO  28          1HG       PRO  28  -3.090  -6.057   7.863
  215   1HD   PRO  28          2HD       PRO  28  -5.605  -5.945   9.479
  216   2HD   PRO  28          1HD       PRO  28  -3.955  -5.473   9.927
  217    H    ASP  29           H        ASP  29  -5.530  -2.230   5.520
  218    HA   ASP  29           HA       ASP  29  -8.422  -2.438   5.904
  219   1HB   ASP  29          2HB       ASP  29  -6.706  -0.183   5.876
  220   2HB   ASP  29          1HB       ASP  29  -7.836  -0.044   4.534
  221    H    THR  30           H        THR  30  -6.256  -3.500   3.870
  222    HA   THR  30           HA       THR  30  -6.164  -3.387   1.458
  223    HB   THR  30           HB       THR  30  -6.884  -5.552   0.910
  224    HG1  THR  30           1HG      THR  30  -9.029  -5.489   1.473
  225   1HG2  THR  30          1HG2      THR  30  -5.761  -6.765   2.417
  226   2HG2  THR  30          2HG2      THR  30  -6.711  -6.157   3.773
  227   3HG2  THR  30          3HG2      THR  30  -5.386  -5.191   3.121
  228    H    ALA  31           H        ALA  31  -6.972  -2.425  -0.221
  229    HA   ALA  31           HA       ALA  31  -9.872  -1.942  -0.354
  230   1HB   ALA  31          1HB       ALA  31  -9.480   0.117  -1.183
  231   2HB   ALA  31          2HB       ALA  31  -8.119  -0.423  -2.164
  232   3HB   ALA  31          3HB       ALA  31  -7.893  -0.096  -0.446
  233    H    LYS  32           H        LYS  32  -9.963  -1.250  -3.090
  234    HA   LYS  32           HA       LYS  32  -9.420  -3.865  -4.330
  235   1HB   LYS  32          2HB       LYS  32 -11.601  -1.918  -5.085
  236   2HB   LYS  32          1HB       LYS  32 -11.371  -3.541  -5.719
  237   1HG   LYS  32          2HG       LYS  32 -11.721  -4.383  -3.372
  238   2HG   LYS  32          1HG       LYS  32 -12.221  -2.745  -2.952
  239   1HD   LYS  32          2HD       LYS  32 -14.270  -3.540  -3.489
  240   2HD   LYS  32          1HD       LYS  32 -13.748  -3.152  -5.130
  241   1HE   LYS  32          2HE       LYS  32 -13.310  -5.845  -3.860
  242   2HE   LYS  32          1HE       LYS  32 -14.752  -5.448  -4.793
  243   1HZ   LYS  32          1HZ       LYS  32 -13.261  -4.888  -6.669
  244   2HZ   LYS  32          2HZ       LYS  32 -13.184  -6.516  -6.217
  245   3HZ   LYS  32          3HZ       LYS  32 -11.948  -5.455  -5.766
  246    H    THR  33           H        THR  33  -9.235  -0.396  -4.695
  247    HA   THR  33           HA       THR  33  -7.127  -0.580  -6.575
  248    HB   THR  33           HB       THR  33  -8.997   0.920  -8.098
  249    HG1  THR  33           1HG      THR  33 -10.749  -0.234  -8.137
  250   1HG2  THR  33          1HG2      THR  33  -7.054  -0.391  -8.943
  251   2HG2  THR  33          2HG2      THR  33  -8.553  -0.628  -9.840
  252   3HG2  THR  33          3HG2      THR  33  -8.008  -1.853  -8.695
  253    H    LEU  34           H        LEU  34  -7.231   1.864  -7.789
  254    HA   LEU  34           HA       LEU  34  -6.488   3.603  -5.700
  255   1HB   LEU  34          2HB       LEU  34  -7.217   4.401  -8.515
  256   2HB   LEU  34          1HB       LEU  34  -6.169   5.264  -7.404
  257    HG   LEU  34           HG       LEU  34  -5.563   2.562  -8.608
  258   1HD1  LEU  34          1HD1      LEU  34  -4.045   5.044  -9.239
  259   2HD1  LEU  34          2HD1      LEU  34  -5.574   4.739 -10.065
  260   3HD1  LEU  34          3HD1      LEU  34  -4.255   3.575 -10.192
  261   1HD2  LEU  34          1HD2      LEU  34  -4.623   3.236  -6.293
  262   2HD2  LEU  34          2HD2      LEU  34  -3.609   4.348  -7.212
  263   3HD2  LEU  34          3HD2      LEU  34  -3.518   2.614  -7.518
  264    H    ARG  35           H        ARG  35  -9.388   3.455  -7.741
  265    HA   ARG  35           HA       ARG  35 -10.678   5.728  -6.752
  266   1HB   ARG  35          2HB       ARG  35 -11.296   3.620  -8.516
  267   2HB   ARG  35          1HB       ARG  35 -12.575   3.623  -7.309
  268   1HG   ARG  35          2HG       ARG  35 -13.370   5.657  -7.952
  269   2HG   ARG  35          1HG       ARG  35 -11.794   6.223  -8.507
  270   1HD   ARG  35          2HD       ARG  35 -12.716   3.961 -10.057
  271   2HD   ARG  35          1HD       ARG  35 -13.887   5.279 -10.081
  272    HE   ARG  35           HE       ARG  35 -11.205   6.155 -10.576
  273   1HH1  ARG  35          1HH1      ARG  35 -14.055   4.778 -12.045
  274   2HH1  ARG  35          2HH1      ARG  35 -13.673   5.363 -13.629
  275   1HH2  ARG  35          1HH2      ARG  35 -10.702   6.927 -12.659
  276   2HH2  ARG  35          2HH2      ARG  35 -11.770   6.583 -13.978
  277    H    GLU  36           H        GLU  36 -10.943   2.336  -5.718
  278    HA   GLU  36           HA       GLU  36 -12.668   2.895  -3.527
  279   1HB   GLU  36          2HB       GLU  36 -11.509   0.580  -4.762
  280   2HB   GLU  36          1HB       GLU  36 -11.236   0.494  -3.027
  281   1HG   GLU  36          2HG       GLU  36 -13.953   1.156  -4.063
  282   2HG   GLU  36          1HG       GLU  36 -13.390  -0.515  -4.069
  283    H    ALA  37           H        ALA  37  -9.212   2.847  -3.977
  284    HA   ALA  37           HA       ALA  37  -8.569   2.826  -1.182
  285   1HB   ALA  37          1HB       ALA  37  -6.279   3.291  -1.926
  286   2HB   ALA  37          2HB       ALA  37  -6.867   3.546  -3.568
  287   3HB   ALA  37          3HB       ALA  37  -6.995   1.953  -2.823
  288    H    GLU  38           H        GLU  38  -9.338   5.248  -3.548
  289    HA   GLU  38           HA       GLU  38  -8.235   7.454  -2.091
  290   1HB   GLU  38          2HB       GLU  38 -10.067   7.183  -4.443
  291   2HB   GLU  38          1HB       GLU  38  -9.866   8.742  -3.657
  292   1HG   GLU  38          2HG       GLU  38  -7.390   8.474  -4.010
  293   2HG   GLU  38          1HG       GLU  38  -7.770   7.085  -5.026
  294    H    LYS  39           H        LYS  39 -11.369   5.891  -2.368
  295    HA   LYS  39           HA       LYS  39 -12.797   7.785  -0.799
  296   1HB   LYS  39          2HB       LYS  39 -14.008   6.318  -2.287
  297   2HB   LYS  39          1HB       LYS  39 -13.361   4.895  -1.485
  298   1HG   LYS  39          2HG       LYS  39 -14.980   6.852   0.076
  299   2HG   LYS  39          1HG       LYS  39 -15.785   5.700  -0.990
  300   1HD   LYS  39          2HD       LYS  39 -14.094   4.043   0.288
  301   2HD   LYS  39          1HD       LYS  39 -14.341   5.254   1.548
  302   1HE   LYS  39          2HE       LYS  39 -16.466   4.622   1.909
  303   2HE   LYS  39          1HE       LYS  39 -16.794   4.400   0.192
  304   1HZ   LYS  39          1HZ       LYS  39 -15.686   2.484   2.128
  305   2HZ   LYS  39          2HZ       LYS  39 -15.310   2.320   0.488
  306   3HZ   LYS  39          3HZ       LYS  39 -16.923   2.266   0.994
  307    H    LYS  40           H        LYS  40 -10.975   4.865  -0.115
  308    HA   LYS  40           HA       LYS  40 -11.752   4.703   2.635
  309   1HB   LYS  40          2HB       LYS  40  -9.404   3.450   1.202
  310   2HB   LYS  40          1HB       LYS  40  -9.971   3.017   2.808
  311   1HG   LYS  40          2HG       LYS  40 -12.113   2.877   0.882
  312   2HG   LYS  40          1HG       LYS  40 -10.741   1.886   0.388
  313   1HD   LYS  40          2HD       LYS  40 -11.683   0.344   1.732
  314   2HD   LYS  40          1HD       LYS  40 -10.899   1.261   3.020
  315   1HE   LYS  40          2HE       LYS  40 -13.108   2.673   2.925
  316   2HE   LYS  40          1HE       LYS  40 -13.764   1.210   2.190
  317   1HZ   LYS  40          1HZ       LYS  40 -14.068   1.254   4.600
  318   2HZ   LYS  40          2HZ       LYS  40 -12.393   1.329   4.823
  319   3HZ   LYS  40          3HZ       LYS  40 -13.092  -0.043   4.124
  320    H    ILE  41           H        ILE  41  -9.092   6.152   0.849
  321    HA   ILE  41           HA       ILE  41  -7.673   6.894   3.260
  322    HB   ILE  41           HB       ILE  41  -7.165   7.657   0.382
  323   1HG1  ILE  41          2HG1      ILE  41  -5.461   5.797   1.993
  324   2HG1  ILE  41          1HG1      ILE  41  -6.941   5.189   1.258
  325   1HG2  ILE  41          1HG2      ILE  41  -5.502   8.087   2.859
  326   2HG2  ILE  41          2HG2      ILE  41  -6.215   9.326   1.825
  327   3HG2  ILE  41          3HG2      ILE  41  -4.912   8.306   1.211
  328   1HD1  ILE  41          1HD1      ILE  41  -5.966   6.283  -0.900
  329   2HD1  ILE  41          2HD1      ILE  41  -5.393   4.706  -0.354
  330   3HD1  ILE  41          3HD1      ILE  41  -4.438   6.152  -0.028
  331    H    LYS  42           H        LYS  42 -10.094   8.247   1.218
  332    HA   LYS  42           HA       LYS  42  -9.637  10.982   1.601
  333   1HB   LYS  42          2HB       LYS  42 -11.734   9.314   0.550
  334   2HB   LYS  42          1HB       LYS  42 -12.402  10.660   1.462
  335   1HG   LYS  42          2HG       LYS  42 -10.238  11.331  -0.418
  336   2HG   LYS  42          1HG       LYS  42 -11.755  10.789  -1.139
  337   1HD   LYS  42          2HD       LYS  42 -12.979  12.528  -0.077
  338   2HD   LYS  42          1HD       LYS  42 -11.610  12.949   0.954
  339   1HE   LYS  42          2HE       LYS  42 -11.170  14.527  -0.567
  340   2HE   LYS  42          1HE       LYS  42 -10.554  13.207  -1.559
  341   1HZ   LYS  42          1HZ       LYS  42 -13.418  13.668  -1.701
  342   2HZ   LYS  42          2HZ       LYS  42 -12.317  13.298  -2.931
  343   3HZ   LYS  42          3HZ       LYS  42 -12.448  14.886  -2.362
  344    H    GLU  43           H        GLU  43 -10.719   8.585   3.792
  345    HA   GLU  43           HA       GLU  43 -11.386  10.684   5.733
  346   1HB   GLU  43          2HB       GLU  43 -12.735   7.987   5.608
  347   2HB   GLU  43          1HB       GLU  43 -13.144   9.331   6.665
  348   1HG   GLU  43          2HG       GLU  43 -13.854  10.644   4.747
  349   2HG   GLU  43          1HG       GLU  43 -13.406   9.325   3.667
  350    H    LEU  44           H        LEU  44 -10.337   7.328   5.282
  351    HA   LEU  44           HA       LEU  44  -9.334   7.152   7.983
  352   1HB   LEU  44          2HB       LEU  44 -10.067   5.324   5.980
  353   2HB   LEU  44          1HB       LEU  44  -8.350   5.081   6.235
  354    HG   LEU  44           HG       LEU  44  -9.704   3.581   7.622
  355   1HD1  LEU  44          1HD1      LEU  44  -8.277   3.690   9.365
  356   2HD1  LEU  44          2HD1      LEU  44  -8.590   5.401   9.655
  357   3HD1  LEU  44          3HD1      LEU  44  -7.490   4.911   8.366
  358   1HD2  LEU  44          1HD2      LEU  44 -11.141   4.379   9.344
  359   2HD2  LEU  44          2HD2      LEU  44 -11.620   5.182   7.848
  360   3HD2  LEU  44          3HD2      LEU  44 -10.665   6.051   9.049
  361    H    PHE  45           H        PHE  45  -7.431   7.880   8.621
  362    HA   PHE  45           HA       PHE  45  -5.453   8.725   6.688
  363   1HB   PHE  45          2HB       PHE  45  -6.001  10.069   8.721
  364   2HB   PHE  45          1HB       PHE  45  -5.312   8.787   9.711
  365    HD1  PHE  45           1HD      PHE  45  -4.606  11.558   7.457
  366    HD2  PHE  45           2HD      PHE  45  -2.913   8.386   9.733
  367    HE1  PHE  45           1HE      PHE  45  -2.381  12.586   7.229
  368    HE2  PHE  45           2HE      PHE  45  -0.685   9.408   9.510
  369    HZ   PHE  45           HZ       PHE  45  -0.418  11.511   8.256
  370    H    PHE  46           H        PHE  46  -4.733   6.780   5.783
  371    HA   PHE  46           HA       PHE  46  -3.700   4.673   7.437
  372   1HB   PHE  46          2HB       PHE  46  -3.634   5.147   4.459
  373   2HB   PHE  46          1HB       PHE  46  -2.917   3.732   5.223
  374    HD1  PHE  46           1HD      PHE  46  -5.412   4.332   3.235
  375    HD2  PHE  46           2HD      PHE  46  -4.920   3.084   7.272
  376    HE1  PHE  46           1HE      PHE  46  -7.592   3.196   3.142
  377    HE2  PHE  46           2HE      PHE  46  -7.099   1.942   7.187
  378    HZ   PHE  46           HZ       PHE  46  -8.438   2.001   5.120
  379    HA   PRO  47           HA       PRO  47   0.409   6.413   7.631
  380   1HB   PRO  47          2HB       PRO  47   1.452   4.252   9.064
  381   2HB   PRO  47          1HB       PRO  47   0.697   5.686   9.755
  382   1HG   PRO  47          2HG       PRO  47  -0.281   3.015   9.788
  383   2HG   PRO  47          1HG       PRO  47  -1.077   4.467  10.410
  384   1HD   PRO  47          2HD       PRO  47  -1.536   3.004   7.895
  385   2HD   PRO  47          1HD       PRO  47  -2.611   4.103   8.778
  386    H    VAL  48           H        VAL  48  -0.385   3.305   6.336
  387    HA   VAL  48           HA       VAL  48   1.941   3.408   4.593
  388    HB   VAL  48           HB       VAL  48   1.211   0.816   5.924
  389   1HG1  VAL  48          1HG1      VAL  48   3.372   1.804   4.148
  390   2HG1  VAL  48          2HG1      VAL  48   2.536   0.251   4.160
  391   3HG1  VAL  48          3HG1      VAL  48   3.789   0.588   5.354
  392   1HG2  VAL  48          1HG2      VAL  48   1.783   2.092   7.776
  393   2HG2  VAL  48          2HG2      VAL  48   3.018   2.989   6.895
  394   3HG2  VAL  48          3HG2      VAL  48   3.294   1.301   7.328
  395    H    ILE  49           H        ILE  49   1.431   2.884   2.571
  396    HA   ILE  49           HA       ILE  49  -1.114   1.496   2.066
  397    HB   ILE  49           HB       ILE  49   0.110   3.348   0.051
  398   1HG1  ILE  49          2HG1      ILE  49  -0.049   4.697   2.078
  399   2HG1  ILE  49          1HG1      ILE  49  -1.293   5.186   0.932
  400   1HG2  ILE  49          1HG2      ILE  49  -2.463   1.978   0.491
  401   2HG2  ILE  49          2HG2      ILE  49  -1.622   2.368  -1.009
  402   3HG2  ILE  49          3HG2      ILE  49  -2.555   3.609  -0.173
  403   1HD1  ILE  49          1HD1      ILE  49  -1.544   3.944   3.586
  404   2HD1  ILE  49          2HD1      ILE  49  -2.678   3.391   2.355
  405   3HD1  ILE  49          3HD1      ILE  49  -2.588   5.103   2.764
  406    H    VAL  50           H        VAL  50  -1.186   0.173   0.137
  407    HA   VAL  50           HA       VAL  50   1.370  -0.527  -1.066
  408    HB   VAL  50           HB       VAL  50  -0.339  -2.589   0.333
  409   1HG1  VAL  50          1HG1      VAL  50   2.263  -2.937  -1.155
  410   2HG1  VAL  50          2HG1      VAL  50   0.675  -3.399  -1.768
  411   3HG1  VAL  50          3HG1      VAL  50   1.338  -4.200  -0.344
  412   1HG2  VAL  50          1HG2      VAL  50   1.627  -2.890   1.777
  413   2HG2  VAL  50          2HG2      VAL  50   0.956  -1.262   1.898
  414   3HG2  VAL  50          3HG2      VAL  50   2.420  -1.545   0.955
  415    H    LEU  51           H        LEU  51   0.780  -0.028  -3.073
  416    HA   LEU  51           HA       LEU  51  -1.800  -0.843  -4.123
  417   1HB   LEU  51          2HB       LEU  51  -0.978   1.380  -4.651
  418   2HB   LEU  51          1HB       LEU  51   0.468   0.700  -5.375
  419    HG   LEU  51           HG       LEU  51  -0.971  -0.388  -7.101
  420   1HD1  LEU  51          1HD1      LEU  51  -3.263   0.298  -7.358
  421   2HD1  LEU  51          2HD1      LEU  51  -3.145   1.351  -5.948
  422   3HD1  LEU  51          3HD1      LEU  51  -3.045  -0.398  -5.751
  423   1HD2  LEU  51          1HD2      LEU  51  -1.011   2.608  -6.811
  424   2HD2  LEU  51          2HD2      LEU  51  -1.534   1.770  -8.272
  425   3HD2  LEU  51          3HD2      LEU  51   0.133   1.617  -7.717
  426    H    ASP  52           H        ASP  52  -1.992  -2.881  -4.732
  427    HA   ASP  52           HA       ASP  52   0.242  -4.293  -5.976
  428   1HB   ASP  52          2HB       ASP  52  -1.565  -5.149  -4.155
  429   2HB   ASP  52          1HB       ASP  52  -2.377  -5.639  -5.638
  430    H    VAL  53           H        VAL  53   0.334  -3.344  -8.000
  431    HA   VAL  53           HA       VAL  53  -1.909  -2.918  -9.665
  432    HB   VAL  53           HB       VAL  53  -0.289  -2.556 -11.469
  433   1HG1  VAL  53          1HG1      VAL  53   0.799  -0.658 -10.539
  434   2HG1  VAL  53          2HG1      VAL  53   0.753  -1.348  -8.916
  435   3HG1  VAL  53          3HG1      VAL  53  -0.741  -0.834  -9.698
  436   1HG2  VAL  53          1HG2      VAL  53   1.769  -3.419 -11.504
  437   2HG2  VAL  53          2HG2      VAL  53   1.273  -4.398 -10.125
  438   3HG2  VAL  53          3HG2      VAL  53   2.111  -2.870  -9.864
  439    H    TRP  54           H        TRP  54  -2.813  -5.177  -9.183
  440    HA   TRP  54           HA       TRP  54  -1.653  -7.427 -10.466
  441   1HB   TRP  54          2HB       TRP  54  -3.204  -7.843  -8.696
  442   2HB   TRP  54          1HB       TRP  54  -4.452  -6.870  -9.468
  443    HD1  TRP  54           HD       TRP  54  -2.419 -10.024 -10.513
  444    HE1  TRP  54           1HE      TRP  54  -4.060 -11.681 -11.597
  445    HE3  TRP  54           3HE      TRP  54  -6.719  -7.285 -10.143
  446    HZ2  TRP  54           2HZ      TRP  54  -6.809 -11.818 -12.214
  447    HZ3  TRP  54           3HZ      TRP  54  -8.811  -8.250 -11.005
  448    HH2  TRP  54           HH       TRP  54  -8.854 -10.470 -12.019
  449    H    MET  55           H        MET  55  -4.943  -6.719 -11.401
  450    HA   MET  55           HA       MET  55  -4.046  -6.207 -14.151
  451   1HB   MET  55          2HB       MET  55  -5.256  -8.559 -13.269
  452   2HB   MET  55          1HB       MET  55  -6.554  -7.666 -14.046
  453   1HG   MET  55          2HG       MET  55  -3.921  -8.457 -15.265
  454   2HG   MET  55          1HG       MET  55  -5.511  -9.117 -15.644
  455   1HE   MET  55          1HE       MET  55  -3.331  -8.135 -17.531
  456   2HE   MET  55          2HE       MET  55  -3.891  -6.855 -18.606
  457   3HE   MET  55          3HE       MET  55  -4.788  -8.370 -18.497
  458    HA   PRO  56           HA       PRO  56  -7.604  -3.407 -12.703
  459   1HB   PRO  56          2HB       PRO  56  -6.358  -1.257 -11.719
  460   2HB   PRO  56          1HB       PRO  56  -6.628  -2.691 -10.719
  461   1HG   PRO  56          2HG       PRO  56  -4.148  -1.833 -12.164
  462   2HG   PRO  56          1HG       PRO  56  -4.318  -2.459 -10.514
  463   1HD   PRO  56          2HD       PRO  56  -3.553  -3.992 -12.652
  464   2HD   PRO  56          1HD       PRO  56  -4.374  -4.634 -11.215
  465    H    ASP  57           H        ASP  57  -7.516  -0.755 -13.200
  466    HA   ASP  57           HA       ASP  57  -6.084  -0.263 -15.677
  467   1HB   ASP  57          2HB       ASP  57  -8.156  -1.402 -16.396
  468   2HB   ASP  57          1HB       ASP  57  -9.104  -0.162 -15.580
  469    H    GLY  58           H        GLY  58  -5.639   0.972 -13.292
  470   1HA   GLY  58          2HA       GLY  58  -6.883   3.626 -13.679
  471   2HA   GLY  58          1HA       GLY  58  -6.465   2.987 -12.097
  472    H    ASP  59           H        ASP  59  -5.449   5.316 -12.380
  473    HA   ASP  59           HA       ASP  59  -2.747   5.047 -13.503
  474   1HB   ASP  59          2HB       ASP  59  -4.167   7.569 -12.619
  475   2HB   ASP  59          1HB       ASP  59  -2.637   7.470 -13.487
  476    H    GLY  60           H        GLY  60  -1.643   4.005 -11.885
  477   1HA   GLY  60          2HA       GLY  60  -1.890   4.717  -9.127
  478   2HA   GLY  60          1HA       GLY  60  -0.669   3.663  -9.824
  479    H    VAL  61           H        VAL  61   0.216   5.719 -11.737
  480    HA   VAL  61           HA       VAL  61   2.324   6.818 -10.314
  481    HB   VAL  61           HB       VAL  61   1.133   7.976 -12.833
  482   1HG1  VAL  61          1HG1      VAL  61   3.735   8.221 -11.416
  483   2HG1  VAL  61          2HG1      VAL  61   2.768   9.454 -12.226
  484   3HG1  VAL  61          3HG1      VAL  61   3.710   8.307 -13.178
  485   1HG2  VAL  61          1HG2      VAL  61   2.886   5.572 -12.417
  486   2HG2  VAL  61          2HG2      VAL  61   2.855   6.453 -13.944
  487   3HG2  VAL  61          3HG2      VAL  61   1.384   5.695 -13.333
  488    H    ASN  62           H        ASN  62  -0.765   8.290 -11.251
  489    HA   ASN  62           HA       ASN  62  -0.115  10.780  -9.945
  490   1HB   ASN  62          2HB       ASN  62  -1.961   9.941 -11.915
  491   2HB   ASN  62          1HB       ASN  62  -2.912  10.547 -10.562
  492   1HD2  ASN  62          1HD2      ASN  62  -0.277  11.349 -12.754
  493   2HD2  ASN  62          2HD2      ASN  62  -0.518  13.059 -12.710
  494    H    PHE  63           H        PHE  63  -0.913   7.869  -8.708
  495    HA   PHE  63           HA       PHE  63  -2.853   8.792  -6.757
  496   1HB   PHE  63          2HB       PHE  63  -2.967   6.497  -7.756
  497   2HB   PHE  63          1HB       PHE  63  -1.475   6.106  -6.905
  498    HD1  PHE  63           1HD      PHE  63  -4.421   8.051  -5.749
  499    HD2  PHE  63           2HD      PHE  63  -2.080   4.523  -5.322
  500    HE1  PHE  63           1HE      PHE  63  -5.721   7.435  -3.754
  501    HE2  PHE  63           2HE      PHE  63  -3.377   3.900  -3.327
  502    HZ   PHE  63           HZ       PHE  63  -5.202   5.357  -2.543
  503    H    ILE  64           H        ILE  64   0.553   7.929  -6.925
  504    HA   ILE  64           HA       ILE  64   1.260   7.719  -4.288
  505    HB   ILE  64           HB       ILE  64   2.809   9.156  -6.449
  506   1HG1  ILE  64          2HG1      ILE  64   3.942   6.655  -5.963
  507   2HG1  ILE  64          1HG1      ILE  64   2.207   6.354  -5.935
  508   1HG2  ILE  64          1HG2      ILE  64   4.771   8.344  -4.974
  509   2HG2  ILE  64          2HG2      ILE  64   3.560   8.255  -3.694
  510   3HG2  ILE  64          3HG2      ILE  64   3.887   9.793  -4.495
  511   1HD1  ILE  64          1HD1      ILE  64   3.698   7.716  -8.166
  512   2HD1  ILE  64          2HD1      ILE  64   1.980   7.318  -8.140
  513   3HD1  ILE  64          3HD1      ILE  64   3.182   6.029  -8.153
  514    H    ASP  65           H        ASP  65   0.315  10.596  -6.018
  515    HA   ASP  65           HA       ASP  65   1.229  12.415  -3.987
  516   1HB   ASP  65          2HB       ASP  65   0.663  12.759  -6.598
  517   2HB   ASP  65          1HB       ASP  65  -0.872  13.273  -5.904
  518    H    PHE  66           H        PHE  66  -1.784  10.813  -4.826
  519    HA   PHE  66           HA       PHE  66  -3.533  12.261  -3.199
  520   1HB   PHE  66          2HB       PHE  66  -4.197  10.564  -4.912
  521   2HB   PHE  66          1HB       PHE  66  -3.680   9.302  -3.799
  522    HD1  PHE  66           1HD      PHE  66  -4.773   9.430  -1.408
  523    HD2  PHE  66           2HD      PHE  66  -6.401  11.199  -4.919
  524    HE1  PHE  66           1HE      PHE  66  -6.999   9.448  -0.362
  525    HE2  PHE  66           2HE      PHE  66  -8.631  11.220  -3.879
  526    HZ   PHE  66           HZ       PHE  66  -8.932  10.343  -1.597
  527    H    ILE  67           H        ILE  67  -1.461   9.491  -2.487
  528    HA   ILE  67           HA       ILE  67  -2.358   9.009   0.132
  529    HB   ILE  67           HB       ILE  67   0.287   8.457  -1.213
  530   1HG1  ILE  67          2HG1      ILE  67  -0.599   6.068  -0.878
  531   2HG1  ILE  67          1HG1      ILE  67  -2.146   6.822  -0.512
  532   1HG2  ILE  67          1HG2      ILE  67   1.122   8.383   0.888
  533   2HG2  ILE  67          2HG2      ILE  67   0.350   6.797   0.899
  534   3HG2  ILE  67          3HG2      ILE  67  -0.466   8.180   1.630
  535   1HD1  ILE  67          1HD1      ILE  67  -0.727   7.516  -3.039
  536   2HD1  ILE  67          2HD1      ILE  67  -2.451   7.548  -2.671
  537   3HD1  ILE  67          3HD1      ILE  67  -1.630   6.006  -2.916
  538    H    LYS  68           H        LYS  68   0.273  11.050  -1.112
  539    HA   LYS  68           HA       LYS  68   1.006  11.992   1.500
  540   1HB   LYS  68          2HB       LYS  68   1.728  13.286  -1.126
  541   2HB   LYS  68          1HB       LYS  68   2.611  13.353   0.394
  542   1HG   LYS  68          2HG       LYS  68   2.311  10.626  -0.467
  543   2HG   LYS  68          1HG       LYS  68   3.026  11.607  -1.748
  544   1HD   LYS  68          2HD       LYS  68   4.054  11.880   1.040
  545   2HD   LYS  68          1HD       LYS  68   4.535  10.480   0.080
  546   1HE   LYS  68          2HE       LYS  68   5.534  11.841  -1.575
  547   2HE   LYS  68          1HE       LYS  68   4.782  13.300  -0.933
  548   1HZ   LYS  68          1HZ       LYS  68   6.162  13.141   1.019
  549   2HZ   LYS  68          2HZ       LYS  68   7.142  13.122  -0.359
  550   3HZ   LYS  68          3HZ       LYS  68   6.835  11.685   0.480
  551    H    GLU  69           H        GLU  69  -1.349  12.845  -0.845
  552    HA   GLU  69           HA       GLU  69  -1.644  15.591  -0.213
  553   1HB   GLU  69          2HB       GLU  69  -2.512  14.358  -2.267
  554   2HB   GLU  69          1HB       GLU  69  -3.824  13.793  -1.243
  555   1HG   GLU  69          2HG       GLU  69  -4.430  16.138  -0.783
  556   2HG   GLU  69          1HG       GLU  69  -3.165  16.656  -1.896
  557    H    ASN  70           H        ASN  70  -3.200  12.643   0.955
  558    HA   ASN  70           HA       ASN  70  -4.391  14.224   3.139
  559   1HB   ASN  70          2HB       ASN  70  -5.516  11.580   2.272
  560   2HB   ASN  70          1HB       ASN  70  -6.314  12.900   3.122
  561   1HD2  ASN  70          1HD2      ASN  70  -4.828  12.074   0.022
  562   2HD2  ASN  70          2HD2      ASN  70  -5.886  13.038  -0.943
  563    H    SER  71           H        SER  71  -1.790  12.566   2.737
  564    HA   SER  71           HA       SER  71  -1.707  11.576   5.417
  565   1HB   SER  71          2HB       SER  71  -2.345   9.730   3.268
  566   2HB   SER  71          1HB       SER  71  -0.852   9.271   4.084
  567    HG   SER  71           HG       SER  71  -2.111   8.495   5.565
  568    HA   PRO  72           HA       PRO  72   2.288  12.959   3.429
  569   1HB   PRO  72          2HB       PRO  72   2.452  14.781   5.711
  570   2HB   PRO  72          1HB       PRO  72   2.534  15.146   3.985
  571   1HG   PRO  72          2HG       PRO  72   0.419  15.843   5.519
  572   2HG   PRO  72          1HG       PRO  72   0.260  15.428   3.802
  573   1HD   PRO  72          2HD       PRO  72  -0.329  13.762   6.220
  574   2HD   PRO  72          1HD       PRO  72  -1.237  13.904   4.699
  575    H    ASP  73           H        ASP  73   1.261  11.970   6.539
  576    HA   ASP  73           HA       ASP  73   3.995  11.264   7.330
  577   1HB   ASP  73          2HB       ASP  73   2.437  12.583   8.875
  578   2HB   ASP  73          1HB       ASP  73   1.567  11.066   9.089
  579    H    SER  74           H        SER  74   2.396   9.835   5.319
  580    HA   SER  74           HA       SER  74   2.038   7.238   6.649
  581   1HB   SER  74          2HB       SER  74   0.057   8.076   5.458
  582   2HB   SER  74          1HB       SER  74   0.998   8.210   3.975
  583    HG   SER  74           HG       SER  74   0.276   6.248   3.680
  584    H    VAL  75           H        VAL  75   2.179   5.754   4.161
  585    HA   VAL  75           HA       VAL  75   4.816   6.250   3.081
  586    HB   VAL  75           HB       VAL  75   4.322   3.655   4.552
  587   1HG1  VAL  75          1HG1      VAL  75   6.383   4.646   2.660
  588   2HG1  VAL  75          2HG1      VAL  75   5.777   3.011   2.921
  589   3HG1  VAL  75          3HG1      VAL  75   6.954   3.704   4.037
  590   1HG2  VAL  75          1HG2      VAL  75   4.680   5.377   6.174
  591   2HG2  VAL  75          2HG2      VAL  75   6.024   6.048   5.250
  592   3HG2  VAL  75          3HG2      VAL  75   6.184   4.467   6.017
  593    H    VAL  76           H        VAL  76   5.056   5.457   1.080
  594    HA   VAL  76           HA       VAL  76   2.909   3.699   0.074
  595    HB   VAL  76           HB       VAL  76   4.394   5.719  -1.597
  596   1HG1  VAL  76          1HG1      VAL  76   3.467   4.384  -3.163
  597   2HG1  VAL  76          2HG1      VAL  76   2.023   5.329  -2.805
  598   3HG1  VAL  76          3HG1      VAL  76   2.251   3.748  -2.057
  599   1HG2  VAL  76          1HG2      VAL  76   2.108   6.068   0.229
  600   2HG2  VAL  76          2HG2      VAL  76   1.918   6.765  -1.380
  601   3HG2  VAL  76          3HG2      VAL  76   3.279   7.246  -0.366
  602    H    ILE  77           H        ILE  77   3.717   1.726  -0.180
  603    HA   ILE  77           HA       ILE  77   6.482   1.383  -1.055
  604    HB   ILE  77           HB       ILE  77   4.455  -0.691  -0.198
  605   1HG1  ILE  77          2HG1      ILE  77   5.140   0.881   1.600
  606   2HG1  ILE  77          1HG1      ILE  77   5.674  -0.770   1.901
  607   1HG2  ILE  77          1HG2      ILE  77   6.184  -1.555  -1.730
  608   2HG2  ILE  77          2HG2      ILE  77   6.311  -2.239  -0.110
  609   3HG2  ILE  77          3HG2      ILE  77   7.427  -0.974  -0.622
  610   1HD1  ILE  77          1HD1      ILE  77   7.652   0.796   0.467
  611   2HD1  ILE  77          2HD1      ILE  77   7.812  -0.168   1.935
  612   3HD1  ILE  77          3HD1      ILE  77   7.225   1.493   2.029
  613    H    VAL  78           H        VAL  78   3.246   0.198  -1.984
  614    HA   VAL  78           HA       VAL  78   2.409  -0.559  -3.967
  615    HB   VAL  78           HB       VAL  78   4.451   1.283  -5.217
  616   1HG1  VAL  78          1HG1      VAL  78   2.285   1.471  -6.776
  617   2HG1  VAL  78          2HG1      VAL  78   2.078  -0.181  -6.197
  618   3HG1  VAL  78          3HG1      VAL  78   3.558   0.279  -7.039
  619   1HG2  VAL  78          1HG2      VAL  78   1.659   1.959  -4.300
  620   2HG2  VAL  78          2HG2      VAL  78   2.820   3.051  -5.056
  621   3HG2  VAL  78          3HG2      VAL  78   3.135   2.407  -3.445
  622    H    ILE  79           H        ILE  79   3.029  -2.689  -3.946
  623    HA   ILE  79           HA       ILE  79   5.632  -3.404  -5.066
  624    HB   ILE  79           HB       ILE  79   3.683  -5.488  -4.191
  625   1HG1  ILE  79          2HG1      ILE  79   5.338  -3.876  -2.243
  626   2HG1  ILE  79          1HG1      ILE  79   3.599  -3.707  -2.444
  627   1HG2  ILE  79          1HG2      ILE  79   5.492  -6.752  -4.426
  628   2HG2  ILE  79          2HG2      ILE  79   6.300  -5.833  -3.157
  629   3HG2  ILE  79          3HG2      ILE  79   6.447  -5.330  -4.841
  630   1HD1  ILE  79          1HD1      ILE  79   3.237  -5.382  -1.050
  631   2HD1  ILE  79          2HD1      ILE  79   4.973  -5.450  -0.744
  632   3HD1  ILE  79          3HD1      ILE  79   4.259  -6.455  -2.005
  633    H    THR  80           H        THR  80   4.738  -5.987  -6.109
  634    HA   THR  80           HA       THR  80   3.972  -6.922  -8.031
  635    HB   THR  80           HB       THR  80   2.008  -4.657  -8.316
  636    HG1  THR  80           1HG      THR  80   1.918  -5.308  -6.149
  637   1HG2  THR  80          1HG2      THR  80   0.566  -6.220  -9.273
  638   2HG2  THR  80          2HG2      THR  80   1.511  -7.587  -8.683
  639   3HG2  THR  80          3HG2      THR  80   2.142  -6.573  -9.982
  640    H    GLY  81           H        GLY  81   5.996  -6.375  -9.016
  641   1HA   GLY  81          2HA       GLY  81   5.852  -4.075 -10.859
  642   2HA   GLY  81          1HA       GLY  81   7.345  -4.768 -10.247
  643    H    HIS  82           H        HIS  82   7.650  -4.592 -12.712
  644    HA   HIS  82           HA       HIS  82   6.898  -7.187 -13.882
  645   1HB   HIS  82          2HB       HIS  82   6.578  -4.460 -14.977
  646   2HB   HIS  82          1HB       HIS  82   7.234  -5.652 -16.095
  647    HD1  HIS  82           1HD      HIS  82   4.286  -5.448 -13.685
  648    HD2  HIS  82           2HD      HIS  82   5.289  -6.970 -17.420
  649    HE1  HIS  82           1HE      HIS  82   2.172  -6.473 -14.584
  650    HE2  HIS  82           2HE      HIS  82   2.827  -7.467 -16.805
  651    H    GLY  83           H        GLY  83   8.363  -7.301 -16.091
  652   1HA   GLY  83          2HA       GLY  83  11.019  -7.669 -15.084
  653   2HA   GLY  83          1HA       GLY  83  10.476  -7.974 -16.728
  654    H    SER  84           H        SER  84   9.426  -5.202 -16.963
  655    HA   SER  84           HA       SER  84  11.835  -4.009 -17.951
  656   1HB   SER  84          2HB       SER  84   9.182  -3.792 -18.613
  657   2HB   SER  84          1HB       SER  84   9.470  -2.271 -17.769
  658    HG   SER  84           HG       SER  84   9.921  -2.156 -20.029
  659    H    VAL  85           H        VAL  85   9.743  -3.525 -15.172
  660    HA   VAL  85           HA       VAL  85  10.018  -2.354 -13.239
  661    HB   VAL  85           HB       VAL  85  12.895  -1.945 -14.051
  662   1HG1  VAL  85          1HG1      VAL  85  12.657  -0.690 -12.161
  663   2HG1  VAL  85          2HG1      VAL  85  12.994  -2.256 -11.424
  664   3HG1  VAL  85          3HG1      VAL  85  11.333  -1.675 -11.539
  665   1HG2  VAL  85          1HG2      VAL  85  11.561  -4.343 -12.816
  666   2HG2  VAL  85          2HG2      VAL  85  13.292  -4.037 -12.681
  667   3HG2  VAL  85          3HG2      VAL  85  12.560  -4.276 -14.268
  668    H    ASP  86           H        ASP  86   9.214  -0.997 -15.664
  669    HA   ASP  86           HA       ASP  86  10.430   1.650 -15.402
  670   1HB   ASP  86          2HB       ASP  86   9.171   2.221 -17.429
  671   2HB   ASP  86          1HB       ASP  86  10.125   0.761 -17.672
  672    H    THR  87           H        THR  87   7.716  -0.084 -14.293
  673    HA   THR  87           HA       THR  87   6.024   2.245 -13.981
  674    HB   THR  87           HB       THR  87   5.320  -0.281 -14.314
  675    HG1  THR  87           1HG      THR  87   3.346   0.242 -13.276
  676   1HG2  THR  87          1HG2      THR  87   6.481  -0.827 -12.032
  677   2HG2  THR  87          2HG2      THR  87   4.951  -1.585 -12.475
  678   3HG2  THR  87          3HG2      THR  87   4.967  -0.217 -11.362
  679    H    ALA  88           H        ALA  88   8.205   0.286 -12.089
  680    HA   ALA  88           HA       ALA  88   7.605   1.236  -9.524
  681   1HB   ALA  88          1HB       ALA  88   9.982   0.607  -9.011
  682   2HB   ALA  88          2HB       ALA  88  10.189   0.252 -10.725
  683   3HB   ALA  88          3HB       ALA  88   9.029  -0.669  -9.769
  684    H    VAL  89           H        VAL  89  10.198   2.244 -11.724
  685    HA   VAL  89           HA       VAL  89  11.072   4.455 -10.280
  686    HB   VAL  89           HB       VAL  89  12.146   5.210 -12.318
  687   1HG1  VAL  89          1HG1      VAL  89  12.655   2.885 -11.071
  688   2HG1  VAL  89          2HG1      VAL  89  13.624   3.504 -12.409
  689   3HG1  VAL  89          3HG1      VAL  89  12.376   2.295 -12.709
  690   1HG2  VAL  89          1HG2      VAL  89  11.613   3.553 -14.359
  691   2HG2  VAL  89          2HG2      VAL  89  10.785   5.092 -14.125
  692   3HG2  VAL  89          3HG2      VAL  89  10.026   3.592 -13.592
  693    H    LYS  90           H        LYS  90   8.345   4.075 -12.423
  694    HA   LYS  90           HA       LYS  90   7.883   6.874 -12.800
  695   1HB   LYS  90          2HB       LYS  90   7.123   5.103 -14.378
  696   2HB   LYS  90          1HB       LYS  90   5.952   4.587 -13.173
  697   1HG   LYS  90          2HG       LYS  90   4.750   6.619 -13.339
  698   2HG   LYS  90          1HG       LYS  90   6.031   7.374 -14.290
  699   1HD   LYS  90          2HD       LYS  90   4.498   4.954 -15.217
  700   2HD   LYS  90          1HD       LYS  90   4.007   6.608 -15.589
  701   1HE   LYS  90          2HE       LYS  90   5.301   6.386 -17.402
  702   2HE   LYS  90          1HE       LYS  90   6.648   6.622 -16.289
  703   1HZ   LYS  90          1HZ       LYS  90   6.644   4.592 -17.853
  704   2HZ   LYS  90          2HZ       LYS  90   5.562   3.922 -16.739
  705   3HZ   LYS  90          3HZ       LYS  90   7.112   4.379 -16.240
  706    H    ALA  91           H        ALA  91   7.504   4.904 -10.134
  707    HA   ALA  91           HA       ALA  91   5.431   6.685  -9.032
  708   1HB   ALA  91          1HB       ALA  91   4.669   4.800  -7.637
  709   2HB   ALA  91          2HB       ALA  91   5.812   3.746  -8.470
  710   3HB   ALA  91          3HB       ALA  91   4.481   4.486  -9.362
  711    H    ILE  92           H        ILE  92   8.223   4.628  -8.266
  712    HA   ILE  92           HA       ILE  92   8.502   5.548  -5.602
  713    HB   ILE  92           HB       ILE  92  10.436   4.281  -5.451
  714   1HG1  ILE  92          2HG1      ILE  92  10.818   4.646  -8.430
  715   2HG1  ILE  92          1HG1      ILE  92  11.773   5.388  -7.154
  716   1HG2  ILE  92          1HG2      ILE  92   9.622   2.644  -7.711
  717   2HG2  ILE  92          2HG2      ILE  92   8.259   3.178  -6.728
  718   3HG2  ILE  92          3HG2      ILE  92   9.588   2.292  -5.985
  719   1HD1  ILE  92          1HD1      ILE  92  12.703   3.287  -6.529
  720   2HD1  ILE  92          2HD1      ILE  92  12.863   3.459  -8.278
  721   3HD1  ILE  92          3HD1      ILE  92  11.604   2.423  -7.604
  722    H    LYS  93           H        LYS  93  10.201   6.871  -4.733
  723    HA   LYS  93           HA       LYS  93  11.666   8.632  -4.660
  724   1HB   LYS  93          2HB       LYS  93  11.420   8.855  -7.665
  725   2HB   LYS  93          1HB       LYS  93  12.636   9.602  -6.641
  726   1HG   LYS  93          2HG       LYS  93  12.752   6.831  -6.147
  727   2HG   LYS  93          1HG       LYS  93  12.667   7.042  -7.896
  728   1HD   LYS  93          2HD       LYS  93  14.489   8.911  -6.581
  729   2HD   LYS  93          1HD       LYS  93  14.943   7.219  -6.372
  730   1HE   LYS  93          2HE       LYS  93  15.985   7.595  -8.350
  731   2HE   LYS  93          1HE       LYS  93  14.392   7.175  -8.979
  732   1HZ   LYS  93          1HZ       LYS  93  15.695   9.393  -9.642
  733   2HZ   LYS  93          2HZ       LYS  93  14.799   9.977  -8.330
  734   3HZ   LYS  93          3HZ       LYS  93  14.008   9.274  -9.649
  735    H    LYS  94           H        LYS  94   9.024   8.998  -7.003
  736    HA   LYS  94           HA       LYS  94   8.637  11.761  -6.597
  737   1HB   LYS  94          2HB       LYS  94   6.762   9.616  -7.592
  738   2HB   LYS  94          1HB       LYS  94   6.385  11.333  -7.611
  739   1HG   LYS  94          2HG       LYS  94   8.779  11.321  -8.877
  740   2HG   LYS  94          1HG       LYS  94   8.121   9.760  -9.372
  741   1HD   LYS  94          2HD       LYS  94   7.467  11.420 -10.984
  742   2HD   LYS  94          1HD       LYS  94   6.040  10.923 -10.074
  743   1HE   LYS  94          2HE       LYS  94   5.697  13.132  -9.846
  744   2HE   LYS  94          1HE       LYS  94   6.912  13.006  -8.574
  745   1HZ   LYS  94          1HZ       LYS  94   8.607  13.625 -10.177
  746   2HZ   LYS  94          2HZ       LYS  94   7.403  14.811 -10.104
  747   3HZ   LYS  94          3HZ       LYS  94   7.447  13.732 -11.404
  748    H    GLY  95           H        GLY  95   7.900   9.057  -4.654
  749   1HA   GLY  95          2HA       GLY  95   7.004  10.549  -2.481
  750   2HA   GLY  95          1HA       GLY  95   5.577   9.997  -3.343
  751    H    ALA  96           H        ALA  96   6.942   7.495  -4.190
  752    HA   ALA  96           HA       ALA  96   6.222   5.928  -1.914
  753   1HB   ALA  96          1HB       ALA  96   6.022   4.278  -3.395
  754   2HB   ALA  96          2HB       ALA  96   7.678   4.484  -3.965
  755   3HB   ALA  96          3HB       ALA  96   6.385   5.478  -4.636
  756    H    TYR  97           H        TYR  97   7.779   4.000  -1.405
  757    HA   TYR  97           HA       TYR  97  10.313   5.215  -0.576
  758   1HB   TYR  97          2HB       TYR  97   9.263   4.462   1.352
  759   2HB   TYR  97          1HB       TYR  97   8.568   3.058   0.553
  760    HD1  TYR  97           1HD      TYR  97  11.779   4.460   1.802
  761    HD2  TYR  97           2HD      TYR  97   9.605   0.965   0.728
  762    HE1  TYR  97           1HE      TYR  97  13.583   3.063   2.716
  763    HE2  TYR  97           2HE      TYR  97  11.401  -0.442   1.641
  764    HH   TYR  97           HH       TYR  97  13.268  -0.086   3.472
  765    H    GLU  98           H        GLU  98   9.085   3.139  -2.869
  766    HA   GLU  98           HA       GLU  98  10.921   2.513  -4.518
  767   1HB   GLU  98          2HB       GLU  98  12.385   0.685  -3.812
  768   2HB   GLU  98          1HB       GLU  98  12.639   2.102  -2.808
  769   1HG   GLU  98          2HG       GLU  98  10.902   0.913  -1.242
  770   2HG   GLU  98          1HG       GLU  98  11.420  -0.524  -2.122
  771    H    PHE  99           H        PHE  99  10.998   0.162  -5.401
  772    HA   PHE  99           HA       PHE  99   8.287  -0.931  -5.110
  773   1HB   PHE  99          2HB       PHE  99   9.914  -0.349  -7.375
  774   2HB   PHE  99          1HB       PHE  99   9.663  -2.090  -7.327
  775    HD1  PHE  99           1HD      PHE  99   7.940  -2.813  -8.640
  776    HD2  PHE  99           2HD      PHE  99   7.584   0.948  -6.679
  777    HE1  PHE  99           1HE      PHE  99   5.706  -2.514  -9.628
  778    HE2  PHE  99           2HE      PHE  99   5.348   1.253  -7.664
  779    HZ   PHE  99           HZ       PHE  99   4.408  -0.479  -9.140
  780    H    LEU 100           H        LEU 100   8.468  -2.350  -3.429
  781    HA   LEU 100           HA       LEU 100  10.602  -4.003  -2.821
  782   1HB   LEU 100          2HB       LEU 100   8.599  -3.512  -1.409
  783   2HB   LEU 100          1HB       LEU 100   7.684  -4.626  -2.403
  784    HG   LEU 100           HG       LEU 100   8.925  -6.494  -1.626
  785   1HD1  LEU 100          1HD1      LEU 100  10.811  -6.208  -0.017
  786   2HD1  LEU 100          2HD1      LEU 100  10.780  -4.479  -0.367
  787   3HD1  LEU 100          3HD1      LEU 100  11.158  -5.633  -1.648
  788   1HD2  LEU 100          1HD2      LEU 100   8.844  -5.880   0.987
  789   2HD2  LEU 100          2HD2      LEU 100   7.414  -6.246   0.025
  790   3HD2  LEU 100          3HD2      LEU 100   7.864  -4.569   0.334
  791    H    GLU 101           H        GLU 101  11.465  -4.945  -4.680
  792    HA   GLU 101           HA       GLU 101   9.802  -7.024  -5.942
  793   1HB   GLU 101          2HB       GLU 101  11.872  -5.174  -7.010
  794   2HB   GLU 101          1HB       GLU 101  11.795  -6.788  -7.703
  795   1HG   GLU 101          2HG       GLU 101   9.259  -6.274  -7.937
  796   2HG   GLU 101          1HG       GLU 101   9.777  -4.596  -7.780
  797    H    LYS 102           H        LYS 102  12.596  -6.422  -4.048
  798    HA   LYS 102           HA       LYS 102  14.264  -8.536  -4.696
  799   1HB   LYS 102          2HB       LYS 102  14.194  -6.581  -2.735
  800   2HB   LYS 102          1HB       LYS 102  14.108  -8.080  -1.820
  801   1HG   LYS 102          2HG       LYS 102  16.148  -8.867  -2.820
  802   2HG   LYS 102          1HG       LYS 102  16.206  -7.464  -3.889
  803   1HD   LYS 102          2HD       LYS 102  16.673  -5.996  -2.116
  804   2HD   LYS 102          1HD       LYS 102  16.181  -7.175  -0.899
  805   1HE   LYS 102          2HE       LYS 102  18.118  -8.475  -1.229
  806   2HE   LYS 102          1HE       LYS 102  18.515  -7.643  -2.732
  807   1HZ   LYS 102          1HZ       LYS 102  19.920  -6.943  -0.873
  808   2HZ   LYS 102          2HZ       LYS 102  18.555  -6.398  -0.035
  809   3HZ   LYS 102          3HZ       LYS 102  19.010  -5.656  -1.486
  810    HA   PRO 103           HA       PRO 103  11.826 -11.183  -1.334
  811   1HB   PRO 103          2HB       PRO 103   9.172  -9.884  -1.669
  812   2HB   PRO 103          1HB       PRO 103   9.935 -10.528  -0.211
  813   1HG   PRO 103          2HG       PRO 103   9.782  -7.905  -0.602
  814   2HG   PRO 103          1HG       PRO 103  11.240  -8.630   0.100
  815   1HD   PRO 103          2HD       PRO 103  10.764  -7.653  -2.689
  816   2HD   PRO 103          1HD       PRO 103  12.212  -7.502  -1.673
  817    H    PHE 104           H        PHE 104   9.331 -12.274  -1.712
  818    HA   PHE 104           HA       PHE 104   8.844 -12.639  -4.539
  819   1HB   PHE 104          2HB       PHE 104  10.110 -14.763  -2.832
  820   2HB   PHE 104          1HB       PHE 104   9.084 -15.202  -4.192
  821    HD1  PHE 104           1HD      PHE 104  12.251 -13.672  -3.181
  822    HD2  PHE 104           2HD      PHE 104   9.802 -14.840  -6.460
  823    HE1  PHE 104           1HE      PHE 104  14.166 -13.403  -4.702
  824    HE2  PHE 104           2HE      PHE 104  11.713 -14.574  -7.987
  825    HZ   PHE 104           HZ       PHE 104  13.898 -13.854  -7.108
  826    H    SER 105           H        SER 105   8.207 -13.822  -1.254
  827    HA   SER 105           HA       SER 105   5.440 -14.403  -2.029
  828   1HB   SER 105          2HB       SER 105   6.176 -15.063   0.722
  829   2HB   SER 105          1HB       SER 105   5.476 -16.086  -0.533
  830    HG   SER 105           HG       SER 105   7.548 -16.409  -1.363
  831    H    VAL 106           H        VAL 106   6.873 -13.257   1.025
  832    HA   VAL 106           HA       VAL 106   5.798 -10.684   1.012
  833    HB   VAL 106           HB       VAL 106   3.608 -11.764   0.990
  834   1HG1  VAL 106          1HG1      VAL 106   4.076 -12.919   3.699
  835   2HG1  VAL 106          2HG1      VAL 106   4.599 -13.812   2.272
  836   3HG1  VAL 106          3HG1      VAL 106   2.901 -13.376   2.467
  837   1HG2  VAL 106          1HG2      VAL 106   4.214 -10.549   3.685
  838   2HG2  VAL 106          2HG2      VAL 106   2.628 -10.658   2.919
  839   3HG2  VAL 106          3HG2      VAL 106   3.885  -9.647   2.205
  840    H    GLU 107           H        GLU 107   6.545 -13.521   2.967
  841    HA   GLU 107           HA       GLU 107   6.901 -12.687   5.466
  842   1HB   GLU 107          2HB       GLU 107   7.602 -14.895   4.407
  843   2HB   GLU 107          1HB       GLU 107   9.151 -14.126   4.093
  844   1HG   GLU 107          2HG       GLU 107   8.848 -13.571   6.713
  845   2HG   GLU 107          1HG       GLU 107   7.999 -15.111   6.604
  846    H    ARG 108           H        ARG 108   9.197 -11.932   2.860
  847    HA   ARG 108           HA       ARG 108  11.022 -10.517   4.501
  848   1HB   ARG 108          2HB       ARG 108  11.441 -11.464   2.174
  849   2HB   ARG 108          1HB       ARG 108  10.595 -10.053   1.553
  850   1HG   ARG 108          2HG       ARG 108  12.576  -9.052   1.518
  851   2HG   ARG 108          1HG       ARG 108  12.444  -8.962   3.275
  852   1HD   ARG 108          2HD       ARG 108  14.105 -10.421   3.557
  853   2HD   ARG 108          1HD       ARG 108  13.397 -11.554   2.408
  854    HE   ARG 108           HE       ARG 108  14.473  -9.674   0.804
  855   1HH1  ARG 108          1HH1      ARG 108  15.758 -11.521   3.472
  856   2HH1  ARG 108          2HH1      ARG 108  17.377 -11.519   2.856
  857   1HH2  ARG 108          1HH2      ARG 108  16.601  -9.672  -0.008
  858   2HH2  ARG 108          2HH2      ARG 108  17.856 -10.470   0.881
  859    H    PHE 109           H        PHE 109   8.286  -9.509   2.506
  860    HA   PHE 109           HA       PHE 109   8.542  -6.758   2.663
  861   1HB   PHE 109          2HB       PHE 109   6.888  -7.730   1.220
  862   2HB   PHE 109          1HB       PHE 109   6.072  -8.497   2.574
  863    HD1  PHE 109           1HD      PHE 109   7.286  -5.001   2.388
  864    HD2  PHE 109           2HD      PHE 109   3.923  -7.607   2.394
  865    HE1  PHE 109           1HE      PHE 109   5.786  -3.059   2.581
  866    HE2  PHE 109           2HE      PHE 109   2.417  -5.672   2.586
  867    HZ   PHE 109           HZ       PHE 109   3.349  -3.394   2.680
  868    H    LEU 110           H        LEU 110   7.431  -9.030   5.067
  869    HA   LEU 110           HA       LEU 110   6.085  -7.339   6.812
  870   1HB   LEU 110          2HB       LEU 110   6.815  -9.969   6.803
  871   2HB   LEU 110          1HB       LEU 110   7.763  -9.327   8.129
  872    HG   LEU 110           HG       LEU 110   4.810  -8.818   7.951
  873   1HD1  LEU 110          1HD1      LEU 110   6.032 -11.112   9.457
  874   2HD1  LEU 110          2HD1      LEU 110   5.359 -11.289   7.836
  875   3HD1  LEU 110          3HD1      LEU 110   4.326 -10.773   9.168
  876   1HD2  LEU 110          1HD2      LEU 110   6.727  -7.804   9.594
  877   2HD2  LEU 110          2HD2      LEU 110   6.155  -9.185  10.529
  878   3HD2  LEU 110          3HD2      LEU 110   5.019  -7.943  10.006
  879    H    LEU 111           H        LEU 111   9.540  -8.072   6.614
  880    HA   LEU 111           HA       LEU 111  10.405  -6.690   8.865
  881   1HB   LEU 111          2HB       LEU 111  11.794  -7.129   6.229
  882   2HB   LEU 111          1HB       LEU 111  12.585  -6.497   7.660
  883    HG   LEU 111           HG       LEU 111  11.414  -8.838   8.566
  884   1HD1  LEU 111          1HD1      LEU 111  10.900  -9.478   6.254
  885   2HD1  LEU 111          2HD1      LEU 111  12.075 -10.563   6.996
  886   3HD1  LEU 111          3HD1      LEU 111  12.610  -9.340   5.844
  887   1HD2  LEU 111          1HD2      LEU 111  13.749  -7.759   8.872
  888   2HD2  LEU 111          2HD2      LEU 111  14.213  -8.777   7.508
  889   3HD2  LEU 111          3HD2      LEU 111  13.590  -9.513   8.987
  890    H    THR 112           H        THR 112  10.311  -5.502   5.500
  891    HA   THR 112           HA       THR 112  11.145  -2.902   6.008
  892    HB   THR 112           HB       THR 112   9.213  -3.849   3.883
  893    HG1  THR 112           1HG      THR 112  11.063  -4.968   3.601
  894   1HG2  THR 112          1HG2      THR 112   9.619  -1.953   2.653
  895   2HG2  THR 112          2HG2      THR 112  11.093  -1.563   3.541
  896   3HG2  THR 112          3HG2      THR 112   9.518  -1.309   4.292
  897    H    ILE 113           H        ILE 113   7.879  -4.266   6.069
  898    HA   ILE 113           HA       ILE 113   6.305  -2.059   6.262
  899    HB   ILE 113           HB       ILE 113   6.120  -4.774   7.455
  900   1HG1  ILE 113          2HG1      ILE 113   5.386  -4.266   5.148
  901   2HG1  ILE 113          1HG1      ILE 113   4.064  -4.848   6.155
  902   1HG2  ILE 113          1HG2      ILE 113   4.418  -2.461   8.347
  903   2HG2  ILE 113          2HG2      ILE 113   5.328  -3.598   9.344
  904   3HG2  ILE 113          3HG2      ILE 113   3.893  -4.141   8.472
  905   1HD1  ILE 113          1HD1      ILE 113   4.030  -2.070   6.415
  906   2HD1  ILE 113          2HD1      ILE 113   2.902  -3.082   5.515
  907   3HD1  ILE 113          3HD1      ILE 113   4.306  -2.391   4.702
  908    H    LYS 114           H        LYS 114   7.864  -3.622   9.076
  909    HA   LYS 114           HA       LYS 114   7.033  -1.909  11.052
  910   1HB   LYS 114          2HB       LYS 114   8.451  -3.964  11.346
  911   2HB   LYS 114          1HB       LYS 114   9.835  -3.010  10.836
  912   1HG   LYS 114          2HG       LYS 114   8.180  -1.999  13.086
  913   2HG   LYS 114          1HG       LYS 114   9.257  -3.365  13.380
  914   1HD   LYS 114          2HD       LYS 114  10.067  -0.685  12.249
  915   2HD   LYS 114          1HD       LYS 114  10.345  -1.234  13.902
  916   1HE   LYS 114          2HE       LYS 114  11.578  -2.238  11.357
  917   2HE   LYS 114          1HE       LYS 114  12.378  -1.605  12.794
  918   1HZ   LYS 114          1HZ       LYS 114  12.689  -3.810  13.133
  919   2HZ   LYS 114          2HZ       LYS 114  11.296  -4.269  12.290
  920   3HZ   LYS 114          3HZ       LYS 114  11.172  -3.674  13.868
  921    H    HIS 115           H        HIS 115  10.104  -1.652   9.286
  922    HA   HIS 115           HA       HIS 115  10.926   0.817  10.138
  923   1HB   HIS 115          2HB       HIS 115  12.157  -0.763   8.607
  924   2HB   HIS 115          1HB       HIS 115  11.192  -0.119   7.284
  925    HD1  HIS 115           1HD      HIS 115  14.397   0.254   8.633
  926    HD2  HIS 115           2HD      HIS 115  11.497   2.962   7.397
  927    HE1  HIS 115           1HE      HIS 115  15.627   2.403   8.196
  928    HE2  HIS 115           2HE      HIS 115  13.840   4.050   7.534
  929    H    ALA 116           H        ALA 116   8.409   0.063   7.812
  930    HA   ALA 116           HA       ALA 116   8.128   2.633   6.681
  931   1HB   ALA 116          1HB       ALA 116   5.807   0.777   7.057
  932   2HB   ALA 116          2HB       ALA 116   7.109   0.375   5.937
  933   3HB   ALA 116          3HB       ALA 116   6.170   1.849   5.704
  934    H    PHE 117           H        PHE 117   6.831   1.139   9.581
  935    HA   PHE 117           HA       PHE 117   5.137   3.395  10.205
  936   1HB   PHE 117          2HB       PHE 117   5.778   0.791  11.564
  937   2HB   PHE 117          1HB       PHE 117   4.897   2.059  12.410
  938    HD1  PHE 117           1HD      PHE 117   2.619   2.439  12.005
  939    HD2  PHE 117           2HD      PHE 117   4.809  -0.193   9.478
  940    HE1  PHE 117           1HE      PHE 117   0.517   1.676  10.987
  941    HE2  PHE 117           2HE      PHE 117   2.710  -0.957   8.453
  942    HZ   PHE 117           HZ       PHE 117   0.560  -0.019   9.208
  943    H    GLU 118           H        GLU 118   8.324   2.245  11.002
  944    HA   GLU 118           HA       GLU 118   8.835   3.560  13.379
  945   1HB   GLU 118          2HB       GLU 118  10.292   2.016  11.724
  946   2HB   GLU 118          1HB       GLU 118  11.026   3.583  11.412
  947   1HG   GLU 118          2HG       GLU 118  11.020   3.665  14.070
  948   2HG   GLU 118          1HG       GLU 118  11.067   1.916  13.852
  949    H    GLU 119           H        GLU 119   8.444   4.879  10.209
  950    HA   GLU 119           HA       GLU 119   9.795   7.350  10.723
  951   1HB   GLU 119          2HB       GLU 119   7.788   6.635   8.582
  952   2HB   GLU 119          1HB       GLU 119   8.769   8.095   8.612
  953   1HG   GLU 119          2HG       GLU 119  10.225   5.536   8.786
  954   2HG   GLU 119          1HG       GLU 119   9.435   5.892   7.251
  955    H    TYR 120           H        TYR 120   6.933   6.120  11.880
  956    HA   TYR 120           HA       TYR 120   5.612   8.731  12.011
  957   1HB   TYR 120          2HB       TYR 120   4.411   6.554  11.308
  958   2HB   TYR 120          1HB       TYR 120   4.448   6.147  13.021
  959    HD1  TYR 120           1HD      TYR 120   2.921   7.130  14.544
  960    HD2  TYR 120           2HD      TYR 120   3.183   8.605  10.562
  961    HE1  TYR 120           1HE      TYR 120   0.880   8.454  14.906
  962    HE2  TYR 120           2HE      TYR 120   1.144   9.933  10.914
  963    HH   TYR 120           HH       TYR 120  -0.109  10.914  12.824
  964    H    SER 121           H        SER 121   7.980   8.266  13.543
  965    HA   SER 121           HA       SER 121   6.853   8.545  16.246
  966   1HB   SER 121          2HB       SER 121   8.961   6.694  15.303
  967   2HB   SER 121          1HB       SER 121   9.305   7.539  16.812
  968    HG   SER 121           HG       SER 121   7.044   5.927  16.227