*HEADER    ELECTRON TRANSPORT                      03-FEB-07   2ORL              
*TITLE     SOLUTION STRUCTURE OF THE CYTOCHROME C- PARA-AMINOPHENOL              
*TITLE    2 ADDUCT                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C ISO-1;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   3 ORGANISM_COMMON: YEAST;                                              
*SOURCE   4 GENE: CYC1;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    PROTEIN-LIGAND ADDUCT                                                 
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    M.ASSFALG, I.BERTINI, R.DEL CONTE, A.GIACHETTI, P.TURANO              
*REVDAT   1   24-APR-07 2ORL    0                                                


STUCTURAL CONSTRAINTS FILE (XPLOR FORMAT)

RESIDUE NUMBERS ARE FROM 1 TO 108 CONTRARY TO THE NUMEBERING FOUND IN THE PDB COORDINATE FILE 
WHERE NUMBERS ARE FROM -5 TO 103

TABLE I: INTERMOLECULAR NOEs BETWEEN CYTOCHROME C AND 4-AMINOPHENOL

assign ( resid 67   and name HN ) ( resid 200 and (name H4 or name H1) ) 6.0 6.0 0.5
assign ( resid 68   and name HN )
       (
               ( resid 200 and (name H4 or name H1 ))
                      )  6.0 6.0 0.5
assign ( resid 104   and name HN )
       (
               ( resid 200 and (name H3 or name H2 )) 
                      )  6.0 6.0 0.5
assign ( resid 66   and name HN )
       (
               ( resid 200 and (name H3 or name H2 ))
                      )  6.0 6.0 0.5

TABLE II: INTRAMOLECULAR NOEs

 assign (resid   2 and name HN  ) (resid   3 and name HN  )   3.1  3.1  0.0
 assign (resid   3 and name CG  ) (resid 101 and name HN  )   7.0  7.0  0.0
 assign (resid   3 and name CZ  ) (resid 100 and name HN  )   7.0  7.0  0.0
 assign (resid   3 and name CZ  ) (resid 101 and name HN  )   6.9  6.9  0.0
 assign (resid   3 and name HZ  ) (resid   6 and name HN  )   3.9  3.9  0.0
 assign (resid   3 and name HZ  ) (resid 101 and name HN  )   4.4  4.4  0.0
 assign (resid   4 and name HN  ) (resid   4 and name HB1 )   3.4  3.4  0.0
 assign (resid   4 and name HN  ) (resid   4 and name HB2 )   3.4  3.4  0.0
 assign (resid   4 and name HN  ) (resid   4 and name HB# )   3.2  3.2  0.0
 assign (resid   4 and name HN  ) (resid  97 and name HB# )   5.1  5.1  0.0
 assign (resid   4 and name HN  ) (resid  97 and name HD21)   4.8  4.8  0.0
 assign (resid   4 and name HN  ) (resid  97 and name HD22)   4.8  4.8  0.0
 assign (resid   4 and name HN  ) (resid  97 and name HD2#)   4.4  4.4  0.0
 assign (resid   4 and name HA  ) (resid   5 and name HN  )   3.0  3.0  0.0
 assign (resid   4 and name HB1 ) (resid   5 and name HN  )   4.5  4.5  0.0
 assign (resid   4 and name HB2 ) (resid   5 and name HN  )   4.5  4.5  0.0
 assign (resid   4 and name HB# ) (resid   5 and name HN  )   4.1  4.1  0.0
 assign (resid   5 and name HN  ) (resid   5 and name HB# )   3.4  3.4  0.0
 assign (resid   5 and name HA  ) (resid   6 and name HN  )   3.0  3.0  0.0
 assign (resid   5 and name HB# ) (resid   6 and name HN  )   3.4  3.4  0.0
 assign (resid   6 and name HN  ) (resid   7 and name HN  )   4.0  4.0  0.0
 assign (resid   6 and name HN  ) (resid  98 and name HA  )   4.8  4.8  0.0
 assign (resid   6 and name HN  ) (resid 101 and name HG2#)   5.4  5.4  0.0
 assign (resid   7 and name HN  ) (resid   7 and name HB# )   3.9  3.9  0.0
 assign (resid   7 and name HN  ) (resid  98 and name HA  )   4.0  4.0  0.0
 assign (resid   7 and name HN  ) (resid  98 and name HB# )   5.9  5.9  0.0
 assign (resid   8 and name HN  ) (resid   9 and name HN  )   5.5  5.5  0.0
 assign (resid   8 and name HN  ) (resid  10 and name HN  )   5.5  5.5  0.0
 assign (resid   8 and name HN  ) (resid 101 and name HG2#)   6.5  6.5  0.0
 assign (resid   8 and name HA  ) (resid  11 and name HN  )   5.0  5.0  0.0
 assign (resid   8 and name HB# ) (resid   9 and name HN  )   4.4  4.4  0.0
 assign (resid   8 and name HB# ) (resid  10 and name HN  )   5.3  5.3  0.0
 assign (resid   8 and name HB# ) (resid  11 and name HN  )   6.5  6.5  0.0
 assign (resid   8 and name HB# ) (resid 102 and name HN  )   6.5  6.5  0.0
 assign (resid   9 and name HN  ) (resid   9 and name HG# )   5.9  5.9  0.0
 assign (resid   9 and name HN  ) (resid   9 and name HD# )   6.0  6.0  0.0
 assign (resid   9 and name HN  ) (resid  10 and name HN  )   4.3  4.3  0.0
 assign (resid   9 and name HN  ) (resid  11 and name HN  )   5.5  5.5  0.0
 assign (resid   9 and name HA  ) (resid  10 and name HN  )   3.2  3.2  0.0
 assign (resid   9 and name HA  ) (resid  12 and name HN  )   5.5  5.5  0.0
 assign (resid   9 and name HB# ) (resid  10 and name HN  )   5.6  5.6  0.0
 assign (resid  10 and name HN  ) (resid  11 and name HN  )   3.6  3.6  0.0
 assign (resid  10 and name HA  ) (resid  11 and name HN  )   3.6  3.6  0.0
 assign (resid  10 and name HA  ) (resid  12 and name HN  )   4.9  4.9  0.0
 assign (resid  10 and name HA  ) (resid  13 and name HN  )   5.0  5.0  0.0
 assign (resid  10 and name HB# ) (resid  11 and name HN  )   5.7  5.7  0.0
 assign (resid  10 and name HB# ) (resid  14 and name HN  )   6.5  6.5  0.0
 assign (resid  11 and name HN  ) (resid  12 and name HN  )   3.2  3.2  0.0
 assign (resid  11 and name HN  ) (resid  12 and name HB# )   5.5  5.5  0.0
 assign (resid  11 and name HN  ) (resid  13 and name HN  )   5.5  5.5  0.0
 assign (resid  11 and name HN  ) (resid  98 and name HB# )   5.0  5.0  0.0
 assign (resid  11 and name HN  ) (resid  99 and name HA  )   5.5  5.5  0.0
 assign (resid  11 and name HN  ) (resid 102 and name HB1 )   5.5  5.5  0.0
 assign (resid  11 and name HN  ) (resid 102 and name HB2 )   5.5  5.5  0.0
 assign (resid  11 and name HN  ) (resid 102 and name HB# )   5.3  5.3  0.0
 assign (resid  11 and name HA1 ) (resid  14 and name HN  )   5.5  5.5  0.0
 assign (resid  11 and name HA2 ) (resid  14 and name HN  )   5.5  5.5  0.0
 assign (resid  11 and name HA# ) (resid  14 and name HN  )   5.2  5.2  0.0
 assign (resid  11 and name HA# ) (resid  15 and name HN  )   5.9  5.9  0.0
 assign (resid  11 and name HA# ) (resid 102 and name HN  )   5.5  5.5  0.0
 assign (resid  12 and name HN  ) (resid  12 and name HB# )   3.3  3.3  0.0
 assign (resid  12 and name HN  ) (resid  13 and name HN  )   3.3  3.3  0.0
 assign (resid  12 and name HN  ) (resid 102 and name HB1 )   5.5  5.5  0.0
 assign (resid  12 and name HN  ) (resid 102 and name HB2 )   5.5  5.5  0.0
 assign (resid  12 and name HN  ) (resid 102 and name HB# )   5.2  5.2  0.0
 assign (resid  12 and name HN  ) (resid 102 and name HB# )   5.2  5.2  0.0
 assign (resid  12 and name HA  ) (resid  14 and name HN  )   5.5  5.5  0.0
 assign (resid  12 and name HA  ) (resid  15 and name HN  )   4.2  4.2  0.0
 assign (resid  12 and name HA  ) (resid  16 and name HN  )   4.3  4.3  0.0
 assign (resid  12 and name HB# ) (resid  13 and name HN  )   3.7  3.7  0.0
 assign (resid  12 and name O   ) (resid  16 and name HN  )   2.4  2.4  0.0
 assign (resid  13 and name HN  ) (resid  13 and name HB  )   3.7  3.7  0.0
 assign (resid  13 and name HN  ) (resid  13 and name HG2#)   3.6  3.6  0.0
 assign (resid  13 and name HN  ) (resid  14 and name HN  )   3.3  3.3  0.0
 assign (resid  13 and name HN  ) (resid  15 and name HN  )   5.5  5.5  0.0
 assign (resid  13 and name HA  ) (resid  16 and name HN  )   4.3  4.3  0.0
 assign (resid  13 and name HB  ) (resid  14 and name HN  )   5.0  5.0  0.0
 assign (resid  13 and name HG2#) (resid  14 and name HN  )   5.2  5.2  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HB# )   3.0  3.0  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HB# )   3.0  3.0  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HG  )   4.2  4.2  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HD1#)   6.0  6.0  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HD2#)   6.0  6.0  0.0
 assign (resid  14 and name HN  ) (resid  14 and name HD# )   5.3  5.3  0.0
 assign (resid  14 and name HN  ) (resid  15 and name HN  )   3.1  3.1  0.0
 assign (resid  14 and name HN  ) (resid  16 and name HN  )   3.9  3.9  0.0
 assign (resid  14 and name HN  ) (resid  99 and name HD# )   8.1  8.1  0.0
 assign (resid  14 and name HA  ) (resid  17 and name HN  )   5.5  5.5  0.0
 assign (resid  14 and name HB1 ) (resid  15 and name HN  )   3.8  3.8  0.0
 assign (resid  14 and name HB2 ) (resid  15 and name HN  )   3.8  3.8  0.0
 assign (resid  14 and name HB# ) (resid  15 and name HN  )   3.4  3.4  0.0
 assign (resid  14 and name HG  ) (resid  15 and name HN  )   4.4  4.4  0.0
 assign (resid  14 and name HD# ) (resid  95 and name HN  )   8.1  8.1  0.0
 assign (resid  14 and name HD# ) (resid  98 and name HN  )   7.6  7.6  0.0
 assign (resid  14 and name HD# ) (resid  99 and name HN  )   7.0  7.0  0.0
 assign (resid  15 and name HN  ) (resid  15 and name HB1 )   3.2  3.2  0.0
 assign (resid  15 and name HN  ) (resid  15 and name HB2 )   3.2  3.2  0.0
 assign (resid  15 and name HN  ) (resid  16 and name HN  )   3.1  3.1  0.0
 assign (resid  15 and name HN  ) (resid  19 and name HN  )   5.5  5.5  0.0
 assign (resid  15 and name HN  ) (resid  99 and name HD1#)   6.0  6.0  0.0
 assign (resid  15 and name HN  ) (resid  99 and name HD2#)   6.0  6.0  0.0
 assign (resid  15 and name HN  ) (resid  99 and name HD# )   5.1  5.1  0.0
 assign (resid  15 and name HA  ) (resid  19 and name HN  )   4.8  4.8  0.0
 assign (resid  15 and name HB1 ) (resid  16 and name HN  )   4.8  4.8  0.0
 assign (resid  15 and name HB2 ) (resid  16 and name HN  )   4.8  4.8  0.0
 assign (resid  15 and name HB# ) (resid  16 and name HN  )   4.3  4.3  0.0
 assign (resid  15 and name HB# ) (resid  16 and name HN  )   4.3  4.3  0.0
 assign (resid  15 and name CG  ) (resid  16 and name HN  )   6.4  6.4  0.0
 assign (resid  15 and name O   ) (resid  20 and name HN  )   2.4  2.4  0.0
 assign (resid  16 and name HN  ) (resid  16 and name HB1 )   3.1  3.1  0.0
 assign (resid  16 and name HN  ) (resid  16 and name HB2 )   3.1  3.1  0.0
 assign (resid  16 and name HN  ) (resid  16 and name HG# )   4.4  4.4  0.0
 assign (resid  16 and name HN  ) (resid  16 and name HG# )   4.4  4.4  0.0
 assign (resid  16 and name HN  ) (resid  17 and name HN  )   3.4  3.4  0.0
 assign (resid  16 and name HN  ) (resid  20 and name HN  )   5.5  5.5  0.0
 assign (resid  16 and name HN  ) (resid  20 and name HD# )   7.3  7.3  0.0
 assign (resid  16 and name HA  ) (resid  18 and name HN  )   5.5  5.5  0.0
 assign (resid  16 and name HA  ) (resid  20 and name HN  )   4.7  4.7  0.0
 assign (resid  16 and name HB1 ) (resid  17 and name HN  )   4.8  4.8  0.0
 assign (resid  16 and name HB2 ) (resid  17 and name HN  )   4.8  4.8  0.0
 assign (resid  16 and name HB# ) (resid  17 and name HN  )   4.0  4.0  0.0
 assign (resid  17 and name HN  ) (resid  17 and name HB  )   3.8  3.8  0.0
 assign (resid  17 and name HN  ) (resid  17 and name HG2#)   3.9  3.9  0.0
 assign (resid  17 and name HN  ) (resid  18 and name HN  )   3.9  3.9  0.0
 assign (resid  17 and name HG2#) (resid  18 and name HN  )   6.5  6.5  0.0
 assign (resid  18 and name HN  ) (resid  18 and name HB# )   3.8  3.8  0.0
 assign (resid  18 and name HN  ) (resid  18 and name HG1 )   4.5  4.5  0.0
 assign (resid  18 and name HN  ) (resid  18 and name HG2 )   4.5  4.5  0.0
 assign (resid  18 and name HN  ) (resid  18 and name HG# )   4.0  4.0  0.0
 assign (resid  18 and name HN  ) (resid  18 and name HD# )   5.7  5.7  0.0
 assign (resid  18 and name HN  ) (resid  19 and name HN  )   2.7  2.7  0.0
 assign (resid  18 and name HN  ) (resid  20 and name HN  )   5.0  5.0  0.0
 assign (resid  18 and name HA  ) (resid  20 and name HN  )   5.5  5.5  0.0
 assign (resid  18 and name HB1 ) (resid  19 and name HN  )   5.5  5.5  0.0
 assign (resid  18 and name HB2 ) (resid  19 and name HN  )   5.5  5.5  0.0
 assign (resid  19 and name HN  ) (resid  19 and name HB1 )   4.0  4.0  0.0
 assign (resid  19 and name HN  ) (resid  19 and name HB2 )   4.0  4.0  0.0
 assign (resid  19 and name HN  ) (resid  19 and name HB# )   3.8  3.8  0.0
 assign (resid  19 and name HN  ) (resid  20 and name HN  )   2.8  2.8  0.0
 assign (resid  19 and name HN  ) (resid  20 and name HA  )   4.7  4.7  0.0
 assign (resid  19 and name HN  ) (resid  20 and name HB# )   5.9  5.9  0.0
 assign (resid  19 and name HA  ) (resid  21 and name HN  )   5.5  5.5  0.0
 assign (resid  19 and name HB1 ) (resid  20 and name HN  )   4.6  4.6  0.0
 assign (resid  19 and name HB2 ) (resid  20 and name HN  )   4.6  4.6  0.0
 assign (resid  19 and name HB# ) (resid  20 and name HN  )   4.2  4.2  0.0
 assign (resid  19 and name O   ) (resid  22 and name HN  )   2.4  2.4  0.0
 assign (resid  19 and name O   ) (resid  23 and name HN  )   2.4  2.4  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HB1 )   3.5  3.5  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HB2 )   3.5  3.5  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HB# )   3.2  3.2  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HG  )   4.5  4.5  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HD1#)   5.1  5.1  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HD2#)   5.1  5.1  0.0
 assign (resid  20 and name HN  ) (resid  20 and name HD# )   4.8  4.8  0.0
 assign (resid  20 and name HN  ) (resid  21 and name HN  )   3.8  3.8  0.0
 assign (resid  20 and name HN  ) (resid  21 and name HB# )   6.4  6.4  0.0
 assign (resid  20 and name HA  ) (resid  22 and name HN  )   5.0  5.0  0.0
 assign (resid  20 and name HA  ) (resid  23 and name HN  )   3.9  3.9  0.0
 assign (resid  20 and name HB# ) (resid  21 and name HN  )   6.4  6.4  0.0
 assign (resid  20 and name HB# ) (resid  23 and name HN  )   6.4  6.4  0.0
 assign (resid  20 and name HD# ) (resid  21 and name HN  )   8.1  8.1  0.0
 assign (resid  21 and name HN  ) (resid  21 and name HB1 )   3.7  3.7  0.0
 assign (resid  21 and name HN  ) (resid  21 and name HB2 )   3.7  3.7  0.0
 assign (resid  21 and name HN  ) (resid  21 and name HB# )   3.5  3.5  0.0
 assign (resid  21 and name HN  ) (resid  21 and name HG# )   3.9  3.9  0.0
 assign (resid  21 and name HN  ) (resid  21 and name HG# )   3.9  3.9  0.0
 assign (resid  21 and name HN  ) (resid  22 and name HN  )   3.5  3.5  0.0
 assign (resid  21 and name HN  ) (resid  22 and name HB# )   6.4  6.4  0.0
 assign (resid  21 and name HN  ) (resid  23 and name HN  )   5.5  5.5  0.0
 assign (resid  21 and name HB1 ) (resid  22 and name HN  )   5.5  5.5  0.0
 assign (resid  21 and name HB2 ) (resid  22 and name HN  )   5.5  5.5  0.0
 assign (resid  21 and name HG1 ) (resid  22 and name HN  )   3.8  3.8  0.0
 assign (resid  21 and name HG1 ) (resid  23 and name HN  )   5.0  5.0  0.0
 assign (resid  21 and name HG2 ) (resid  22 and name HN  )   3.8  3.8  0.0
 assign (resid  21 and name HG2 ) (resid  23 and name HN  )   5.0  5.0  0.0
 assign (resid  21 and name HG# ) (resid  23 and name HN  )   4.6  4.6  0.0
 assign (resid  22 and name HN  ) (resid  22 and name HB1 )   3.9  3.9  0.0
 assign (resid  22 and name HN  ) (resid  22 and name HB2 )   3.9  3.9  0.0
 assign (resid  22 and name HN  ) (resid  22 and name HB# )   3.5  3.5  0.0
 assign (resid  22 and name HN  ) (resid  23 and name HN  )   2.8  2.8  0.0
 assign (resid  22 and name HN  ) (resid  23 and name HB1 )   5.5  5.5  0.0
 assign (resid  22 and name HN  ) (resid  23 and name HB2 )   5.5  5.5  0.0
 assign (resid  22 and name HN  ) (resid  23 and name HB# )   4.9  4.9  0.0
 assign (resid  22 and name HN  ) (resid 109 and name HMC#)   6.0  6.0  0.0
 assign (resid  22 and name HA  ) (resid  33 and name HN  )   4.3  4.3  0.0
 assign (resid  22 and name HA  ) (resid  34 and name HN  )   4.4  4.4  0.0
 assign (resid  22 and name HB1 ) (resid  23 and name HN  )   4.2  4.2  0.0
 assign (resid  22 and name HB1 ) (resid  34 and name HN  )   4.6  4.6  0.0
 assign (resid  22 and name HB2 ) (resid  23 and name HN  )   4.2  4.2  0.0
 assign (resid  22 and name HB2 ) (resid  34 and name HN  )   4.6  4.6  0.0
 assign (resid  22 and name HB# ) (resid  23 and name HN  )   3.7  3.7  0.0
 assign (resid  22 and name HB# ) (resid  33 and name HN  )   5.4  5.4  0.0
 assign (resid  22 and name HB# ) (resid  34 and name HN  )   4.2  4.2  0.0
 assign (resid  23 and name HN  ) (resid  23 and name HB1 )   3.8  3.8  0.0
 assign (resid  23 and name HN  ) (resid  23 and name HB2 )   3.8  3.8  0.0
 assign (resid  23 and name HN  ) (resid  23 and name HB# )   3.4  3.4  0.0
 assign (resid  23 and name HN  ) (resid  23 and name HD2 )   4.2  4.2  0.0
 assign (resid  23 and name HN  ) (resid  24 and name HN  )   4.8  4.8  0.0
 assign (resid  23 and name HN  ) (resid  24 and name HA  )   5.5  5.5  0.0
 assign (resid  23 and name HA  ) (resid  24 and name HN  )   2.9  2.9  0.0
 assign (resid  23 and name HB1 ) (resid  24 and name HN  )   5.5  5.5  0.0
 assign (resid  23 and name HB2 ) (resid  24 and name HN  )   5.5  5.5  0.0
 assign (resid  23 and name HB# ) (resid  37 and name HN  )   5.9  5.9  0.0
 assign (resid  23 and name HD1 ) (resid  24 and name HN  )   5.0  5.0  0.0
 assign (resid  24 and name HN  ) (resid  24 and name HG2#)   4.4  4.4  0.0
 assign (resid  24 and name HN  ) (resid  36 and name HA  )   4.0  4.0  0.0
 assign (resid  24 and name HN  ) (resid  37 and name HN  )   4.0  4.0  0.0
 assign (resid  24 and name HN  ) (resid  37 and name HG  )   5.5  5.5  0.0
 assign (resid  24 and name HA  ) (resid  25 and name HN  )   2.8  2.8  0.0
 assign (resid  24 and name HA  ) (resid  26 and name HN  )   4.1  4.1  0.0
 assign (resid  24 and name HB  ) (resid  25 and name HN  )   3.6  3.6  0.0
 assign (resid  24 and name HB  ) (resid  26 and name HN  )   5.5  5.5  0.0
 assign (resid  24 and name HG2#) (resid  25 and name HN  )   6.0  6.0  0.0
 assign (resid  24 and name HG2#) (resid  26 and name HN  )   6.0  6.0  0.0
 assign (resid  25 and name HN  ) (resid  25 and name HB  )   4.0  4.0  0.0
 assign (resid  25 and name HN  ) (resid  25 and name HG1#)   4.3  4.3  0.0
 assign (resid  25 and name HN  ) (resid  25 and name HG2#)   4.3  4.3  0.0
 assign (resid  25 and name HN  ) (resid  25 and name HG# )   3.6  3.6  0.0
 assign (resid  25 and name HN  ) (resid  25 and name HG# )   3.6  3.6  0.0
 assign (resid  25 and name HN  ) (resid  26 and name HN  )   3.0  3.0  0.0
 assign (resid  25 and name HN  ) (resid  26 and name HB# )   5.9  5.9  0.0
 assign (resid  25 and name HA  ) (resid  37 and name HN  )   4.2  4.2  0.0
 assign (resid  25 and name HB  ) (resid  26 and name HN  )   4.1  4.1  0.0
 assign (resid  25 and name HG1#) (resid  26 and name HN  )   6.0  6.0  0.0
 assign (resid  25 and name HG2#) (resid  26 and name HN  )   6.0  6.0  0.0
 assign (resid  25 and name HG# ) (resid  26 and name HN  )   5.3  5.3  0.0
 assign (resid  25 and name HG# ) (resid  37 and name HN  )   7.6  7.6  0.0
 assign (resid  26 and name HN  ) (resid  26 and name HB# )   3.6  3.6  0.0
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 assign (resid  90 and name HB1 ) (resid  92 and name HN  )   5.5  5.5  0.0
 assign (resid  90 and name HB2 ) (resid  91 and name HN  )   4.7  4.7  0.0
 assign (resid  90 and name HB2 ) (resid  92 and name HN  )   5.5  5.5  0.0
 assign (resid  90 and name HB# ) (resid  91 and name HN  )   4.3  4.3  0.0
 assign (resid  90 and name HB# ) (resid  92 and name HN  )   5.2  5.2  0.0
 assign (resid  90 and name HD# ) (resid  91 and name HN  )   8.1  8.1  0.0
 assign (resid  91 and name HN  ) (resid  91 and name HB# )   3.8  3.8  0.0
 assign (resid  91 and name HN  ) (resid  92 and name HN  )   3.7  3.7  0.0
 assign (resid  91 and name HB# ) (resid  92 and name HN  )   4.8  4.8  0.0
 assign (resid  91 and name HB# ) (resid  93 and name HN  )   6.4  6.4  0.0
 assign (resid  92 and name HN  ) (resid  92 and name HB1 )   3.8  3.8  0.0
 assign (resid  92 and name HN  ) (resid  92 and name HB2 )   3.8  3.8  0.0
 assign (resid  92 and name HN  ) (resid  92 and name HB# )   3.5  3.5  0.0
 assign (resid  92 and name HN  ) (resid  92 and name HG# )   4.0  4.0  0.0
 assign (resid  92 and name HN  ) (resid  93 and name HN  )   5.5  5.5  0.0
 assign (resid  92 and name HN  ) (resid  95 and name HN  )   5.5  5.5  0.0
 assign (resid  92 and name HN  ) (resid  95 and name HB# )   5.7  5.7  0.0
 assign (resid  92 and name HA  ) (resid  93 and name HN  )   3.6  3.6  0.0
 assign (resid  92 and name HB1 ) (resid  95 and name HN  )   4.1  4.1  0.0
 assign (resid  92 and name HB2 ) (resid  95 and name HN  )   4.1  4.1  0.0
 assign (resid  92 and name HB# ) (resid  94 and name HN  )   4.6  4.6  0.0
 assign (resid  92 and name HB# ) (resid  95 and name HN  )   3.8  3.8  0.0
 assign (resid  92 and name O   ) (resid  96 and name HN  )   2.4  2.4  0.0
 assign (resid  93 and name HN  ) (resid  93 and name HB1 )   3.7  3.7  0.0
 assign (resid  93 and name HN  ) (resid  93 and name HB2 )   3.7  3.7  0.0
 assign (resid  93 and name HN  ) (resid  94 and name HN  )   3.7  3.7  0.0
 assign (resid  93 and name HA  ) (resid  95 and name HN  )   5.5  5.5  0.0
 assign (resid  93 and name HA  ) (resid  96 and name HN  )   4.0  4.0  0.0
 assign (resid  93 and name HA  ) (resid  97 and name HN  )   4.9  4.9  0.0
 assign (resid  93 and name HB1 ) (resid  94 and name HN  )   3.8  3.8  0.0
 assign (resid  93 and name HB2 ) (resid  94 and name HN  )   3.8  3.8  0.0
 assign (resid  93 and name HB# ) (resid  94 and name HN  )   3.4  3.4  0.0
 assign (resid  93 and name O   ) (resid  97 and name HN  )   2.4  2.4  0.0
 assign (resid  94 and name HN  ) (resid  94 and name HB1 )   3.5  3.5  0.0
 assign (resid  94 and name HN  ) (resid  94 and name HB2 )   3.5  3.5  0.0
 assign (resid  94 and name HN  ) (resid  94 and name HB# )   3.1  3.1  0.0
 assign (resid  94 and name HN  ) (resid  94 and name HG1 )   3.4  3.4  0.0
 assign (resid  94 and name HN  ) (resid  94 and name HG2 )   3.4  3.4  0.0
 assign (resid  94 and name HN  ) (resid  95 and name HN  )   3.4  3.4  0.0
 assign (resid  94 and name HN  ) (resid  96 and name HN  )   4.7  4.7  0.0
 assign (resid  94 and name HA  ) (resid  97 and name HN  )   5.1  5.1  0.0
 assign (resid  94 and name HB1 ) (resid  95 and name HN  )   4.0  4.0  0.0
 assign (resid  94 and name HB2 ) (resid  95 and name HN  )   4.0  4.0  0.0
 assign (resid  94 and name HB# ) (resid  95 and name HN  )   3.4  3.4  0.0
 assign (resid  94 and name HB# ) (resid  96 and name HN  )   5.6  5.6  0.0
 assign (resid  94 and name HG1 ) (resid  95 and name HN  )   4.4  4.4  0.0
 assign (resid  94 and name HG2 ) (resid  95 and name HN  )   4.4  4.4  0.0
 assign (resid  94 and name HG# ) (resid  95 and name HN  )   4.1  4.1  0.0
 assign (resid  95 and name HN  ) (resid  95 and name HB1 )   3.4  3.4  0.0
 assign (resid  95 and name HN  ) (resid  95 and name HB2 )   3.4  3.4  0.0
 assign (resid  95 and name HN  ) (resid  95 and name HB# )   3.1  3.1  0.0
 assign (resid  95 and name HN  ) (resid  96 and name HN  )   3.0  3.0  0.0
 assign (resid  95 and name HN  ) (resid  96 and name HG# )   5.0  5.0  0.0
 assign (resid  95 and name HN  ) (resid  97 and name HN  )   4.2  4.2  0.0
 assign (resid  95 and name HB1 ) (resid  96 and name HN  )   3.7  3.7  0.0
 assign (resid  95 and name HB2 ) (resid  96 and name HN  )   3.7  3.7  0.0
 assign (resid  95 and name HB# ) (resid  99 and name HN  )   6.4  6.4  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HB1 )   3.8  3.8  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HB2 )   3.8  3.8  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HB# )   3.6  3.6  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HG1 )   3.7  3.7  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HG2 )   3.7  3.7  0.0
 assign (resid  96 and name HN  ) (resid  96 and name HG# )   3.4  3.4  0.0
 assign (resid  96 and name HN  ) (resid  97 and name HN  )   3.1  3.1  0.0
 assign (resid  96 and name HN  ) (resid  99 and name HN  )   5.0  5.0  0.0
 assign (resid  96 and name HA  ) (resid  99 and name HN  )   5.0  5.0  0.0
 assign (resid  96 and name HA  ) (resid 100 and name HN  )   5.5  5.5  0.0
 assign (resid  96 and name HB1 ) (resid  97 and name HN  )   4.3  4.3  0.0
 assign (resid  96 and name HB2 ) (resid  97 and name HN  )   4.3  4.3  0.0
 assign (resid  96 and name HB# ) (resid  97 and name HN  )   3.6  3.6  0.0
 assign (resid  96 and name HG# ) (resid  97 and name HN  )   5.1  5.1  0.0
 assign (resid  96 and name O   ) (resid 100 and name HN  )   2.4  2.4  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HB1 )   3.9  3.9  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HB2 )   3.9  3.9  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HB# )   3.3  3.3  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HD21)   5.0  5.0  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HD22)   5.0  5.0  0.0
 assign (resid  97 and name HN  ) (resid  97 and name HD2#)   4.5  4.5  0.0
 assign (resid  97 and name HA  ) (resid 100 and name HN  )   5.5  5.5  0.0
 assign (resid  97 and name HB1 ) (resid  98 and name HN  )   4.3  4.3  0.0
 assign (resid  97 and name HB2 ) (resid  98 and name HN  )   4.3  4.3  0.0
 assign (resid  97 and name HB# ) (resid  98 and name HN  )   3.8  3.8  0.0
 assign (resid  97 and name HB# ) (resid  99 and name HN  )   6.3  6.3  0.0
 assign (resid  98 and name HN  ) (resid  98 and name HB1 )   3.9  3.9  0.0
 assign (resid  98 and name HN  ) (resid  98 and name HB2 )   3.9  3.9  0.0
 assign (resid  98 and name HN  ) (resid  98 and name HB# )   3.5  3.5  0.0
 assign (resid  98 and name HN  ) (resid  99 and name HN  )   3.1  3.1  0.0
 assign (resid  98 and name HB1 ) (resid  99 and name HN  )   3.8  3.8  0.0
 assign (resid  98 and name HB2 ) (resid  99 and name HN  )   3.8  3.8  0.0
 assign (resid  98 and name HB# ) (resid  99 and name HN  )   3.5  3.5  0.0
 assign (resid  98 and name O   ) (resid 102 and name HN  )   2.4  2.4  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HB1 )   3.2  3.2  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HB2 )   3.2  3.2  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HD1#)   5.0  5.0  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HD2#)   5.0  5.0  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HD# )   4.5  4.5  0.0
 assign (resid  99 and name HN  ) (resid  99 and name HD# )   4.5  4.5  0.0
 assign (resid  99 and name HN  ) (resid 100 and name HN  )   3.9  3.9  0.0
 assign (resid  99 and name HN  ) (resid 101 and name HN  )   5.5  5.5  0.0
 assign (resid  99 and name HA  ) (resid 101 and name HN  )   5.5  5.5  0.0
 assign (resid  99 and name HA  ) (resid 102 and name HN  )   3.9  3.9  0.0
 assign (resid  99 and name HB1 ) (resid 100 and name HN  )   4.4  4.4  0.0
 assign (resid  99 and name HB2 ) (resid 100 and name HN  )   4.4  4.4  0.0
 assign (resid  99 and name HB# ) (resid 100 and name HN  )   3.9  3.9  0.0
 assign (resid  99 and name HB# ) (resid 103 and name HN  )   6.4  6.4  0.0
 assign (resid  99 and name HD1#) (resid 100 and name HN  )   6.5  6.5  0.0
 assign (resid  99 and name HD2#) (resid 100 and name HN  )   6.5  6.5  0.0
 assign (resid  99 and name HD# ) (resid 100 and name HN  )   6.2  6.2  0.0
 assign (resid  99 and name HD# ) (resid 100 and name HN  )   6.2  6.2  0.0
 assign (resid  99 and name HD# ) (resid 103 and name HN  )   7.6  7.6  0.0
 assign (resid 100 and name HN  ) (resid 100 and name HB  )   3.3  3.3  0.0
 assign (resid 100 and name HN  ) (resid 100 and name HG2#)   4.8  4.8  0.0
 assign (resid 100 and name HN  ) (resid 100 and name HG1#)   3.8  3.8  0.0
 assign (resid 100 and name HN  ) (resid 100 and name HG1#)   3.8  3.8  0.0
 assign (resid 100 and name HN  ) (resid 100 and name HD1#)   4.1  4.1  0.0
 assign (resid 100 and name HN  ) (resid 101 and name HN  )   3.4  3.4  0.0
 assign (resid 100 and name HN  ) (resid 102 and name HN  )   4.5  4.5  0.0
 assign (resid 100 and name HN  ) (resid 104 and name HB# )   6.4  6.4  0.0
 assign (resid 100 and name HA  ) (resid 103 and name HN  )   4.2  4.2  0.0
 assign (resid 100 and name HA  ) (resid 104 and name HN  )   5.5  5.5  0.0
 assign (resid 100 and name HB  ) (resid 101 and name HN  )   3.8  3.8  0.0
 assign (resid 100 and name HG2#) (resid 101 and name HN  )   5.6  5.6  0.0
 assign (resid 100 and name HG2#) (resid 104 and name HN  )   6.0  6.0  0.0
 assign (resid 100 and name HG1#) (resid 102 and name HN  )   6.4  6.4  0.0
 assign (resid 100 and name HD1#) (resid 101 and name HN  )   6.5  6.5  0.0
 assign (resid 101 and name HN  ) (resid 101 and name HB  )   3.1  3.1  0.0
 assign (resid 101 and name HN  ) (resid 101 and name HG2#)   4.9  4.9  0.0
 assign (resid 101 and name HN  ) (resid 102 and name HN  )   3.3  3.3  0.0
 assign (resid 101 and name HN  ) (resid 103 and name HN  )   5.0  5.0  0.0
 assign (resid 101 and name HA  ) (resid 103 and name HN  )   5.0  5.0  0.0
 assign (resid 101 and name HA  ) (resid 104 and name HN  )   4.5  4.5  0.0
 assign (resid 101 and name HB  ) (resid 102 and name HN  )   3.4  3.4  0.0
 assign (resid 101 and name HG2#) (resid 102 and name HN  )   6.0  6.0  0.0
 assign (resid 102 and name HN  ) (resid 102 and name HB1 )   3.8  3.8  0.0
 assign (resid 102 and name HN  ) (resid 102 and name HB2 )   3.8  3.8  0.0
 assign (resid 102 and name HN  ) (resid 102 and name HB# )   3.5  3.5  0.0
 assign (resid 102 and name HN  ) (resid 103 and name HN  )   3.1  3.1  0.0
 assign (resid 102 and name HN  ) (resid 104 and name HN  )   4.3  4.3  0.0
 assign (resid 102 and name HN  ) (resid 105 and name HB# )   6.4  6.4  0.0
 assign (resid 102 and name HB1 ) (resid 103 and name HN  )   3.9  3.9  0.0
 assign (resid 102 and name HB2 ) (resid 103 and name HN  )   3.9  3.9  0.0
 assign (resid 102 and name CG  ) (resid 103 and name HN  )   7.5  7.5  0.0
 assign (resid 102 and name O   ) (resid 106 and name HN  )   2.4  2.4  0.0
 assign (resid 103 and name HN  ) (resid 103 and name HB1 )   3.2  3.2  0.0
 assign (resid 103 and name HN  ) (resid 103 and name HB2 )   3.2  3.2  0.0
 assign (resid 103 and name HN  ) (resid 103 and name HD1#)   5.2  5.2  0.0
 assign (resid 103 and name HN  ) (resid 103 and name HD2#)   5.2  5.2  0.0
 assign (resid 103 and name HN  ) (resid 104 and name HN  )   3.1  3.1  0.0
 assign (resid 103 and name HN  ) (resid 104 and name HA  )   5.5  5.5  0.0
 assign (resid 103 and name HN  ) (resid 104 and name HB# )   6.4  6.4  0.0
 assign (resid 103 and name HN  ) (resid 105 and name HN  )   5.0  5.0  0.0
 assign (resid 103 and name HA  ) (resid 105 and name HN  )   4.3  4.3  0.0
 assign (resid 103 and name HA  ) (resid 106 and name HN  )   3.7  3.7  0.0
 assign (resid 103 and name HA  ) (resid 107 and name HN  )   5.5  5.5  0.0
 assign (resid 103 and name HB1 ) (resid 104 and name HN  )   3.3  3.3  0.0
 assign (resid 103 and name HB2 ) (resid 104 and name HN  )   3.3  3.3  0.0
 assign (resid 103 and name HD# ) (resid 104 and name HN  )   7.6  7.6  0.0
 assign (resid 104 and name HN  ) (resid 104 and name HB1 )   3.1  3.1  0.0
 assign (resid 104 and name HN  ) (resid 104 and name HB2 )   3.1  3.1  0.0
 assign (resid 104 and name HN  ) (resid 105 and name HN  )   3.3  3.3  0.0
 assign (resid 104 and name HN  ) (resid 105 and name HA  )   5.5  5.5  0.0
 assign (resid 104 and name HN  ) (resid 106 and name HN  )   4.8  4.8  0.0
 assign (resid 104 and name HB# ) (resid 105 and name HN  )   4.0  4.0  0.0
 assign (resid 105 and name HN  ) (resid 105 and name HB1 )   3.1  3.1  0.0
 assign (resid 105 and name HN  ) (resid 105 and name HB2 )   3.1  3.1  0.0
 assign (resid 105 and name HN  ) (resid 105 and name HB# )   2.7  2.7  0.0
 assign (resid 105 and name HN  ) (resid 106 and name HN  )   2.7  2.7  0.0
 assign (resid 105 and name HN  ) (resid 107 and name HN  )   4.2  4.2  0.0
 assign (resid 105 and name HA  ) (resid 106 and name HN  )   3.6  3.6  0.0
 assign (resid 105 and name HA  ) (resid 108 and name HN  )   5.0  5.0  0.0
 assign (resid 105 and name HB1 ) (resid 106 and name HN  )   3.9  3.9  0.0
 assign (resid 105 and name HB2 ) (resid 106 and name HN  )   3.9  3.9  0.0
 assign (resid 105 and name HB# ) (resid 106 and name HN  )   3.5  3.5  0.0
 assign (resid 105 and name HB# ) (resid 107 and name HN  )   6.4  6.4  0.0
 assign (resid 106 and name HN  ) (resid 106 and name HB# )   3.3  3.3  0.0
 assign (resid 106 and name HN  ) (resid 107 and name HN  )   3.1  3.1  0.0
 assign (resid 106 and name HN  ) (resid 108 and name HN  )   3.9  3.9  0.0
 assign (resid 106 and name HN  ) (resid 108 and name HG# )   6.4  6.4  0.0
 assign (resid 106 and name HA  ) (resid 108 and name HN  )   5.5  5.5  0.0
 assign (resid 106 and name HB# ) (resid 107 and name HN  )   3.8  3.8  0.0
 assign (resid 106 and name HB# ) (resid 108 and name HN  )   6.5  6.5  0.0
 assign (resid 107 and name HN  ) (resid 108 and name HN  )   3.1  3.1  0.0
 assign (resid 107 and name HN  ) (resid 108 and name HB# )   6.4  6.4  0.0
 assign (resid 108 and name HN  ) (resid 108 and name HB1 )   3.9  3.9  0.0
 assign (resid 108 and name HN  ) (resid 108 and name HB2 )   3.9  3.9  0.0
 assign (resid 108 and name HN  ) (resid 108 and name HB# )   3.3  3.3  0.0
 assign (resid 108 and name HN  ) (resid 108 and name HG# )   5.8  5.8  0.0
 assign (resid 109 and name HAC ) (resid  86 and name HN  )   5.0  5.0  0.0
 assign (resid 109 and name HBC#) (resid  86 and name HN  )   5.3  5.3  0.0
 assign (resid 109 and name HD  ) (resid  86 and name HN  )   4.4  4.4  0.0
 assign (resid 109 and name FE  ) (resid  85 and name SD  )   2.5  2.5  0.0

TABLE III: LOWER LIMITS

 assign (resid  20 and name N   ) (resid  15 and name O   )   2.7  0.0 9999.0
 assign (resid  36 and name N   ) (resid  31 and name ND1 )   2.7  0.0 9999.0
 assign (resid  59 and name N   ) (resid  55 and name O   )   2.7  0.0 9999.0
 assign (resid  73 and name N   ) (resid  69 and name O   )   2.7  0.0 9999.0
 assign (resid 102 and name N   ) (resid  98 and name O   )   2.7  0.0 9999.0
 assign (resid 103 and name N   ) (resid  99 and name O   )   2.7  0.0 9999.0
 assign (resid 104 and name N   ) (resid 100 and name O   )   2.7  0.0 9999.0
 assign (resid 106 and name N   ) (resid 102 and name O   )   2.7  0.0 9999.0

TABLE IV: ANGLE CONSTRAINTS

assign ( resid  10  and name N   )
       ( resid  10  and name CA  )
       ( resid  10  and name C   )
       ( resid  11  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  12  and name N   )
       ( resid  12  and name CA  )
       ( resid  12  and name C   )
       ( resid  13  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  13  and name N   )
       ( resid  13  and name CA  )
       ( resid  13  and name C   )
       ( resid  14  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  14  and name N   )
       ( resid  14  and name CA  )
       ( resid  14  and name C   )
       ( resid  15  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  15  and name N   )
       ( resid  15  and name CA  )
       ( resid  15  and name C   )
       ( resid  16  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  20  and name N   )
       ( resid  20  and name CA  )
       ( resid  20  and name C   )
       ( resid  21  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  21  and name N   )
       ( resid  21  and name CA  )
       ( resid  21  and name C   )
       ( resid  22  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  22  and name N   )
       ( resid  22  and name CA  )
       ( resid  22  and name C   )
       ( resid  23  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  55  and name N   )
       ( resid  55  and name CA  )
       ( resid  55  and name C   )
       ( resid  56  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  56  and name N   )
       ( resid  56  and name CA  )
       ( resid  56  and name C   )
       ( resid  57  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  57  and name N   )
       ( resid  57  and name CA  )
       ( resid  57  and name C   )
       ( resid  58  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  58  and name N   )
       ( resid  58  and name CA  )
       ( resid  58  and name C   )
       ( resid  59  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  59  and name N   )
       ( resid  59  and name CA  )
       ( resid  59  and name C   )
       ( resid  60  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  60  and name N   )
       ( resid  60  and name CA  )
       ( resid  60  and name C   )
       ( resid  61  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  66  and name N   )
       ( resid  66  and name CA  )
       ( resid  66  and name C   )
       ( resid  67  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  68  and name N   )
       ( resid  68  and name CA  )
       ( resid  68  and name C   )
       ( resid  69  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  69  and name N   )
       ( resid  69  and name CA  )
       ( resid  69  and name C   )
       ( resid  70  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  70  and name N   )
       ( resid  70  and name CA  )
       ( resid  70  and name C   )
       ( resid  71  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  71  and name N   )
       ( resid  71  and name CA  )
       ( resid  71  and name C   )
       ( resid  72  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  72  and name N   )
       ( resid  72  and name CA  )
       ( resid  72  and name C   )
       ( resid  73  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  73  and name N   )
       ( resid  73  and name CA  )
       ( resid  73  and name C   )
       ( resid  74  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  77  and name N   )
       ( resid  77  and name CA  )
       ( resid  77  and name C   )
       ( resid  78  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  78  and name N   )
       ( resid  78  and name CA  )
       ( resid  78  and name C   )
       ( resid  79  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  79  and name N   )
       ( resid  79  and name CA  )
       ( resid  79  and name C   )
       ( resid  80  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  93  and name N   )
       ( resid  93  and name CA  )
       ( resid  93  and name C   )
       ( resid  94  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  94  and name N   )
       ( resid  94  and name CA  )
       ( resid  94  and name C   )
       ( resid  95  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  95  and name N   )
       ( resid  95  and name CA  )
       ( resid  95  and name C   )
       ( resid  96  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  96  and name N   )
       ( resid  96  and name CA  )
       ( resid  96  and name C   )
       ( resid  97  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  97  and name N   )
       ( resid  97  and name CA  )
       ( resid  97  and name C   )
       ( resid  98  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  98  and name N   )
       ( resid  98  and name CA  )
       ( resid  98  and name C   )
       ( resid  99  and name N   )           1.0  -60.0  -20.0 2

assign ( resid  99  and name N   )
       ( resid  99  and name CA  )
       ( resid  99  and name C   )
       ( resid 100  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 100  and name N   )
       ( resid 100  and name CA  )
       ( resid 100  and name C   )
       ( resid 101  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 101  and name N   )
       ( resid 101  and name CA  )
       ( resid 101  and name C   )
       ( resid 102  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 102  and name N   )
       ( resid 102  and name CA  )
       ( resid 102  and name C   )
       ( resid 103  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 103  and name N   )
       ( resid 103  and name CA  )
       ( resid 103  and name C   )
       ( resid 104  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 104  and name N   )
       ( resid 104  and name CA  )
       ( resid 104  and name C   )
       ( resid 105  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 105  and name N   )
       ( resid 105  and name CA  )
       ( resid 105  and name C   )
       ( resid 106  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 106  and name N   )
       ( resid 106  and name CA  )
       ( resid 106  and name C   )
       ( resid 107  and name N   )           1.0  -60.0  -20.0 2

assign ( resid 107  and name N   )
       ( resid 107  and name CA  )
       ( resid 107  and name C   )
       ( resid 108  and name N   )           1.0  -60.0  -20.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR  -5          HT1       THR  -5  -9.435  -6.538  10.640
    2   2H    THR  -5          HT2       THR  -5  -8.721  -7.906   9.944
    3   3H    THR  -5          HT3       THR  -5  -7.807  -6.903  10.952
    4    HA   THR  -5           HA       THR  -5  -8.389  -8.844  12.176
    5    HB   THR  -5           HB       THR  -5 -10.384  -6.866  13.226
    6    HG1  THR  -5           HG1      THR  -5  -8.868  -5.383  13.645
    7   1HG2  THR  -5          HG21      THR  -5  -8.081  -8.420  14.423
    8   2HG2  THR  -5          HG22      THR  -5  -9.796  -8.799  14.581
    9   3HG2  THR  -5          HG23      THR  -5  -9.144  -7.338  15.324
   10    H    GLU  -4           HN       GLU  -4 -11.254  -7.144  10.893
   11    HA   GLU  -4           HA       GLU  -4 -12.799  -9.642  11.054
   12   1HB   GLU  -4          HB1       GLU  -4 -13.579  -7.297  12.080
   13   2HB   GLU  -4          HB2       GLU  -4 -14.081  -6.999  10.420
   14   1HG   GLU  -4          HG1       GLU  -4 -14.922  -9.448  11.961
   15   2HG   GLU  -4          HG2       GLU  -4 -15.840  -7.947  11.983
   16    H    PHE  -3           HN       PHE  -3 -10.945  -9.716   9.190
   17    HA   PHE  -3           HA       PHE  -3 -11.474  -8.540   6.709
   18   1HB   PHE  -3          HB1       PHE  -3  -9.277  -9.412   7.196
   19   2HB   PHE  -3          HB2       PHE  -3  -9.910 -11.049   7.315
   20    HD1  PHE  -3           HD1      PHE  -3  -9.392  -8.219   4.919
   21    HD2  PHE  -3           HD2      PHE  -3 -10.026 -12.444   5.413
   22    HE1  PHE  -3           HE1      PHE  -3  -9.068  -8.552   2.476
   23    HE2  PHE  -3           HE2      PHE  -3  -9.752 -12.772   2.963
   24    HZ   PHE  -3           HZ       PHE  -3  -9.304 -10.820   1.486
   25    H    LYS  -2           HN       LYS  -2 -12.296  -9.314   4.825
   26    HA   LYS  -2           HA       LYS  -2 -13.904 -11.697   4.642
   27   1HB   LYS  -2          HB1       LYS  -2 -15.185  -9.507   5.645
   28   2HB   LYS  -2          HB2       LYS  -2 -15.422  -9.256   3.916
   29   1HG   LYS  -2          HG1       LYS  -2 -16.916 -10.919   3.765
   30   2HG   LYS  -2          HG2       LYS  -2 -15.912 -12.016   4.708
   31   1HD   LYS  -2          HD1       LYS  -2 -17.207  -9.868   6.261
   32   2HD   LYS  -2          HD2       LYS  -2 -18.317 -11.023   5.526
   33   1HE   LYS  -2          HE1       LYS  -2 -17.864 -11.889   7.671
   34   2HE   LYS  -2          HE2       LYS  -2 -16.878 -12.848   6.574
   35   1HZ   LYS  -2          HZ1       LYS  -2 -15.453 -12.361   8.312
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.029 -10.786   8.504
   37   3HZ   LYS  -2          HZ3       LYS  -2 -15.056 -11.164   7.177
   38    H    ALA  -1           HN       ALA  -1 -13.595 -12.458   2.696
   39    HA   ALA  -1           HA       ALA  -1 -11.891 -11.368   0.804
   40   1HB   ALA  -1          HB1       ALA  -1 -12.605 -13.247  -0.609
   41   2HB   ALA  -1          HB2       ALA  -1 -13.960 -13.543   0.481
   42   3HB   ALA  -1          HB3       ALA  -1 -12.305 -13.751   1.055
   43    H    GLY   1           HN       GLY   1 -12.150 -10.378  -1.159
   44   1HA   GLY   1          HA1       GLY   1 -14.759  -9.131  -1.752
   45   2HA   GLY   1          HA2       GLY   1 -13.208  -8.348  -2.010
   46    H    SER   2           HN       SER   2 -13.364  -8.003  -4.141
   47    HA   SER   2           HA       SER   2 -12.922 -10.209  -5.960
   48   1HB   SER   2          HB1       SER   2 -15.095  -8.347  -6.813
   49   2HB   SER   2          HB2       SER   2 -14.806 -10.028  -7.276
   50    HG   SER   2           HG       SER   2 -15.311 -10.434  -4.922
   51    H    ALA   3           HN       ALA   3 -11.719  -9.582  -7.728
   52    HA   ALA   3           HA       ALA   3 -10.148  -7.349  -7.643
   53   1HB   ALA   3          HB1       ALA   3  -9.756  -9.415  -8.960
   54   2HB   ALA   3          HB2       ALA   3  -9.412  -7.927  -9.843
   55   3HB   ALA   3          HB3       ALA   3 -10.899  -8.816 -10.164
   56    H    LYS   4           HN       LYS   4 -13.281  -7.536  -9.405
   57    HA   LYS   4           HA       LYS   4 -12.955  -4.992 -10.616
   58   1HB   LYS   4          HB1       LYS   4 -14.301  -6.920 -11.519
   59   2HB   LYS   4          HB2       LYS   4 -15.573  -6.428 -10.400
   60   1HG   LYS   4          HG1       LYS   4 -14.691  -4.088 -11.730
   61   2HG   LYS   4          HG2       LYS   4 -14.913  -5.325 -12.960
   62   1HD   LYS   4          HD1       LYS   4 -17.182  -5.412 -12.651
   63   2HD   LYS   4          HD2       LYS   4 -17.072  -4.997 -10.936
   64   1HE   LYS   4          HE1       LYS   4 -16.481  -3.023 -13.150
   65   2HE   LYS   4          HE2       LYS   4 -18.084  -3.211 -12.436
   66   1HZ   LYS   4          HZ1       LYS   4 -17.399  -2.347 -10.449
   67   2HZ   LYS   4          HZ2       LYS   4 -16.448  -1.448 -11.516
   68   3HZ   LYS   4          HZ3       LYS   4 -15.772  -2.757 -10.687
   69    H    LYS   5           HN       LYS   5 -13.350  -5.411  -7.460
   70    HA   LYS   5           HA       LYS   5 -14.992  -2.978  -7.143
   71   1HB   LYS   5          HB1       LYS   5 -14.659  -5.317  -5.262
   72   2HB   LYS   5          HB2       LYS   5 -15.290  -3.763  -4.732
   73   1HG   LYS   5          HG1       LYS   5 -17.060  -4.001  -6.538
   74   2HG   LYS   5          HG2       LYS   5 -16.511  -5.668  -6.726
   75   1HD   LYS   5          HD1       LYS   5 -17.084  -4.813  -3.950
   76   2HD   LYS   5          HD2       LYS   5 -18.483  -4.908  -5.020
   77   1HE   LYS   5          HE1       LYS   5 -18.266  -7.034  -3.943
   78   2HE   LYS   5          HE2       LYS   5 -17.753  -7.243  -5.617
   79   1HZ   LYS   5          HZ1       LYS   5 -16.170  -8.338  -4.278
   80   2HZ   LYS   5          HZ2       LYS   5 -16.053  -7.033  -3.199
   81   3HZ   LYS   5          HZ3       LYS   5 -15.431  -6.892  -4.766
   82    H    GLY   6           HN       GLY   6 -12.295  -4.758  -5.591
   83   1HA   GLY   6          HA1       GLY   6 -11.254  -2.652  -4.086
   84   2HA   GLY   6          HA2       GLY   6 -10.314  -4.003  -4.699
   85    H    ALA   7           HN       ALA   7 -10.639  -3.449  -7.503
   86    HA   ALA   7           HA       ALA   7  -8.564  -1.657  -7.995
   87   1HB   ALA   7          HB1       ALA   7 -10.668  -2.598  -9.944
   88   2HB   ALA   7          HB2       ALA   7  -9.196  -3.474  -9.523
   89   3HB   ALA   7          HB3       ALA   7  -9.089  -1.921 -10.349
   90    H    THR   8           HN       THR   8 -12.123  -1.068  -8.484
   91    HA   THR   8           HA       THR   8 -11.915   1.517  -9.455
   92    HB   THR   8           HB       THR   8 -14.163   1.740  -7.910
   93    HG1  THR   8           HG1      THR   8 -13.958  -0.411  -7.193
   94   1HG2  THR   8          HG21      THR   8 -14.142   2.204 -10.264
   95   2HG2  THR   8          HG22      THR   8 -15.372   0.975  -9.962
   96   3HG2  THR   8          HG23      THR   8 -13.812   0.512 -10.645
   97    H    LEU   9           HN       LEU   9 -11.734   0.538  -6.064
   98    HA   LEU   9           HA       LEU   9 -11.748   3.157  -4.955
   99   1HB   LEU   9          HB1       LEU   9 -10.656   0.611  -3.717
  100   2HB   LEU   9          HB2       LEU   9 -11.143   2.076  -2.867
  101    HG   LEU   9           HG       LEU   9 -13.030   0.346  -4.486
  102   1HD1  LEU   9          HD11      LEU   9 -13.877  -0.469  -2.388
  103   2HD1  LEU   9          HD12      LEU   9 -12.793   0.590  -1.485
  104   3HD1  LEU   9          HD13      LEU   9 -12.136  -0.753  -2.421
  105   1HD2  LEU   9          HD21      LEU   9 -13.773   2.682  -4.319
  106   2HD2  LEU   9          HD22      LEU   9 -13.560   2.630  -2.570
  107   3HD2  LEU   9          HD23      LEU   9 -14.791   1.625  -3.337
  108    H    PHE  10           HN       PHE  10  -9.106   0.770  -5.274
  109    HA   PHE  10           HA       PHE  10  -6.941   2.357  -4.622
  110   1HB   PHE  10          HB1       PHE  10  -6.984  -0.125  -4.923
  111   2HB   PHE  10          HB2       PHE  10  -6.982   0.127  -6.662
  112    HD1  PHE  10           HD1      PHE  10  -4.960   1.392  -7.689
  113    HD2  PHE  10           HD2      PHE  10  -4.991  -0.302  -3.736
  114    HE1  PHE  10           HE1      PHE  10  -2.468   1.369  -7.674
  115    HE2  PHE  10           HE2      PHE  10  -2.509  -0.204  -3.674
  116    HZ   PHE  10           HZ       PHE  10  -1.242   0.606  -5.649
  117    H    LYS  11           HN       LYS  11  -8.559   2.050  -7.752
  118    HA   LYS  11           HA       LYS  11  -6.626   3.499  -9.251
  119   1HB   LYS  11          HB1       LYS  11  -8.727   1.834  -9.863
  120   2HB   LYS  11          HB2       LYS  11  -9.290   3.403 -10.441
  121   1HG   LYS  11          HG1       LYS  11  -7.804   3.459 -12.126
  122   2HG   LYS  11          HG2       LYS  11  -6.494   2.859 -11.112
  123   1HD   LYS  11          HD1       LYS  11  -8.654   1.162 -12.383
  124   2HD   LYS  11          HD2       LYS  11  -7.000   1.326 -12.975
  125   1HE   LYS  11          HE1       LYS  11  -6.168   0.372 -10.848
  126   2HE   LYS  11          HE2       LYS  11  -7.829   0.172 -10.300
  127   1HZ   LYS  11          HZ1       LYS  11  -6.822  -1.881 -11.199
  128   2HZ   LYS  11          HZ2       LYS  11  -6.695  -1.139 -12.712
  129   3HZ   LYS  11          HZ3       LYS  11  -8.220  -1.410 -12.038
  130    H    THR  12           HN       THR  12  -8.879   4.696  -7.083
  131    HA   THR  12           HA       THR  12  -8.590   7.416  -8.073
  132    HB   THR  12           HB       THR  12 -10.787   6.293  -8.767
  133    HG1  THR  12           HG1      THR  12 -10.161   8.550  -8.872
  134   1HG2  THR  12          HG21      THR  12 -11.439   6.959  -5.911
  135   2HG2  THR  12          HG22      THR  12 -11.761   5.468  -6.798
  136   3HG2  THR  12          HG23      THR  12 -12.663   6.935  -7.180
  137    H    ARG  13           HN       ARG  13  -7.480   5.755  -5.899
  138    HA   ARG  13           HA       ARG  13  -7.715   7.646  -3.674
  139   1HB   ARG  13          HB1       ARG  13  -8.034   4.654  -3.475
  140   2HB   ARG  13          HB2       ARG  13  -7.629   5.653  -2.095
  141   1HG   ARG  13          HG1       ARG  13 -10.135   5.977  -3.730
  142   2HG   ARG  13          HG2       ARG  13 -10.025   4.992  -2.278
  143   1HD   ARG  13          HD1       ARG  13 -11.001   7.124  -1.714
  144   2HD   ARG  13          HD2       ARG  13  -9.382   7.043  -1.009
  145    HE   ARG  13           HE       ARG  13  -9.836   7.996  -3.586
  146   1HH1  ARG  13          HH11      ARG  13  -9.233   8.851  -0.251
  147   2HH1  ARG  13          HH12      ARG  13  -8.306  10.287  -0.489
  148   1HH2  ARG  13          HH21      ARG  13  -8.388  10.183  -3.907
  149   2HH2  ARG  13          HH22      ARG  13  -7.881  11.041  -2.495
  150    H    CYS  14           HN       CYS  14  -5.961   4.888  -5.031
  151    HA   CYS  14           HA       CYS  14  -3.502   5.744  -3.650
  152   1HB   CYS  14          HB1       CYS  14  -3.902   3.033  -4.851
  153   2HB   CYS  14          HB2       CYS  14  -2.803   3.517  -3.579
  154    H    LEU  15           HN       LEU  15  -4.881   4.951  -6.794
  155    HA   LEU  15           HA       LEU  15  -2.652   4.639  -8.365
  156   1HB   LEU  15          HB1       LEU  15  -5.116   4.409  -8.966
  157   2HB   LEU  15          HB2       LEU  15  -5.108   6.145  -9.247
  158    HG   LEU  15           HG       LEU  15  -3.248   5.804 -10.911
  159   1HD1  LEU  15          HD11      LEU  15  -2.361   3.682 -10.219
  160   2HD1  LEU  15          HD12      LEU  15  -3.011   3.509 -11.850
  161   3HD1  LEU  15          HD13      LEU  15  -3.921   2.898 -10.467
  162   1HD2  LEU  15          HD21      LEU  15  -5.285   6.124 -11.964
  163   2HD2  LEU  15          HD22      LEU  15  -5.982   4.650 -11.294
  164   3HD2  LEU  15          HD23      LEU  15  -4.796   4.553 -12.597
  165    H    GLN  16           HN       GLN  16  -4.078   7.714  -7.330
  166    HA   GLN  16           HA       GLN  16  -2.936   9.609  -8.831
  167   1HB   GLN  16          HB1       GLN  16  -2.784  10.927  -6.561
  168   2HB   GLN  16          HB2       GLN  16  -4.332  10.468  -7.253
  169   1HG   GLN  16          HG1       GLN  16  -4.291   8.434  -5.758
  170   2HG   GLN  16          HG2       GLN  16  -2.879   9.138  -4.966
  171   1HE2  GLN  16          HE21      GLN  16  -3.182  11.101  -3.742
  172   2HE2  GLN  16          HE22      GLN  16  -4.755  11.575  -3.221
  173    H    CYS  17           HN       CYS  17  -1.116   7.813  -6.366
  174    HA   CYS  17           HA       CYS  17   1.346   9.155  -7.257
  175   1HB   CYS  17          HB1       CYS  17   1.357   7.945  -4.568
  176   2HB   CYS  17          HB2       CYS  17   2.064   9.437  -5.163
  177    H    HIS  18           HN       HIS  18  -0.068   6.052  -6.347
  178    HA   HIS  18           HA       HIS  18   2.455   4.620  -6.621
  179   1HB   HIS  18          HB1       HIS  18  -0.259   3.964  -5.545
  180   2HB   HIS  18          HB2       HIS  18   0.877   2.680  -5.914
  181    HD1  HIS  18           HD1      HIS  18   3.363   3.088  -4.548
  182    HD2  HIS  18           HD2      HIS  18  -0.171   4.806  -3.102
  183    HE1  HIS  18           HE1      HIS  18   3.750   3.521  -2.080
  184    H    THR  19           HN       THR  19   2.263   2.435  -7.572
  185    HA   THR  19           HA       THR  19   0.734   2.280 -10.068
  186    HB   THR  19           HB       THR  19   3.047   0.975 -10.677
  187    HG1  THR  19           HG1      THR  19   4.572   2.837 -10.124
  188   1HG2  THR  19          HG21      THR  19   2.329   3.864 -11.154
  189   2HG2  THR  19          HG22      THR  19   2.025   2.490 -12.217
  190   3HG2  THR  19          HG23      THR  19   3.676   3.046 -11.945
  191    H    VAL  20           HN       VAL  20  -0.487   0.459 -10.124
  192    HA   VAL  20           HA       VAL  20  -0.272  -1.569  -8.113
  193    HB   VAL  20           HB       VAL  20  -2.303  -0.489  -9.449
  194   1HG1  VAL  20          HG11      VAL  20  -1.901  -1.579 -11.556
  195   2HG1  VAL  20          HG12      VAL  20  -3.415  -2.146 -10.852
  196   3HG1  VAL  20          HG13      VAL  20  -1.977  -3.165 -10.784
  197   1HG2  VAL  20          HG21      VAL  20  -2.591  -1.620  -7.362
  198   2HG2  VAL  20          HG22      VAL  20  -2.337  -3.190  -8.122
  199   3HG2  VAL  20          HG23      VAL  20  -3.768  -2.242  -8.519
  200    H    GLU  21           HN       GLU  21   0.799  -1.375 -11.368
  201    HA   GLU  21           HA       GLU  21   1.582  -4.214 -11.431
  202   1HB   GLU  21          HB1       GLU  21   1.800  -3.533 -14.011
  203   2HB   GLU  21          HB2       GLU  21   0.284  -4.100 -13.337
  204   1HG   GLU  21          HG1       GLU  21   0.092  -2.111 -14.850
  205   2HG   GLU  21          HG2       GLU  21  -0.608  -1.886 -13.250
  206    H    LYS  22           HN       LYS  22   3.669  -4.255 -13.211
  207    HA   LYS  22           HA       LYS  22   5.520  -2.322 -12.042
  208   1HB   LYS  22          HB1       LYS  22   5.689  -5.115 -12.453
  209   2HB   LYS  22          HB2       LYS  22   6.970  -4.342 -13.401
  210   1HG   LYS  22          HG1       LYS  22   8.000  -3.449 -11.568
  211   2HG   LYS  22          HG2       LYS  22   6.489  -3.266 -10.678
  212   1HD   LYS  22          HD1       LYS  22   6.452  -5.594 -10.134
  213   2HD   LYS  22          HD2       LYS  22   7.820  -5.915 -11.199
  214   1HE   LYS  22          HE1       LYS  22   8.679  -5.900  -8.977
  215   2HE   LYS  22          HE2       LYS  22   9.208  -4.409  -9.734
  216   1HZ   LYS  22          HZ1       LYS  22   7.230  -3.350  -8.533
  217   2HZ   LYS  22          HZ2       LYS  22   8.547  -3.809  -7.583
  218   3HZ   LYS  22          HZ3       LYS  22   7.161  -4.771  -7.616
  219    H    GLY  23           HN       GLY  23   3.881  -1.621 -14.464
  220   1HA   GLY  23          HA1       GLY  23   6.049  -1.243 -16.437
  221   2HA   GLY  23          HA2       GLY  23   4.333  -1.174 -16.799
  222    H    GLY  24           HN       GLY  24   4.065   0.509 -14.224
  223   1HA   GLY  24          HA1       GLY  24   4.386   3.106 -15.469
  224   2HA   GLY  24          HA2       GLY  24   3.517   2.745 -13.987
  225    HA   PRO  25           HA       PRO  25   8.217   3.964 -13.287
  226   1HB   PRO  25          HB1       PRO  25   8.097   6.708 -13.533
  227   2HB   PRO  25          HB2       PRO  25   8.732   5.620 -14.771
  228   1HG   PRO  25          HG1       PRO  25   6.035   6.895 -14.567
  229   2HG   PRO  25          HG2       PRO  25   7.052   6.643 -15.998
  230   1HD   PRO  25          HD1       PRO  25   4.942   5.063 -15.464
  231   2HD   PRO  25          HD2       PRO  25   6.423   4.423 -16.209
  232    H    HIS  26           HN       HIS  26   8.858   4.912 -11.283
  233    HA   HIS  26           HA       HIS  26   6.918   4.911  -9.246
  234   1HB   HIS  26          HB1       HIS  26   9.770   5.917  -9.333
  235   2HB   HIS  26          HB2       HIS  26   8.824   5.812  -7.858
  236    HD2  HIS  26           HD2      HIS  26  10.989   3.747 -10.186
  237    HE1  HIS  26           HE1      HIS  26   9.630   1.069  -7.185
  238    HE2  HIS  26           HE2      HIS  26  11.255   1.383  -9.110
  239    H    LYS  27           HN       LYS  27   5.369   6.482  -9.077
  240    HA   LYS  27           HA       LYS  27   5.865   9.195  -9.946
  241   1HB   LYS  27          HB1       LYS  27   3.429   7.604  -9.210
  242   2HB   LYS  27          HB2       LYS  27   3.341   9.352  -9.330
  243   1HG   LYS  27          HG1       LYS  27   3.878   9.340 -11.632
  244   2HG   LYS  27          HG2       LYS  27   4.447   7.668 -11.567
  245   1HD   LYS  27          HD1       LYS  27   1.588   8.642 -11.315
  246   2HD   LYS  27          HD2       LYS  27   2.274   7.661 -12.616
  247   1HE   LYS  27          HE1       LYS  27   2.418   5.754 -11.277
  248   2HE   LYS  27          HE2       LYS  27   2.379   6.684  -9.779
  249   1HZ   LYS  27          HZ1       LYS  27   0.060   7.170 -10.157
  250   2HZ   LYS  27          HZ2       LYS  27   0.300   5.498 -10.186
  251   3HZ   LYS  27          HZ3       LYS  27   0.088   6.341 -11.636
  252    H    VAL  28           HN       VAL  28   3.790  10.019  -7.752
  253    HA   VAL  28           HA       VAL  28   5.576  11.160  -5.902
  254    HB   VAL  28           HB       VAL  28   2.665  10.664  -5.322
  255   1HG1  VAL  28          HG11      VAL  28   3.833  11.680  -3.497
  256   2HG1  VAL  28          HG12      VAL  28   2.883  12.943  -4.280
  257   3HG1  VAL  28          HG13      VAL  28   4.620  12.840  -4.569
  258   1HG2  VAL  28          HG21      VAL  28   3.021  11.624  -7.674
  259   2HG2  VAL  28          HG22      VAL  28   3.636  13.065  -6.866
  260   3HG2  VAL  28          HG23      VAL  28   1.977  12.537  -6.584
  261    H    GLY  29           HN       GLY  29   4.149   8.050  -6.093
  262   1HA   GLY  29          HA1       GLY  29   5.266   7.233  -3.490
  263   2HA   GLY  29          HA2       GLY  29   3.713   6.644  -4.060
  264    HA   PRO  30           HA       PRO  30   7.496   4.086  -5.657
  265   1HB   PRO  30          HB1       PRO  30   7.563   2.097  -3.822
  266   2HB   PRO  30          HB2       PRO  30   8.493   3.591  -3.656
  267   1HG   PRO  30          HG1       PRO  30   5.868   2.849  -2.413
  268   2HG   PRO  30          HG2       PRO  30   7.283   3.611  -1.662
  269   1HD   PRO  30          HD1       PRO  30   5.132   5.036  -2.442
  270   2HD   PRO  30          HD2       PRO  30   6.781   5.691  -2.529
  271    H    ASN  31           HN       ASN  31   7.453   1.705  -6.273
  272    HA   ASN  31           HA       ASN  31   4.847   1.040  -7.293
  273   1HB   ASN  31          HB1       ASN  31   6.975   0.821  -8.587
  274   2HB   ASN  31          HB2       ASN  31   7.480  -0.463  -7.498
  275   1HD2  ASN  31          HD21      ASN  31   5.323   0.362 -10.132
  276   2HD2  ASN  31          HD22      ASN  31   4.906  -1.278 -10.505
  277    H    LEU  32           HN       LEU  32   3.443  -0.456  -6.484
  278    HA   LEU  32           HA       LEU  32   3.964  -1.726  -3.911
  279   1HB   LEU  32          HB1       LEU  32   1.408  -1.054  -5.371
  280   2HB   LEU  32          HB2       LEU  32   1.469  -1.868  -3.821
  281    HG   LEU  32           HG       LEU  32   2.325   0.974  -4.416
  282   1HD1  LEU  32          HD11      LEU  32   0.146  -0.221  -2.695
  283   2HD1  LEU  32          HD12      LEU  32  -0.062   0.743  -4.157
  284   3HD1  LEU  32          HD13      LEU  32   0.593   1.487  -2.699
  285   1HD2  LEU  32          HD21      LEU  32   3.000   1.230  -2.147
  286   2HD2  LEU  32          HD22      LEU  32   3.847  -0.190  -2.762
  287   3HD2  LEU  32          HD23      LEU  32   2.434  -0.386  -1.725
  288    H    HIS  33           HN       HIS  33   3.700  -2.633  -7.175
  289    HA   HIS  33           HA       HIS  33   2.466  -5.146  -7.127
  290   1HB   HIS  33          HB1       HIS  33   2.894  -3.681  -9.123
  291   2HB   HIS  33          HB2       HIS  33   4.591  -4.139  -9.030
  292    HD2  HIS  33           HD2      HIS  33   1.684  -6.657  -8.549
  293    HE1  HIS  33           HE1      HIS  33   3.623  -7.643 -12.201
  294    HE2  HIS  33           HE2      HIS  33   1.886  -8.388 -10.501
  295    H    GLY  34           HN       GLY  34   3.255  -6.433  -5.480
  296   1HA   GLY  34          HA1       GLY  34   4.618  -8.450  -5.291
  297   2HA   GLY  34          HA2       GLY  34   5.997  -7.483  -5.771
  298    H    ILE  35           HN       ILE  35   4.041  -5.752  -3.519
  299    HA   ILE  35           HA       ILE  35   6.082  -5.910  -1.566
  300    HB   ILE  35           HB       ILE  35   4.677  -4.649  -0.052
  301   1HG1  ILE  35          HG11      ILE  35   2.493  -5.201  -2.018
  302   2HG1  ILE  35          HG12      ILE  35   2.421  -5.062  -0.263
  303   1HG2  ILE  35          HG21      ILE  35   6.122  -3.571  -1.642
  304   2HG2  ILE  35          HG22      ILE  35   4.667  -2.606  -1.400
  305   3HG2  ILE  35          HG23      ILE  35   4.847  -3.578  -2.860
  306   1HD1  ILE  35          HD11      ILE  35   2.706  -2.598  -0.492
  307   2HD1  ILE  35          HD12      ILE  35   1.234  -3.208  -1.249
  308   3HD1  ILE  35          HD13      ILE  35   2.628  -2.790  -2.244
  309    H    PHE  36           HN       PHE  36   3.013  -7.681  -1.784
  310    HA   PHE  36           HA       PHE  36   2.855  -8.712   0.764
  311   1HB   PHE  36          HB1       PHE  36   1.980  -9.842  -1.885
  312   2HB   PHE  36          HB2       PHE  36   1.673 -10.682  -0.367
  313    HD1  PHE  36           HD1      PHE  36   1.015  -8.561   1.494
  314    HD2  PHE  36           HD2      PHE  36  -0.071  -9.004  -2.645
  315    HE1  PHE  36           HE1      PHE  36  -0.979  -7.122   1.871
  316    HE2  PHE  36           HE2      PHE  36  -2.067  -7.565  -2.272
  317    HZ   PHE  36           HZ       PHE  36  -2.515  -6.614  -0.017
  318    H    GLY  37           HN       GLY  37   4.226  -9.741   1.915
  319   1HA   GLY  37          HA1       GLY  37   5.391 -11.707   2.547
  320   2HA   GLY  37          HA2       GLY  37   5.855 -11.950   0.874
  321    H    ARG  38           HN       ARG  38   6.395  -8.746   1.330
  322    HA   ARG  38           HA       ARG  38   9.217  -9.115   2.104
  323   1HB   ARG  38          HB1       ARG  38   7.844  -7.365   0.082
  324   2HB   ARG  38          HB2       ARG  38   9.353  -6.817   0.796
  325   1HG   ARG  38          HG1       ARG  38  10.600  -8.320  -0.350
  326   2HG   ARG  38          HG2       ARG  38   9.363  -9.575  -0.262
  327   1HD   ARG  38          HD1       ARG  38   9.401  -9.037  -2.538
  328   2HD   ARG  38          HD2       ARG  38   8.051  -8.079  -1.927
  329    HE   ARG  38           HE       ARG  38  10.106  -7.041  -1.479
  330   1HH1  ARG  38          HH21      ARG  38   8.422  -7.803  -4.387
  331   2HH1  ARG  38          HH22      ARG  38   8.608  -6.270  -5.069
  332   1HH2  ARG  38          HH11      ARG  38  10.898  -4.891  -3.170
  333   2HH2  ARG  38          HH12      ARG  38  10.460  -5.269  -4.781
  334    H    HIS  39           HN       HIS  39  10.175  -7.043   3.000
  335    HA   HIS  39           HA       HIS  39   8.470  -6.098   5.169
  336   1HB   HIS  39          HB1       HIS  39  11.434  -5.609   4.754
  337   2HB   HIS  39          HB2       HIS  39  10.518  -5.417   6.251
  338    HD2  HIS  39           HD2      HIS  39  10.134  -7.535   7.754
  339    HE1  HIS  39           HE1      HIS  39  11.807 -10.478   5.177
  340    HE2  HIS  39           HE2      HIS  39  10.791 -10.051   7.465
  341    H    SER  40           HN       SER  40   8.577  -3.743   5.758
  342    HA   SER  40           HA       SER  40   7.845  -2.091   3.643
  343   1HB   SER  40          HB1       SER  40   8.959  -0.841   6.123
  344   2HB   SER  40          HB2       SER  40   7.592  -0.339   5.140
  345    HG   SER  40           HG       SER  40   6.602  -2.377   5.968
  346    H    GLY  41           HN       GLY  41   8.833  -0.425   2.545
  347   1HA   GLY  41          HA1       GLY  41  10.554   0.868   1.711
  348   2HA   GLY  41          HA2       GLY  41  11.595   0.261   2.976
  349    H    GLN  42           HN       GLN  42  10.010  -1.573   0.256
  350    HA   GLN  42           HA       GLN  42  12.725  -2.245  -0.628
  351   1HB   GLN  42          HB1       GLN  42  10.398  -4.125  -0.395
  352   2HB   GLN  42          HB2       GLN  42  11.883  -4.521  -1.252
  353   1HG   GLN  42          HG1       GLN  42  13.131  -4.008   0.882
  354   2HG   GLN  42          HG2       GLN  42  11.568  -3.909   1.686
  355   1HE2  GLN  42          HE21      GLN  42  12.229  -5.711   3.039
  356   2HE2  GLN  42          HE22      GLN  42  12.240  -7.318   2.414
  357    H    ALA  43           HN       ALA  43  10.753  -0.240  -1.914
  358    HA   ALA  43           HA       ALA  43   9.956  -1.231  -4.412
  359   1HB   ALA  43          HB1       ALA  43   9.135   0.841  -3.378
  360   2HB   ALA  43          HB2       ALA  43   9.650   1.072  -5.049
  361   3HB   ALA  43          HB3       ALA  43  10.684   1.608  -3.726
  362    H    GLU  44           HN       GLU  44  10.911  -1.595  -6.311
  363    HA   GLU  44           HA       GLU  44  13.731  -1.587  -6.581
  364   1HB   GLU  44          HB1       GLU  44  11.739  -2.251  -8.764
  365   2HB   GLU  44          HB2       GLU  44  13.404  -2.805  -8.617
  366   1HG   GLU  44          HG1       GLU  44  12.233  -4.661  -7.888
  367   2HG   GLU  44          HG2       GLU  44  12.624  -3.862  -6.378
  368    H    GLY  45           HN       GLY  45  14.215   0.654  -6.322
  369   1HA   GLY  45          HA1       GLY  45  15.448   2.246  -7.662
  370   2HA   GLY  45          HA2       GLY  45  14.158   2.186  -8.843
  371    H    TYR  46           HN       TYR  46  13.527   2.531  -5.386
  372    HA   TYR  46           HA       TYR  46  13.142   5.392  -5.552
  373   1HB   TYR  46          HB1       TYR  46  11.061   4.428  -6.401
  374   2HB   TYR  46          HB2       TYR  46  10.852   3.551  -4.892
  375    HD1  TYR  46           HD1      TYR  46  10.542   6.780  -6.586
  376    HD2  TYR  46           HD2      TYR  46  10.372   4.768  -2.794
  377    HE1  TYR  46           HE1      TYR  46   9.226   8.678  -5.654
  378    HE2  TYR  46           HE2      TYR  46   8.961   6.604  -1.874
  379    HH   TYR  46           HH       TYR  46   7.527   8.998  -3.883
  380    H    SER  47           HN       SER  47  13.411   6.481  -3.685
  381    HA   SER  47           HA       SER  47  14.490   5.078  -1.408
  382   1HB   SER  47          HB1       SER  47  14.259   7.929  -1.013
  383   2HB   SER  47          HB2       SER  47  15.708   6.929  -1.133
  384    HG   SER  47           HG       SER  47  15.922   7.486  -3.156
  385    H    TYR  48           HN       TYR  48  13.828   5.196   0.671
  386    HA   TYR  48           HA       TYR  48  11.100   6.019   1.360
  387   1HB   TYR  48          HB1       TYR  48  12.787   3.645   2.134
  388   2HB   TYR  48          HB2       TYR  48  11.347   4.099   3.043
  389    HD1  TYR  48           HD1      TYR  48   9.123   4.057   1.974
  390    HD2  TYR  48           HD2      TYR  48  12.621   2.580  -0.043
  391    HE1  TYR  48           HE1      TYR  48   7.675   2.723   0.456
  392    HE2  TYR  48           HE2      TYR  48  11.184   1.242  -1.567
  393    HH   TYR  48           HH       TYR  48   8.171   0.354  -0.842
  394    H    THR  49           HN       THR  49  10.798   6.544   3.778
  395    HA   THR  49           HA       THR  49  12.733   8.454   4.708
  396    HB   THR  49           HB       THR  49  11.122   8.403   6.784
  397    HG1  THR  49           HG1      THR  49   9.228   7.645   4.893
  398   1HG2  THR  49          HG21      THR  49   9.623   9.990   5.630
  399   2HG2  THR  49          HG22      THR  49  10.373   9.533   4.101
  400   3HG2  THR  49          HG23      THR  49  11.336  10.312   5.358
  401    H    ASP  50           HN       ASP  50  13.506   8.554   6.950
  402    HA   ASP  50           HA       ASP  50  15.045   6.406   7.776
  403   1HB   ASP  50          HB1       ASP  50  15.746   8.494   8.506
  404   2HB   ASP  50          HB2       ASP  50  14.130   8.974   9.018
  405    H    ALA  51           HN       ALA  51  11.756   7.238   8.704
  406    HA   ALA  51           HA       ALA  51  11.601   5.366  10.877
  407   1HB   ALA  51          HB1       ALA  51   9.471   7.095   9.621
  408   2HB   ALA  51          HB2       ALA  51  10.509   7.555  10.970
  409   3HB   ALA  51          HB3       ALA  51   9.348   6.241  11.161
  410    H    ASN  52           HN       ASN  52  10.534   5.321   7.461
  411    HA   ASN  52           HA       ASN  52   8.776   3.091   7.812
  412   1HB   ASN  52          HB1       ASN  52   8.115   4.312   5.998
  413   2HB   ASN  52          HB2       ASN  52   9.761   4.730   5.537
  414   1HD2  ASN  52          HD21      ASN  52   7.156   2.483   5.030
  415   2HD2  ASN  52          HD22      ASN  52   7.943   1.668   3.727
  416    H    ILE  53           HN       ILE  53  12.156   3.406   6.819
  417    HA   ILE  53           HA       ILE  53  12.571   0.692   6.143
  418    HB   ILE  53           HB       ILE  53  14.507   2.842   6.956
  419   1HG1  ILE  53          HG11      ILE  53  13.860   1.758   4.194
  420   2HG1  ILE  53          HG12      ILE  53  13.143   3.221   4.864
  421   1HG2  ILE  53          HG21      ILE  53  16.284   1.475   5.968
  422   2HG2  ILE  53          HG22      ILE  53  15.126   0.190   5.629
  423   3HG2  ILE  53          HG23      ILE  53  15.511   0.609   7.297
  424   1HD1  ILE  53          HD11      ILE  53  16.085   2.781   4.323
  425   2HD1  ILE  53          HD12      ILE  53  15.377   4.243   5.009
  426   3HD1  ILE  53          HD13      ILE  53  14.983   3.765   3.359
  427    H    LYS  54           HN       LYS  54  14.011   2.306   9.032
  428    HA   LYS  54           HA       LYS  54  14.531   0.284  10.687
  429   1HB   LYS  54          HB1       LYS  54  13.277   2.947  11.255
  430   2HB   LYS  54          HB2       LYS  54  13.680   1.834  12.564
  431   1HG   LYS  54          HG1       LYS  54  15.999   1.725  11.257
  432   2HG   LYS  54          HG2       LYS  54  15.485   3.330  10.730
  433   1HD   LYS  54          HD1       LYS  54  14.992   3.142  13.527
  434   2HD   LYS  54          HD2       LYS  54  16.642   2.575  13.226
  435   1HE   LYS  54          HE1       LYS  54  16.697   4.974  13.563
  436   2HE   LYS  54          HE2       LYS  54  17.046   4.625  11.867
  437   1HZ   LYS  54          HZ1       LYS  54  14.537   5.663  13.031
  438   2HZ   LYS  54          HZ2       LYS  54  14.604   4.988  11.479
  439   3HZ   LYS  54          HZ3       LYS  54  15.519   6.366  11.840
  440    H    LYS  55           HN       LYS  55  11.361   0.864   9.549
  441    HA   LYS  55           HA       LYS  55   9.947  -0.389  11.744
  442   1HB   LYS  55          HB1       LYS  55   9.035   1.540  10.568
  443   2HB   LYS  55          HB2       LYS  55   9.003   0.640   9.070
  444   1HG   LYS  55          HG1       LYS  55   6.803   0.661   9.734
  445   2HG   LYS  55          HG2       LYS  55   7.359  -0.918  10.257
  446   1HD   LYS  55          HD1       LYS  55   7.335   1.394  12.170
  447   2HD   LYS  55          HD2       LYS  55   5.851   0.510  11.820
  448   1HE   LYS  55          HE1       LYS  55   8.412  -0.639  12.950
  449   2HE   LYS  55          HE2       LYS  55   6.899  -0.388  13.822
  450   1HZ   LYS  55          HZ1       LYS  55   5.837  -1.981  12.301
  451   2HZ   LYS  55          HZ2       LYS  55   7.101  -2.681  13.174
  452   3HZ   LYS  55          HZ3       LYS  55   7.335  -2.259  11.555
  453    H    ASN  56           HN       ASN  56  10.929  -1.340   8.521
  454    HA   ASN  56           HA       ASN  56  10.574  -3.131   7.190
  455   1HB   ASN  56          HB1       ASN  56  12.263  -3.753   9.493
  456   2HB   ASN  56          HB2       ASN  56  11.671  -5.174   8.663
  457   1HD2  ASN  56          HD21      ASN  56  13.479  -2.108   8.041
  458   2HD2  ASN  56          HD22      ASN  56  14.067  -2.818   6.601
  459    H    VAL  57           HN       VAL  57   8.059  -2.772   8.148
  460    HA   VAL  57           HA       VAL  57   6.987  -5.024   9.505
  461    HB   VAL  57           HB       VAL  57   6.033  -2.536   8.787
  462   1HG1  VAL  57          HG11      VAL  57   4.226  -4.573   7.487
  463   2HG1  VAL  57          HG12      VAL  57   5.116  -3.307   6.641
  464   3HG1  VAL  57          HG13      VAL  57   3.844  -2.877   7.785
  465   1HG2  VAL  57          HG21      VAL  57   5.682  -3.834  10.829
  466   2HG2  VAL  57          HG22      VAL  57   4.547  -4.872   9.965
  467   3HG2  VAL  57          HG23      VAL  57   4.176  -3.165  10.200
  468    H    LEU  58           HN       LEU  58   6.246  -6.956   8.758
  469    HA   LEU  58           HA       LEU  58   6.868  -7.616   6.017
  470   1HB   LEU  58          HB1       LEU  58   7.474  -9.158   7.845
  471   2HB   LEU  58          HB2       LEU  58   5.770  -9.368   8.226
  472    HG   LEU  58           HG       LEU  58   5.510 -10.167   5.773
  473   1HD1  LEU  58          HD11      LEU  58   7.719  -9.375   5.023
  474   2HD1  LEU  58          HD12      LEU  58   7.526 -11.110   4.771
  475   3HD1  LEU  58          HD13      LEU  58   8.494 -10.519   6.121
  476   1HD2  LEU  58          HD21      LEU  58   5.471 -11.681   7.800
  477   2HD2  LEU  58          HD22      LEU  58   7.191 -11.957   7.531
  478   3HD2  LEU  58          HD23      LEU  58   6.020 -12.439   6.305
  479    H    TRP  59           HN       TRP  59   5.485  -6.771   4.613
  480    HA   TRP  59           HA       TRP  59   2.791  -6.177   5.009
  481   1HB   TRP  59          HB1       TRP  59   4.339  -6.680   2.470
  482   2HB   TRP  59          HB2       TRP  59   2.711  -6.030   2.510
  483    HD1  TRP  59           HD1      TRP  59   5.988  -4.872   1.940
  484    HE1  TRP  59           HE1      TRP  59   6.285  -2.386   2.559
  485    HE3  TRP  59           HE3      TRP  59   1.760  -4.148   4.726
  486    HZ2  TRP  59           HZ2      TRP  59   4.999  -0.398   4.163
  487    HZ3  TRP  59           HZ3      TRP  59   1.312  -1.952   5.752
  488    HH2  TRP  59           HH2      TRP  59   2.898  -0.078   5.485
  489    H    ASP  60           HN       ASP  60   1.427  -7.657   5.620
  490    HA   ASP  60           HA       ASP  60   1.020 -10.172   4.177
  491   1HB   ASP  60          HB1       ASP  60   1.376 -11.101   6.184
  492   2HB   ASP  60          HB2       ASP  60   1.388  -9.534   6.974
  493    H    GLU  61           HN       GLU  61  -1.462 -10.847   5.003
  494    HA   GLU  61           HA       GLU  61  -3.148  -9.256   3.364
  495   1HB   GLU  61          HB1       GLU  61  -3.250 -11.842   4.145
  496   2HB   GLU  61          HB2       GLU  61  -4.414 -11.153   5.272
  497   1HG   GLU  61          HG1       GLU  61  -5.854 -11.599   3.571
  498   2HG   GLU  61          HG2       GLU  61  -5.304 -10.017   3.011
  499    H    ASN  62           HN       ASN  62  -3.200  -9.832   6.902
  500    HA   ASN  62           HA       ASN  62  -5.080  -7.712   7.360
  501   1HB   ASN  62          HB1       ASN  62  -5.164  -9.718   8.693
  502   2HB   ASN  62          HB2       ASN  62  -3.503  -9.503   9.215
  503   1HD2  ASN  62          HD21      ASN  62  -3.052  -7.957  10.798
  504   2HD2  ASN  62          HD22      ASN  62  -4.300  -7.236  11.751
  505    H    ASN  63           HN       ASN  63  -1.557  -8.084   8.035
  506    HA   ASN  63           HA       ASN  63  -1.042  -5.732   9.325
  507   1HB   ASN  63          HB1       ASN  63   0.726  -7.186   9.226
  508   2HB   ASN  63          HB2       ASN  63   0.531  -7.494   7.512
  509   1HD2  ASN  63          HD21      ASN  63   1.783  -5.105   9.848
  510   2HD2  ASN  63          HD22      ASN  63   2.647  -4.309   8.579
  511    H    MET  64           HN       MET  64  -1.336  -5.958   5.720
  512    HA   MET  64           HA       MET  64  -0.473  -3.389   5.119
  513   1HB   MET  64          HB1       MET  64  -0.976  -5.184   3.485
  514   2HB   MET  64          HB2       MET  64  -2.692  -4.885   3.724
  515   1HG   MET  64          HG1       MET  64  -2.433  -2.619   2.882
  516   2HG   MET  64          HG2       MET  64  -0.709  -2.870   2.687
  517   1HE   MET  64          HE1       MET  64  -4.011  -4.809   0.097
  518   2HE   MET  64          HE2       MET  64  -4.305  -3.628   1.375
  519   3HE   MET  64          HE3       MET  64  -3.750  -5.251   1.786
  520    H    SER  65           HN       SER  65  -3.710  -4.332   6.275
  521    HA   SER  65           HA       SER  65  -4.865  -1.747   6.110
  522   1HB   SER  65          HB1       SER  65  -5.631  -4.138   7.784
  523   2HB   SER  65          HB2       SER  65  -6.587  -2.668   7.669
  524    HG   SER  65           HG       SER  65  -6.101  -4.641   5.740
  525    H    GLU  66           HN       GLU  66  -3.061  -3.352   8.697
  526    HA   GLU  66           HA       GLU  66  -3.474  -1.758  10.869
  527   1HB   GLU  66          HB1       GLU  66  -2.064  -3.646  11.095
  528   2HB   GLU  66          HB2       GLU  66  -0.989  -3.100   9.812
  529   1HG   GLU  66          HG1       GLU  66  -0.350  -1.169  11.296
  530   2HG   GLU  66          HG2       GLU  66  -1.252  -1.960  12.589
  531    H    TYR  67           HN       TYR  67  -1.072  -1.148   8.328
  532    HA   TYR  67           HA       TYR  67  -0.394   1.502   9.142
  533   1HB   TYR  67          HB1       TYR  67   1.241   0.087   8.113
  534   2HB   TYR  67          HB2       TYR  67   0.227  -0.150   6.702
  535    HD1  TYR  67           HD1      TYR  67   0.548   1.174   4.793
  536    HD2  TYR  67           HD2      TYR  67   2.045   2.503   8.594
  537    HE1  TYR  67           HE1      TYR  67   1.853   2.960   3.648
  538    HE2  TYR  67           HE2      TYR  67   3.397   4.258   7.466
  539    HH   TYR  67           HH       TYR  67   4.387   4.666   5.295
  540    H    LEU  68           HN       LEU  68  -2.545   0.205   6.560
  541    HA   LEU  68           HA       LEU  68  -2.963   2.623   5.227
  542   1HB   LEU  68          HB1       LEU  68  -4.695   0.198   5.565
  543   2HB   LEU  68          HB2       LEU  68  -5.213   1.576   4.611
  544    HG   LEU  68           HG       LEU  68  -2.825  -0.204   4.080
  545   1HD1  LEU  68          HD11      LEU  68  -5.053  -1.075   3.508
  546   2HD1  LEU  68          HD12      LEU  68  -4.116  -0.727   2.055
  547   3HD1  LEU  68          HD13      LEU  68  -5.385   0.383   2.573
  548   1HD2  LEU  68          HD21      LEU  68  -3.744   2.164   2.424
  549   2HD2  LEU  68          HD22      LEU  68  -2.362   1.115   2.110
  550   3HD2  LEU  68          HD23      LEU  68  -2.342   2.208   3.493
  551    H    THR  69           HN       THR  69  -4.672   1.447   8.145
  552    HA   THR  69           HA       THR  69  -6.708   3.357   8.215
  553    HB   THR  69           HB       THR  69  -5.497   2.465  10.783
  554    HG1  THR  69           HG1      THR  69  -5.412   0.583   9.651
  555   1HG2  THR  69          HG21      THR  69  -7.669   3.776  10.635
  556   2HG2  THR  69          HG22      THR  69  -7.764   2.236  11.491
  557   3HG2  THR  69          HG23      THR  69  -8.363   2.364   9.838
  558    H    ASN  70           HN       ASN  70  -3.364   3.642   9.391
  559    HA   ASN  70           HA       ASN  70  -3.496   6.491   9.216
  560   1HB   ASN  70          HB1       ASN  70  -4.528   5.983  11.477
  561   2HB   ASN  70          HB2       ASN  70  -2.944   5.404  11.982
  562   1HD2  ASN  70          HD21      ASN  70  -4.428   7.634  13.085
  563   2HD2  ASN  70          HD22      ASN  70  -3.248   8.889  12.955
  564    HA   PRO  71           HA       PRO  71   0.662   4.817   8.149
  565   1HB   PRO  71          HB1       PRO  71   1.232   6.939   6.490
  566   2HB   PRO  71          HB2       PRO  71   0.427   5.455   5.973
  567   1HG   PRO  71          HG1       PRO  71  -0.760   8.104   6.696
  568   2HG   PRO  71          HG2       PRO  71  -1.195   7.003   5.375
  569   1HD   PRO  71          HD1       PRO  71  -2.654   7.151   7.625
  570   2HD   PRO  71          HD2       PRO  71  -2.416   5.612   6.771
  571    H    LYS  72           HN       LYS  72  -0.252   8.107   9.066
  572    HA   LYS  72           HA       LYS  72   2.334   9.025   9.781
  573   1HB   LYS  72          HB1       LYS  72  -0.384  10.073   9.833
  574   2HB   LYS  72          HB2       LYS  72   0.551  10.578  11.231
  575   1HG   LYS  72          HG1       LYS  72   0.701  12.236   9.483
  576   2HG   LYS  72          HG2       LYS  72   2.275  11.495   9.745
  577   1HD   LYS  72          HD1       LYS  72   1.962  10.107   7.750
  578   2HD   LYS  72          HD2       LYS  72   0.364  10.813   7.502
  579   1HE   LYS  72          HE1       LYS  72   1.260  12.924   6.967
  580   2HE   LYS  72          HE2       LYS  72   2.837  12.517   7.626
  581   1HZ   LYS  72          HZ1       LYS  72   2.359  12.539   5.055
  582   2HZ   LYS  72          HZ2       LYS  72   1.879  10.948   5.360
  583   3HZ   LYS  72          HZ3       LYS  72   3.447  11.437   5.751
  584    H    LYS  73           HN       LYS  73  -0.227   7.445  11.624
  585    HA   LYS  73           HA       LYS  73   1.053   7.886  14.150
  586   1HB   LYS  73          HB1       LYS  73  -1.326   7.660  14.153
  587   2HB   LYS  73          HB2       LYS  73  -1.240   6.096  13.357
  588   1HG   LYS  73          HG1       LYS  73  -1.765   5.800  15.701
  589   2HG   LYS  73          HG2       LYS  73  -0.172   5.138  15.358
  590   1HD   LYS  73          HD1       LYS  73   0.550   7.608  16.147
  591   2HD   LYS  73          HD2       LYS  73  -0.953   7.453  17.053
  592   1HE   LYS  73          HE1       LYS  73   0.594   6.623  18.560
  593   2HE   LYS  73          HE2       LYS  73   0.033   5.147  17.779
  594   1HZ   LYS  73          HZ1       LYS  73   2.601   6.544  17.474
  595   2HZ   LYS  73          HZ2       LYS  73   2.029   5.562  16.224
  596   3HZ   LYS  73          HZ3       LYS  73   2.300   4.901  17.756
  597    H    TYR  74           HN       TYR  74   1.036   5.190  11.859
  598    HA   TYR  74           HA       TYR  74   2.557   3.440  13.549
  599   1HB   TYR  74          HB1       TYR  74   0.896   2.799  11.723
  600   2HB   TYR  74          HB2       TYR  74   2.185   3.163  10.577
  601    HD1  TYR  74           HD1      TYR  74   2.821   1.026   9.702
  602    HD2  TYR  74           HD2      TYR  74   2.426   1.658  13.936
  603    HE1  TYR  74           HE1      TYR  74   3.741  -1.257  10.128
  604    HE2  TYR  74           HE2      TYR  74   3.332  -0.609  14.376
  605    HH   TYR  74           HH       TYR  74   3.318  -2.918  12.800
  606    H    ILE  75           HN       ILE  75   3.329   5.415  10.734
  607    HA   ILE  75           HA       ILE  75   6.205   5.161  11.281
  608    HB   ILE  75           HB       ILE  75   4.909   5.322   8.546
  609   1HG1  ILE  75          HG11      ILE  75   6.350   3.047   9.957
  610   2HG1  ILE  75          HG12      ILE  75   4.670   3.062   9.442
  611   1HG2  ILE  75          HG21      ILE  75   6.980   6.529   8.527
  612   2HG2  ILE  75          HG22      ILE  75   7.299   4.961   7.786
  613   3HG2  ILE  75          HG23      ILE  75   7.798   5.266   9.449
  614   1HD1  ILE  75          HD11      ILE  75   7.016   3.170   7.541
  615   2HD1  ILE  75          HD12      ILE  75   5.316   2.947   7.127
  616   3HD1  ILE  75          HD13      ILE  75   6.181   1.688   8.008
  617    HA   PRO  76           HA       PRO  76   5.006   9.562  11.828
  618   1HB   PRO  76          HB1       PRO  76   7.035  10.090  13.573
  619   2HB   PRO  76          HB2       PRO  76   5.476   9.418  14.063
  620   1HG   PRO  76          HG1       PRO  76   8.079   8.022  13.588
  621   2HG   PRO  76          HG2       PRO  76   6.888   7.766  14.877
  622   1HD   PRO  76          HD1       PRO  76   7.068   6.141  12.724
  623   2HD   PRO  76          HD2       PRO  76   5.525   6.478  13.536
  624    H    GLY  77           HN       GLY  77   5.600  10.831  10.172
  625   1HA   GLY  77          HA1       GLY  77   7.162  12.382   9.254
  626   2HA   GLY  77          HA2       GLY  77   8.455  11.259   9.623
  627    H    THR  78           HN       THR  78   6.195   9.292   8.337
  628    HA   THR  78           HA       THR  78   7.484   8.770   5.923
  629    HB   THR  78           HB       THR  78   5.643   7.500   7.411
  630    HG1  THR  78           HG1      THR  78   6.985   7.010   5.192
  631   1HG2  THR  78          HG21      THR  78   3.684   6.969   6.039
  632   2HG2  THR  78          HG22      THR  78   4.134   8.243   4.905
  633   3HG2  THR  78          HG23      THR  78   3.680   8.655   6.559
  634    H    LYS  79           HN       LYS  79   7.046   9.156   3.787
  635    HA   LYS  79           HA       LYS  79   6.031  11.707   3.085
  636   1HB   LYS  79          HB1       LYS  79   6.557   9.378   1.241
  637   2HB   LYS  79          HB2       LYS  79   6.527  11.080   0.811
  638   1HG   LYS  79          HG1       LYS  79   8.527  11.382   2.335
  639   2HG   LYS  79          HG2       LYS  79   8.611   9.615   2.420
  640   1HD   LYS  79          HD1       LYS  79   8.318  10.141  -0.300
  641   2HD   LYS  79          HD2       LYS  79   9.424  11.402   0.261
  642   1HE   LYS  79          HE1       LYS  79  10.905   9.687  -0.218
  643   2HE   LYS  79          HE2       LYS  79  10.602   9.415   1.498
  644   1HZ   LYS  79          HZ1       LYS  79   8.815   8.075  -0.366
  645   2HZ   LYS  79          HZ2       LYS  79   9.468   7.526   1.092
  646   3HZ   LYS  79          HZ3       LYS  79  10.410   7.507  -0.308
  647    H    MET  80           HN       MET  80   4.363   8.596   3.265
  648    HA   MET  80           HA       MET  80   2.318   9.260   1.412
  649   1HB   MET  80          HB1       MET  80   2.521   6.988   1.580
  650   2HB   MET  80          HB2       MET  80   2.777   7.026   3.328
  651   1HG   MET  80          HG1       MET  80   0.563   7.112   3.807
  652   2HG   MET  80          HG2       MET  80   0.162   7.985   2.340
  653   1HE   MET  80          HE1       MET  80  -1.211   5.401   4.019
  654   2HE   MET  80          HE2       MET  80  -1.974   4.581   2.657
  655   3HE   MET  80          HE3       MET  80  -2.064   6.337   2.791
  656    H    ALA  81           HN       ALA  81   1.164  10.967   1.690
  657    HA   ALA  81           HA       ALA  81  -0.036  11.614   4.271
  658   1HB   ALA  81          HB1       ALA  81   1.586  13.185   3.119
  659   2HB   ALA  81          HB2       ALA  81   0.079  13.867   3.727
  660   3HB   ALA  81          HB3       ALA  81   0.265  13.540   2.004
  661    H    PHE  82           HN       PHE  82  -1.113   9.839   2.165
  662    HA   PHE  82           HA       PHE  82  -3.343  10.651   0.829
  663   1HB   PHE  82          HB1       PHE  82  -2.487   8.608   0.216
  664   2HB   PHE  82          HB2       PHE  82  -2.368   8.032   1.874
  665    HD1  PHE  82           HD1      PHE  82  -4.787   8.777  -0.871
  666    HD2  PHE  82           HD2      PHE  82  -4.080   6.733   2.848
  667    HE1  PHE  82           HE1      PHE  82  -7.001   7.656  -1.065
  668    HE2  PHE  82           HE2      PHE  82  -6.295   5.624   2.661
  669    HZ   PHE  82           HZ       PHE  82  -7.764   6.102   0.716
  670    H    GLY  83           HN       GLY  83  -3.200  10.099   4.306
  671   1HA   GLY  83          HA1       GLY  83  -4.959  11.088   5.658
  672   2HA   GLY  83          HA2       GLY  83  -6.102  10.647   4.409
  673    H    GLY  84           HN       GLY  84  -5.243   7.897   4.135
  674   1HA   GLY  84          HA1       GLY  84  -5.180   5.819   5.162
  675   2HA   GLY  84          HA2       GLY  84  -5.381   6.596   6.721
  676    H    LEU  85           HN       LEU  85  -6.821   4.579   4.579
  677    HA   LEU  85           HA       LEU  85  -9.579   5.348   4.790
  678   1HB   LEU  85          HB1       LEU  85  -8.187   2.915   3.686
  679   2HB   LEU  85          HB2       LEU  85  -9.932   3.040   3.762
  680    HG   LEU  85           HG       LEU  85  -8.095   4.848   2.170
  681   1HD1  LEU  85          HD11      LEU  85  -8.354   2.569   1.267
  682   2HD1  LEU  85          HD12      LEU  85  -9.143   3.767   0.241
  683   3HD1  LEU  85          HD13      LEU  85 -10.107   2.755   1.316
  684   1HD2  LEU  85          HD21      LEU  85 -11.123   4.788   2.263
  685   2HD2  LEU  85          HD22      LEU  85 -10.138   5.763   1.173
  686   3HD2  LEU  85          HD23      LEU  85 -10.108   6.078   2.907
  687    H    LYS  86           HN       LYS  86 -10.115   5.441   6.837
  688    HA   LYS  86           HA       LYS  86  -9.571   3.821   9.000
  689   1HB   LYS  86          HB1       LYS  86 -12.071   5.471   8.625
  690   2HB   LYS  86          HB2       LYS  86 -11.292   5.043  10.142
  691   1HG   LYS  86          HG1       LYS  86  -9.850   6.674   8.065
  692   2HG   LYS  86          HG2       LYS  86 -10.941   7.426   9.231
  693   1HD   LYS  86          HD1       LYS  86  -9.612   6.552  11.082
  694   2HD   LYS  86          HD2       LYS  86  -8.559   5.700   9.954
  695   1HE   LYS  86          HE1       LYS  86  -8.903   8.692   9.862
  696   2HE   LYS  86          HE2       LYS  86  -7.717   7.926  10.916
  697   1HZ   LYS  86          HZ1       LYS  86  -7.840   7.631   7.963
  698   2HZ   LYS  86          HZ2       LYS  86  -6.686   6.930   8.981
  699   3HZ   LYS  86          HZ3       LYS  86  -6.748   8.610   8.813
  700    H    LYS  87           HN       LYS  87 -12.182   3.453   6.660
  701    HA   LYS  87           HA       LYS  87 -13.751   1.580   8.142
  702   1HB   LYS  87          HB1       LYS  87 -13.706   2.025   5.170
  703   2HB   LYS  87          HB2       LYS  87 -14.991   1.305   6.102
  704   1HG   LYS  87          HG1       LYS  87 -15.348   3.639   7.134
  705   2HG   LYS  87          HG2       LYS  87 -14.303   4.227   5.805
  706   1HD   LYS  87          HD1       LYS  87 -15.831   2.290   4.625
  707   2HD   LYS  87          HD2       LYS  87 -16.968   3.002   5.719
  708   1HE   LYS  87          HE1       LYS  87 -17.159   4.916   4.423
  709   2HE   LYS  87          HE2       LYS  87 -15.605   4.631   3.606
  710   1HZ   LYS  87          HZ1       LYS  87 -17.719   2.586   3.454
  711   2HZ   LYS  87          HZ2       LYS  87 -16.452   2.880   2.379
  712   3HZ   LYS  87          HZ3       LYS  87 -17.789   3.923   2.411
  713    H    GLU  88           HN       GLU  88 -12.794  -0.344   8.627
  714    HA   GLU  88           HA       GLU  88 -10.944  -1.809   7.169
  715   1HB   GLU  88          HB1       GLU  88 -11.715  -2.019   9.603
  716   2HB   GLU  88          HB2       GLU  88 -12.973  -3.077   8.977
  717   1HG   GLU  88          HG1       GLU  88 -10.868  -4.230   7.792
  718   2HG   GLU  88          HG2       GLU  88 -10.047  -3.543   9.201
  719    H    LYS  89           HN       LYS  89 -14.496  -2.087   6.989
  720    HA   LYS  89           HA       LYS  89 -14.639  -4.428   5.478
  721   1HB   LYS  89          HB1       LYS  89 -16.640  -2.217   5.151
  722   2HB   LYS  89          HB2       LYS  89 -16.901  -3.957   5.229
  723   1HG   LYS  89          HG1       LYS  89 -15.756  -2.565   7.606
  724   2HG   LYS  89          HG2       LYS  89 -17.479  -2.419   7.282
  725   1HD   LYS  89          HD1       LYS  89 -17.194  -4.230   8.822
  726   2HD   LYS  89          HD2       LYS  89 -17.569  -4.952   7.249
  727   1HE   LYS  89          HE1       LYS  89 -15.551  -5.943   7.098
  728   2HE   LYS  89          HE2       LYS  89 -14.708  -4.488   7.629
  729   1HZ   LYS  89          HZ1       LYS  89 -15.735  -5.242   9.924
  730   2HZ   LYS  89          HZ2       LYS  89 -14.254  -5.836   9.370
  731   3HZ   LYS  89          HZ3       LYS  89 -15.654  -6.766   9.185
  732    H    ASP  90           HN       ASP  90 -14.330  -1.128   4.497
  733    HA   ASP  90           HA       ASP  90 -14.374  -1.348   1.725
  734   1HB   ASP  90          HB1       ASP  90 -13.441   0.617   3.775
  735   2HB   ASP  90          HB2       ASP  90 -13.030   0.892   2.093
  736    H    ARG  91           HN       ARG  91 -11.575  -1.478   4.017
  737    HA   ARG  91           HA       ARG  91  -9.645  -1.779   1.930
  738   1HB   ARG  91          HB1       ARG  91  -9.193  -2.653   4.788
  739   2HB   ARG  91          HB2       ARG  91  -7.979  -2.246   3.582
  740   1HG   ARG  91          HG1       ARG  91  -8.783   0.084   3.591
  741   2HG   ARG  91          HG2       ARG  91  -9.948  -0.335   4.835
  742   1HD   ARG  91          HD1       ARG  91  -6.941  -0.458   5.118
  743   2HD   ARG  91          HD2       ARG  91  -7.970   0.826   5.731
  744    HE   ARG  91           HE       ARG  91  -7.682  -1.619   6.125
  745   1HH1  ARG  91          HH21      ARG  91  -8.843   1.355   7.497
  746   2HH1  ARG  91          HH22      ARG  91  -9.352   0.872   9.079
  747   1HH2  ARG  91          HH11      ARG  91  -8.477  -2.426   8.698
  748   2HH2  ARG  91          HH12      ARG  91  -9.188  -1.245   9.739
  749    H    ASN  92           HN       ASN  92 -11.451  -4.133   3.865
  750    HA   ASN  92           HA       ASN  92 -10.189  -6.475   3.351
  751   1HB   ASN  92          HB1       ASN  92 -13.117  -5.816   3.495
  752   2HB   ASN  92          HB2       ASN  92 -12.579  -7.468   3.233
  753   1HD2  ASN  92          HD21      ASN  92 -14.095  -6.699   5.418
  754   2HD2  ASN  92          HD22      ASN  92 -13.075  -7.111   6.753
  755    H    ASP  93           HN       ASP  93 -12.626  -5.106   1.085
  756    HA   ASP  93           HA       ASP  93 -12.156  -6.898  -1.022
  757   1HB   ASP  93          HB1       ASP  93 -13.913  -4.818  -0.556
  758   2HB   ASP  93          HB2       ASP  93 -12.946  -4.222  -1.896
  759    H    LEU  94           HN       LEU  94 -10.559  -3.731  -0.345
  760    HA   LEU  94           HA       LEU  94  -9.083  -3.455  -2.646
  761   1HB   LEU  94          HB1       LEU  94  -9.107  -2.362   0.071
  762   2HB   LEU  94          HB2       LEU  94  -7.552  -2.358  -0.674
  763    HG   LEU  94           HG       LEU  94  -9.937  -1.220  -2.098
  764   1HD1  LEU  94          HD11      LEU  94  -9.601  -0.200   0.180
  765   2HD1  LEU  94          HD12      LEU  94  -9.483   0.929  -1.174
  766   3HD1  LEU  94          HD13      LEU  94  -8.019   0.350  -0.380
  767   1HD2  LEU  94          HD21      LEU  94  -7.079  -0.291  -2.316
  768   2HD2  LEU  94          HD22      LEU  94  -8.428   0.041  -3.400
  769   3HD2  LEU  94          HD23      LEU  94  -7.723  -1.574  -3.343
  770    H    ILE  95           HN       ILE  95  -8.311  -5.368   0.236
  771    HA   ILE  95           HA       ILE  95  -5.638  -6.005  -0.416
  772    HB   ILE  95           HB       ILE  95  -7.537  -7.600   1.316
  773   1HG1  ILE  95          HG11      ILE  95  -5.679  -5.371   2.199
  774   2HG1  ILE  95          HG12      ILE  95  -7.390  -5.119   1.868
  775   1HG2  ILE  95          HG21      ILE  95  -5.359  -8.706   0.756
  776   2HG2  ILE  95          HG22      ILE  95  -5.574  -8.389   2.476
  777   3HG2  ILE  95          HG23      ILE  95  -4.528  -7.345   1.514
  778   1HD1  ILE  95          HD11      ILE  95  -7.024  -5.386   4.254
  779   2HD1  ILE  95          HD12      ILE  95  -6.235  -6.940   3.984
  780   3HD1  ILE  95          HD13      ILE  95  -7.952  -6.752   3.633
  781    H    THR  96           HN       THR  96  -8.706  -7.739  -1.019
  782    HA   THR  96           HA       THR  96  -7.704 -10.030  -2.242
  783    HB   THR  96           HB       THR  96 -10.268  -8.725  -3.141
  784    HG1  THR  96           HG1      THR  96  -9.612  -9.414  -0.647
  785   1HG2  THR  96          HG21      THR  96  -9.474 -10.840  -4.247
  786   2HG2  THR  96          HG22      THR  96 -11.032 -10.986  -3.432
  787   3HG2  THR  96          HG23      THR  96  -9.576 -11.630  -2.673
  788    H    TYR  97           HN       TYR  97  -8.543  -6.909  -3.823
  789    HA   TYR  97           HA       TYR  97  -7.890  -7.674  -6.434
  790   1HB   TYR  97          HB1       TYR  97  -9.101  -5.663  -6.139
  791   2HB   TYR  97          HB2       TYR  97  -7.860  -4.981  -5.096
  792    HD1  TYR  97           HD1      TYR  97  -6.573  -3.306  -6.000
  793    HD2  TYR  97           HD2      TYR  97  -8.074  -6.401  -8.581
  794    HE1  TYR  97           HE1      TYR  97  -5.493  -2.200  -7.947
  795    HE2  TYR  97           HE2      TYR  97  -7.102  -5.239 -10.554
  796    HH   TYR  97           HH       TYR  97  -4.765  -3.130 -10.488
  797    H    LEU  98           HN       LEU  98  -5.764  -5.855  -4.168
  798    HA   LEU  98           HA       LEU  98  -3.440  -5.908  -5.707
  799   1HB   LEU  98          HB1       LEU  98  -4.169  -4.870  -3.292
  800   2HB   LEU  98          HB2       LEU  98  -3.073  -6.153  -2.790
  801    HG   LEU  98           HG       LEU  98  -1.321  -5.243  -4.302
  802   1HD1  LEU  98          HD11      LEU  98  -3.311  -3.004  -4.738
  803   2HD1  LEU  98          HD12      LEU  98  -2.801  -4.176  -5.953
  804   3HD1  LEU  98          HD13      LEU  98  -1.638  -3.021  -5.299
  805   1HD2  LEU  98          HD21      LEU  98  -2.465  -3.167  -2.424
  806   2HD2  LEU  98          HD22      LEU  98  -0.803  -3.243  -3.008
  807   3HD2  LEU  98          HD23      LEU  98  -1.422  -4.507  -1.946
  808    H    LYS  99           HN       LYS  99  -4.563  -8.156  -3.249
  809    HA   LYS  99           HA       LYS  99  -2.488  -9.986  -3.207
  810   1HB   LYS  99          HB1       LYS  99  -3.833 -10.660  -1.556
  811   2HB   LYS  99          HB2       LYS  99  -5.222  -9.855  -2.262
  812   1HG   LYS  99          HG1       LYS  99  -5.742 -11.780  -3.600
  813   2HG   LYS  99          HG2       LYS  99  -4.250 -12.574  -3.137
  814   1HD   LYS  99          HD1       LYS  99  -5.995 -11.912  -0.867
  815   2HD   LYS  99          HD2       LYS  99  -6.716 -13.033  -2.027
  816   1HE   LYS  99          HE1       LYS  99  -5.502 -14.216  -0.260
  817   2HE   LYS  99          HE2       LYS  99  -4.797 -14.504  -1.843
  818   1HZ   LYS  99          HZ1       LYS  99  -3.427 -12.370  -0.839
  819   2HZ   LYS  99          HZ2       LYS  99  -2.882 -13.972  -0.920
  820   3HZ   LYS  99          HZ3       LYS  99  -3.636 -13.409   0.490
  821    H    LYS 100           HN       LYS 100  -5.229  -9.810  -5.485
  822    HA   LYS 100           HA       LYS 100  -4.587 -12.189  -6.882
  823   1HB   LYS 100          HB1       LYS 100  -6.753 -10.519  -6.768
  824   2HB   LYS 100          HB2       LYS 100  -6.178 -10.306  -8.404
  825   1HG   LYS 100          HG1       LYS 100  -7.975 -12.011  -8.198
  826   2HG   LYS 100          HG2       LYS 100  -6.485 -12.672  -8.876
  827   1HD   LYS 100          HD1       LYS 100  -6.812 -12.787  -5.952
  828   2HD   LYS 100          HD2       LYS 100  -7.890 -13.791  -6.869
  829   1HE   LYS 100          HE1       LYS 100  -6.277 -15.277  -6.257
  830   2HE   LYS 100          HE2       LYS 100  -5.625 -14.759  -7.820
  831   1HZ   LYS 100          HZ1       LYS 100  -3.846 -13.873  -6.814
  832   2HZ   LYS 100          HZ2       LYS 100  -4.365 -14.580  -5.367
  833   3HZ   LYS 100          HZ3       LYS 100  -4.817 -12.991  -5.737
  834    H    ALA 101           HN       ALA 101  -3.568  -9.012  -7.309
  835    HA   ALA 101           HA       ALA 101  -2.350  -9.175  -9.876
  836   1HB   ALA 101          HB1       ALA 101  -1.596  -6.879  -9.301
  837   2HB   ALA 101          HB2       ALA 101  -2.291  -7.090  -7.694
  838   3HB   ALA 101          HB3       ALA 101  -3.334  -7.117  -9.117
  839    H    THR 102           HN       THR 102  -1.181  -9.468  -6.553
  840    HA   THR 102           HA       THR 102   1.614  -9.669  -7.251
  841    HB   THR 102           HB       THR 102   0.473 -10.335  -4.551
  842    HG1  THR 102           HG1      THR 102  -0.329  -8.264  -5.249
  843   1HG2  THR 102          HG21      THR 102   2.572  -9.656  -3.707
  844   2HG2  THR 102          HG22      THR 102   3.020  -8.872  -5.222
  845   3HG2  THR 102          HG23      THR 102   2.948 -10.632  -5.128
  846    H    GLU 103           HN       GLU 103  -0.986 -11.909  -6.261
  847    HA   GLU 103           HA       GLU 103   0.780 -14.141  -7.039
  848   1HB   GLU 103          HB1       GLU 103  -0.907 -15.388  -5.324
  849   2HB   GLU 103          HB2       GLU 103   0.668 -14.762  -4.867
  850   1HG   GLU 103          HG1       GLU 103  -0.225 -13.303  -3.461
  851   2HG   GLU 103          HG2       GLU 103  -1.365 -12.724  -4.671
  852    HHA  HEC 104           HA       HEC 104   5.180   3.387   1.408
  853    HHB  HEC 104           HB       HEC 104  -0.511   0.476   0.254
  854    HHC  HEC 104           HC       HEC 104  -3.055   6.205  -1.394
  855    HHD  HEC 104           HD       HEC 104   2.883   8.746  -1.424
  856   1HMA  HEC 104          HMA1      HEC 104   1.294  -0.903   2.079
  857   2HMA  HEC 104          HMA2      HEC 104   2.806  -1.285   1.254
  858   3HMA  HEC 104          HMA3      HEC 104   1.312  -1.130   0.330
  859   1HAA  HEC 104          HAA1      HEC 104   4.349  -0.266   2.142
  860   2HAA  HEC 104          HAA2      HEC 104   5.032   1.311   2.493
  861   1HBA  HEC 104          HBA1      HEC 104   5.882   1.429   0.163
  862   2HBA  HEC 104          HBA2      HEC 104   5.258  -0.188  -0.122
  863   1HMB  HEC 104          HMB1      HEC 104  -2.394   0.154  -0.355
  864   2HMB  HEC 104          HMB2      HEC 104  -3.324   0.733  -1.738
  865   3HMB  HEC 104          HMB3      HEC 104  -3.976   0.894  -0.108
  866    HAB  HEC 104           HAB      HEC 104  -4.460   4.876  -1.413
  867   1HBB  HEC 104          HBB1      HEC 104  -4.778   3.688   0.894
  868   2HBB  HEC 104          HBB2      HEC 104  -5.781   2.603  -0.069
  869   3HBB  HEC 104          HBB3      HEC 104  -6.134   4.331  -0.032
  870   1HMC  HEC 104          HMC1      HEC 104  -3.111   8.769  -1.592
  871   2HMC  HEC 104          HMC2      HEC 104  -2.782   8.021  -3.155
  872   3HMC  HEC 104          HMC3      HEC 104  -2.171   9.637  -2.806
  873    HAC  HEC 104           HAC      HEC 104   1.678   9.778  -2.709
  874   1HBC  HEC 104          HBC1      HEC 104   0.895  11.192  -1.052
  875   2HBC  HEC 104          HBC2      HEC 104  -0.768  11.114  -1.631
  876   3HBC  HEC 104          HBC3      HEC 104   0.457  11.961  -2.577
  877   1HMD  HEC 104          HMD1      HEC 104   5.023   9.158  -0.532
  878   2HMD  HEC 104          HMD2      HEC 104   5.465   8.152  -1.912
  879   3HMD  HEC 104          HMD3      HEC 104   6.495   8.189  -0.480
  880   1HAD  HEC 104          HAD1      HEC 104   7.304   6.327   0.321
  881   2HAD  HEC 104          HAD2      HEC 104   6.856   4.795   1.062
  882   1HBD  HEC 104          HBD1      HEC 104   6.352   5.773   3.101
  883   2HBD  HEC 104          HBD2      HEC 104   6.027   7.339   2.389
  884    H2   4NL 105           H2       4NL 105   0.009 -12.776  -1.324
  885    H6   4NL 105           H6       4NL 105   1.423 -13.671   3.814
  886    H3   4NL 105           H3       4NL 105  -1.915 -10.603   1.908
  887    H5   4NL 105           H5       4NL 105  -2.559 -10.457  -0.239
  888    H4   4NL 105           H4       4NL 105  -0.266 -11.564   3.537
  889    H1   4NL 105           H1       4NL 105   1.658 -13.737   0.304
  890    H7   4NL 105           H7       4NL 105   2.753 -13.181   2.737
  Start of MODEL    2
    1   1H    THR  -5          HT1       THR  -5 -11.261  -6.543  13.491
    2   2H    THR  -5          HT2       THR  -5 -11.192  -5.595  12.090
    3   3H    THR  -5          HT3       THR  -5  -9.800  -5.822  13.025
    4    HA   THR  -5           HA       THR  -5  -9.864  -7.171  10.961
    5    HB   THR  -5           HB       THR  -5  -9.931  -9.048  13.311
    6    HG1  THR  -5           HG1      THR  -5  -7.548  -7.958  13.234
    7   1HG2  THR  -5          HG21      THR  -5  -9.200  -9.845  11.097
    8   2HG2  THR  -5          HG22      THR  -5  -7.874  -9.869  12.260
    9   3HG2  THR  -5          HG23      THR  -5  -7.968  -8.582  11.056
   10    H    GLU  -4           HN       GLU  -4 -12.367  -6.656  10.600
   11    HA   GLU  -4           HA       GLU  -4 -13.924  -9.121  11.002
   12   1HB   GLU  -4          HB1       GLU  -4 -14.734  -6.709  11.826
   13   2HB   GLU  -4          HB2       GLU  -4 -15.215  -6.547  10.141
   14   1HG   GLU  -4          HG1       GLU  -4 -16.050  -8.920  11.786
   15   2HG   GLU  -4          HG2       GLU  -4 -16.954  -7.412  11.826
   16    H    PHE  -3           HN       PHE  -3 -12.098  -9.417   9.187
   17    HA   PHE  -3           HA       PHE  -3 -12.428  -8.411   6.626
   18   1HB   PHE  -3          HB1       PHE  -3 -10.388  -9.538   7.252
   19   2HB   PHE  -3          HB2       PHE  -3 -11.242 -11.064   7.443
   20    HD1  PHE  -3           HD1      PHE  -3 -10.274  -8.487   4.904
   21    HD2  PHE  -3           HD2      PHE  -3 -11.479 -12.552   5.626
   22    HE1  PHE  -3           HE1      PHE  -3  -9.921  -9.017   2.500
   23    HE2  PHE  -3           HE2      PHE  -3 -11.175 -13.071   3.213
   24    HZ   PHE  -3           HZ       PHE  -3 -10.424 -11.294   1.641
   25    H    LYS  -2           HN       LYS  -2 -13.367  -9.079   4.798
   26    HA   LYS  -2           HA       LYS  -2 -15.221 -11.296   4.667
   27   1HB   LYS  -2          HB1       LYS  -2 -16.301  -8.989   5.522
   28   2HB   LYS  -2          HB2       LYS  -2 -16.330  -8.666   3.788
   29   1HG   LYS  -2          HG1       LYS  -2 -17.918 -10.234   3.374
   30   2HG   LYS  -2          HG2       LYS  -2 -17.310 -11.331   4.611
   31   1HD   LYS  -2          HD1       LYS  -2 -18.687  -8.789   5.415
   32   2HD   LYS  -2          HD2       LYS  -2 -19.645 -10.179   4.907
   33   1HE   LYS  -2          HE1       LYS  -2 -19.423 -10.146   7.331
   34   2HE   LYS  -2          HE2       LYS  -2 -18.585 -11.542   6.662
   35   1HZ   LYS  -2          HZ1       LYS  -2 -16.531 -10.657   7.161
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.451 -10.143   8.481
   37   3HZ   LYS  -2          HZ3       LYS  -2 -17.107  -9.063   7.232
   38    H    ALA  -1           HN       ALA  -1 -15.075 -12.178   2.737
   39    HA   ALA  -1           HA       ALA  -1 -13.142 -11.567   0.872
   40   1HB   ALA  -1          HB1       ALA  -1 -14.059 -13.775   1.095
   41   2HB   ALA  -1          HB2       ALA  -1 -14.328 -13.225  -0.559
   42   3HB   ALA  -1          HB3       ALA  -1 -15.657 -13.212   0.600
   43    H    GLY   1           HN       GLY   1 -13.094 -10.583  -1.110
   44   1HA   GLY   1          HA1       GLY   1 -15.357  -8.862  -1.895
   45   2HA   GLY   1          HA2       GLY   1 -13.673  -8.386  -2.045
   46    H    SER   2           HN       SER   2 -13.624  -8.078  -4.189
   47    HA   SER   2           HA       SER   2 -13.407 -10.375  -5.925
   48   1HB   SER   2          HB1       SER   2 -15.203  -8.272  -7.027
   49   2HB   SER   2          HB2       SER   2 -15.176 -10.012  -7.338
   50    HG   SER   2           HG       SER   2 -15.974 -10.237  -5.123
   51    H    ALA   3           HN       ALA   3 -11.916 -10.006  -7.508
   52    HA   ALA   3           HA       ALA   3 -10.128  -7.950  -7.424
   53   1HB   ALA   3          HB1       ALA   3  -9.830 -10.122  -8.561
   54   2HB   ALA   3          HB2       ALA   3  -9.285  -8.749  -9.525
   55   3HB   ALA   3          HB3       ALA   3 -10.822  -9.528  -9.894
   56    H    LYS   4           HN       LYS   4 -13.119  -7.911  -9.414
   57    HA   LYS   4           HA       LYS   4 -12.413  -5.439 -10.657
   58   1HB   LYS   4          HB1       LYS   4 -14.274  -7.488 -11.177
   59   2HB   LYS   4          HB2       LYS   4 -15.162  -5.968 -11.075
   60   1HG   LYS   4          HG1       LYS   4 -12.688  -6.382 -12.759
   61   2HG   LYS   4          HG2       LYS   4 -14.334  -6.493 -13.369
   62   1HD   LYS   4          HD1       LYS   4 -13.061  -4.030 -12.156
   63   2HD   LYS   4          HD2       LYS   4 -13.331  -4.312 -13.880
   64   1HE   LYS   4          HE1       LYS   4 -15.526  -3.784 -13.744
   65   2HE   LYS   4          HE2       LYS   4 -15.736  -4.654 -12.224
   66   1HZ   LYS   4          HZ1       LYS   4 -14.693  -2.778 -11.082
   67   2HZ   LYS   4          HZ2       LYS   4 -16.102  -2.319 -11.894
   68   3HZ   LYS   4          HZ3       LYS   4 -14.592  -1.939 -12.552
   69    H    LYS   5           HN       LYS   5 -13.264  -5.789  -7.579
   70    HA   LYS   5           HA       LYS   5 -14.819  -3.282  -7.489
   71   1HB   LYS   5          HB1       LYS   5 -14.632  -5.464  -5.397
   72   2HB   LYS   5          HB2       LYS   5 -15.463  -3.931  -5.170
   73   1HG   LYS   5          HG1       LYS   5 -16.740  -4.688  -7.368
   74   2HG   LYS   5          HG2       LYS   5 -16.254  -6.290  -6.810
   75   1HD   LYS   5          HD1       LYS   5 -17.349  -4.628  -4.668
   76   2HD   LYS   5          HD2       LYS   5 -18.498  -4.890  -5.980
   77   1HE   LYS   5          HE1       LYS   5 -18.777  -6.628  -4.316
   78   2HE   LYS   5          HE2       LYS   5 -18.104  -7.335  -5.785
   79   1HZ   LYS   5          HZ1       LYS   5 -16.154  -7.795  -4.771
   80   2HZ   LYS   5          HZ2       LYS   5 -17.124  -7.793  -3.380
   81   3HZ   LYS   5          HZ3       LYS   5 -16.208  -6.424  -3.772
   82    H    GLY   6           HN       GLY   6 -12.260  -5.051  -5.713
   83   1HA   GLY   6          HA1       GLY   6 -11.348  -2.931  -4.140
   84   2HA   GLY   6          HA2       GLY   6 -10.366  -4.294  -4.653
   85    H    ALA   7           HN       ALA   7 -10.661  -3.633  -7.532
   86    HA   ALA   7           HA       ALA   7  -8.436  -1.998  -7.913
   87   1HB   ALA   7          HB1       ALA   7 -10.581  -2.639  -9.938
   88   2HB   ALA   7          HB2       ALA   7  -9.222  -3.687  -9.532
   89   3HB   ALA   7          HB3       ALA   7  -8.930  -2.116 -10.275
   90    H    THR   8           HN       THR   8 -11.925  -1.094  -8.437
   91    HA   THR   8           HA       THR   8 -11.532   1.494  -9.282
   92    HB   THR   8           HB       THR   8 -13.715   1.832  -7.651
   93    HG1  THR   8           HG1      THR   8 -13.572  -0.428  -7.116
   94   1HG2  THR   8          HG21      THR   8 -13.565   2.360 -10.051
   95   2HG2  THR   8          HG22      THR   8 -15.035   1.465  -9.663
   96   3HG2  THR   8          HG23      THR   8 -13.675   0.639 -10.426
   97    H    LEU   9           HN       LEU   9 -11.184   0.355  -5.980
   98    HA   LEU   9           HA       LEU   9 -11.110   2.877  -4.691
   99   1HB   LEU   9          HB1       LEU   9 -10.489   0.058  -3.949
  100   2HB   LEU   9          HB2       LEU   9  -9.738   1.321  -2.976
  101    HG   LEU   9           HG       LEU   9 -11.756   0.888  -1.858
  102   1HD1  LEU   9          HD11      LEU   9 -12.321   3.176  -3.750
  103   2HD1  LEU   9          HD12      LEU   9 -11.415   3.285  -2.241
  104   3HD1  LEU   9          HD13      LEU   9 -13.134   2.891  -2.210
  105   1HD2  LEU   9          HD21      LEU   9 -13.179   0.965  -4.529
  106   2HD2  LEU   9          HD22      LEU   9 -13.952   0.755  -2.958
  107   3HD2  LEU   9          HD23      LEU   9 -12.859  -0.485  -3.575
  108    H    PHE  10           HN       PHE  10  -8.367   0.647  -4.708
  109    HA   PHE  10           HA       PHE  10  -6.292   2.387  -4.405
  110   1HB   PHE  10          HB1       PHE  10  -6.139  -0.072  -4.331
  111   2HB   PHE  10          HB2       PHE  10  -6.285  -0.130  -6.081
  112    HD1  PHE  10           HD1      PHE  10  -4.436   1.122  -7.457
  113    HD2  PHE  10           HD2      PHE  10  -4.050  -0.030  -3.331
  114    HE1  PHE  10           HE1      PHE  10  -1.953   1.223  -7.656
  115    HE2  PHE  10           HE2      PHE  10  -1.581   0.196  -3.498
  116    HZ   PHE  10           HZ       PHE  10  -0.526   0.797  -5.663
  117    H    LYS  11           HN       LYS  11  -7.773   1.480  -7.507
  118    HA   LYS  11           HA       LYS  11  -5.899   2.936  -9.101
  119   1HB   LYS  11          HB1       LYS  11  -7.646   0.865  -9.565
  120   2HB   LYS  11          HB2       LYS  11  -8.380   2.203 -10.450
  121   1HG   LYS  11          HG1       LYS  11  -6.326   2.602 -11.664
  122   2HG   LYS  11          HG2       LYS  11  -5.485   1.383 -10.710
  123   1HD   LYS  11          HD1       LYS  11  -7.232  -0.267 -11.641
  124   2HD   LYS  11          HD2       LYS  11  -7.597   0.994 -12.820
  125   1HE   LYS  11          HE1       LYS  11  -6.015  -0.477 -13.842
  126   2HE   LYS  11          HE2       LYS  11  -5.152   1.002 -13.432
  127   1HZ   LYS  11          HZ1       LYS  11  -3.720  -0.657 -12.741
  128   2HZ   LYS  11          HZ2       LYS  11  -4.961  -1.659 -12.180
  129   3HZ   LYS  11          HZ3       LYS  11  -4.535  -0.281 -11.302
  130    H    THR  12           HN       THR  12  -8.113   4.270  -7.187
  131    HA   THR  12           HA       THR  12  -8.445   6.647  -8.834
  132    HB   THR  12           HB       THR  12 -10.524   4.877  -8.329
  133    HG1  THR  12           HG1      THR  12 -10.201   6.283 -10.109
  134   1HG2  THR  12          HG21      THR  12 -12.261   6.284  -7.317
  135   2HG2  THR  12          HG22      THR  12 -11.029   7.461  -6.858
  136   3HG2  THR  12          HG23      THR  12 -11.006   5.840  -6.160
  137    H    ARG  13           HN       ARG  13  -7.996   5.235  -5.767
  138    HA   ARG  13           HA       ARG  13  -7.924   7.782  -4.307
  139   1HB   ARG  13          HB1       ARG  13  -8.350   4.940  -3.523
  140   2HB   ARG  13          HB2       ARG  13  -7.594   6.001  -2.354
  141   1HG   ARG  13          HG1       ARG  13 -10.311   6.373  -3.598
  142   2HG   ARG  13          HG2       ARG  13  -9.983   5.788  -1.974
  143   1HD   ARG  13          HD1       ARG  13 -10.624   8.068  -1.769
  144   2HD   ARG  13          HD2       ARG  13  -8.873   8.022  -1.526
  145    HE   ARG  13           HE       ARG  13 -10.249   8.470  -3.937
  146   1HH1  ARG  13          HH11      ARG  13  -7.891   9.562  -1.600
  147   2HH1  ARG  13          HH12      ARG  13  -6.978  10.634  -2.599
  148   1HH2  ARG  13          HH21      ARG  13  -8.779  10.064  -5.450
  149   2HH2  ARG  13          HH22      ARG  13  -7.476  10.922  -4.705
  150    H    CYS  14           HN       CYS  14  -5.931   5.058  -5.227
  151    HA   CYS  14           HA       CYS  14  -3.619   6.146  -3.766
  152   1HB   CYS  14          HB1       CYS  14  -3.746   3.417  -4.992
  153   2HB   CYS  14          HB2       CYS  14  -2.731   3.981  -3.683
  154    H    LEU  15           HN       LEU  15  -4.858   5.475  -6.939
  155    HA   LEU  15           HA       LEU  15  -2.609   5.212  -8.497
  156   1HB   LEU  15          HB1       LEU  15  -5.095   5.080  -9.116
  157   2HB   LEU  15          HB2       LEU  15  -5.003   6.819  -9.358
  158    HG   LEU  15           HG       LEU  15  -3.128   6.427 -10.996
  159   1HD1  LEU  15          HD11      LEU  15  -2.833   4.210 -11.941
  160   2HD1  LEU  15          HD12      LEU  15  -4.001   3.545 -10.799
  161   3HD1  LEU  15          HD13      LEU  15  -2.463   4.186 -10.216
  162   1HD2  LEU  15          HD21      LEU  15  -5.163   6.874 -12.038
  163   2HD2  LEU  15          HD22      LEU  15  -5.893   5.371 -11.476
  164   3HD2  LEU  15          HD23      LEU  15  -4.680   5.338 -12.757
  165    H    GLN  16           HN       GLN  16  -3.945   8.218  -7.212
  166    HA   GLN  16           HA       GLN  16  -2.780  10.179  -8.657
  167   1HB   GLN  16          HB1       GLN  16  -2.759  11.487  -6.454
  168   2HB   GLN  16          HB2       GLN  16  -4.289  10.842  -7.024
  169   1HG   GLN  16          HG1       GLN  16  -4.112   8.976  -5.445
  170   2HG   GLN  16          HG2       GLN  16  -2.553   9.589  -4.888
  171   1HE2  GLN  16          HE21      GLN  16  -2.534  11.508  -3.592
  172   2HE2  GLN  16          HE22      GLN  16  -3.976  12.096  -2.852
  173    H    CYS  17           HN       CYS  17  -1.024   8.173  -6.337
  174    HA   CYS  17           HA       CYS  17   1.460   9.580  -7.042
  175   1HB   CYS  17          HB1       CYS  17   1.312   8.191  -4.425
  176   2HB   CYS  17          HB2       CYS  17   2.173   9.642  -4.909
  177    H    HIS  18           HN       HIS  18   0.040   6.426  -6.271
  178    HA   HIS  18           HA       HIS  18   2.559   5.015  -6.662
  179   1HB   HIS  18          HB1       HIS  18  -0.143   4.274  -5.597
  180   2HB   HIS  18          HB2       HIS  18   1.034   3.042  -5.997
  181    HD1  HIS  18           HD1      HIS  18   3.504   3.499  -4.606
  182    HD2  HIS  18           HD2      HIS  18  -0.101   5.031  -3.126
  183    HE1  HIS  18           HE1      HIS  18   3.862   3.865  -2.123
  184    H    THR  19           HN       THR  19   1.849   2.653  -7.486
  185    HA   THR  19           HA       THR  19   0.199   2.521  -9.820
  186    HB   THR  19           HB       THR  19   2.421   1.598 -11.031
  187    HG1  THR  19           HG1      THR  19   3.856   2.320  -9.456
  188   1HG2  THR  19          HG21      THR  19   1.312   4.395 -11.015
  189   2HG2  THR  19          HG22      THR  19   1.013   3.108 -12.183
  190   3HG2  THR  19          HG23      THR  19   2.593   3.887 -12.115
  191    H    VAL  20           HN       VAL  20  -0.745   0.544  -9.711
  192    HA   VAL  20           HA       VAL  20   0.205  -1.506  -7.950
  193    HB   VAL  20           HB       VAL  20  -2.207  -0.702  -8.728
  194   1HG1  VAL  20          HG11      VAL  20  -2.161  -1.618 -10.943
  195   2HG1  VAL  20          HG12      VAL  20  -3.353  -2.477  -9.967
  196   3HG1  VAL  20          HG13      VAL  20  -1.794  -3.225 -10.312
  197   1HG2  VAL  20          HG21      VAL  20  -1.735  -3.505  -7.742
  198   2HG2  VAL  20          HG22      VAL  20  -3.171  -2.510  -7.510
  199   3HG2  VAL  20          HG23      VAL  20  -1.655  -2.060  -6.734
  200    H    GLU  21           HN       GLU  21   0.556  -0.982 -11.306
  201    HA   GLU  21           HA       GLU  21   1.173  -3.716 -12.038
  202   1HB   GLU  21          HB1       GLU  21   1.561  -1.220 -13.717
  203   2HB   GLU  21          HB2       GLU  21   1.418  -2.872 -14.285
  204   1HG   GLU  21          HG1       GLU  21  -0.630  -1.881 -14.840
  205   2HG   GLU  21          HG2       GLU  21  -0.980  -2.807 -13.383
  206    H    LYS  22           HN       LYS  22   3.442  -4.022 -13.266
  207    HA   LYS  22           HA       LYS  22   5.462  -3.000 -11.507
  208   1HB   LYS  22          HB1       LYS  22   5.183  -5.275 -13.175
  209   2HB   LYS  22          HB2       LYS  22   6.691  -4.448 -13.605
  210   1HG   LYS  22          HG1       LYS  22   5.822  -5.437 -10.897
  211   2HG   LYS  22          HG2       LYS  22   7.276  -5.861 -11.801
  212   1HD   LYS  22          HD1       LYS  22   8.013  -3.485 -11.555
  213   2HD   LYS  22          HD2       LYS  22   6.642  -3.232 -10.475
  214   1HE   LYS  22          HE1       LYS  22   8.138  -5.572  -9.675
  215   2HE   LYS  22          HE2       LYS  22   9.213  -4.193  -9.810
  216   1HZ   LYS  22          HZ1       LYS  22   7.096  -3.225  -8.373
  217   2HZ   LYS  22          HZ2       LYS  22   8.570  -3.734  -7.729
  218   3HZ   LYS  22          HZ3       LYS  22   7.265  -4.804  -7.787
  219    H    GLY  23           HN       GLY  23   4.958  -2.532 -15.038
  220   1HA   GLY  23          HA1       GLY  23   7.231  -0.761 -15.227
  221   2HA   GLY  23          HA2       GLY  23   6.062  -1.095 -16.494
  222    H    GLY  24           HN       GLY  24   4.766  -0.077 -13.472
  223   1HA   GLY  24          HA1       GLY  24   3.481   2.213 -14.522
  224   2HA   GLY  24          HA2       GLY  24   3.497   1.698 -12.844
  225    HA   PRO  25           HA       PRO  25   6.773   5.197 -13.856
  226   1HB   PRO  25          HB1       PRO  25   5.170   7.440 -13.922
  227   2HB   PRO  25          HB2       PRO  25   5.824   6.636 -15.352
  228   1HG   PRO  25          HG1       PRO  25   3.106   6.418 -14.130
  229   2HG   PRO  25          HG2       PRO  25   3.566   6.478 -15.841
  230   1HD   PRO  25          HD1       PRO  25   2.896   4.170 -14.626
  231   2HD   PRO  25          HD2       PRO  25   4.138   4.236 -15.895
  232    H    HIS  26           HN       HIS  26   7.623   5.538 -11.886
  233    HA   HIS  26           HA       HIS  26   6.120   5.553  -9.482
  234   1HB   HIS  26          HB1       HIS  26   8.981   6.360 -10.061
  235   2HB   HIS  26          HB2       HIS  26   8.316   6.129  -8.454
  236    HD2  HIS  26           HD2      HIS  26   8.999   4.020 -11.672
  237    HE1  HIS  26           HE1      HIS  26   9.447   1.452  -8.320
  238    HE2  HIS  26           HE2      HIS  26   9.676   1.639 -10.841
  239    H    LYS  27           HN       LYS  27   4.903   7.249  -8.790
  240    HA   LYS  27           HA       LYS  27   5.646   9.982  -9.541
  241   1HB   LYS  27          HB1       LYS  27   3.067   8.569  -9.148
  242   2HB   LYS  27          HB2       LYS  27   3.113  10.264  -8.686
  243   1HG   LYS  27          HG1       LYS  27   2.609  10.638 -10.854
  244   2HG   LYS  27          HG2       LYS  27   4.331  10.355 -11.127
  245   1HD   LYS  27          HD1       LYS  27   2.844   9.022 -12.646
  246   2HD   LYS  27          HD2       LYS  27   3.919   8.025 -11.658
  247   1HE   LYS  27          HE1       LYS  27   1.270   8.649 -10.482
  248   2HE   LYS  27          HE2       LYS  27   1.260   7.576 -11.881
  249   1HZ   LYS  27          HZ1       LYS  27   1.444   6.229  -9.964
  250   2HZ   LYS  27          HZ2       LYS  27   2.681   7.178  -9.314
  251   3HZ   LYS  27          HZ3       LYS  27   2.980   6.236 -10.686
  252    H    VAL  28           HN       VAL  28   3.691  10.707  -7.174
  253    HA   VAL  28           HA       VAL  28   5.613  11.422  -5.261
  254    HB   VAL  28           HB       VAL  28   2.674  11.047  -4.695
  255   1HG1  VAL  28          HG11      VAL  28   4.041  11.545  -2.736
  256   2HG1  VAL  28          HG12      VAL  28   3.022  12.926  -3.139
  257   3HG1  VAL  28          HG13      VAL  28   4.736  12.944  -3.556
  258   1HG2  VAL  28          HG21      VAL  28   3.995  13.478  -5.927
  259   2HG2  VAL  28          HG22      VAL  28   2.323  13.380  -5.377
  260   3HG2  VAL  28          HG23      VAL  28   2.860  12.397  -6.739
  261    H    GLY  29           HN       GLY  29   3.974   8.468  -5.831
  262   1HA   GLY  29          HA1       GLY  29   5.073   7.225  -3.391
  263   2HA   GLY  29          HA2       GLY  29   3.523   6.766  -4.077
  264    HA   PRO  30           HA       PRO  30   7.353   4.636  -6.211
  265   1HB   PRO  30          HB1       PRO  30   8.067   2.685  -4.475
  266   2HB   PRO  30          HB2       PRO  30   8.801   4.292  -4.469
  267   1HG   PRO  30          HG1       PRO  30   6.623   3.201  -2.726
  268   2HG   PRO  30          HG2       PRO  30   8.040   4.165  -2.271
  269   1HD   PRO  30          HD1       PRO  30   5.586   5.252  -2.562
  270   2HD   PRO  30          HD2       PRO  30   7.071   6.142  -2.954
  271    H    ASN  31           HN       ASN  31   7.510   2.230  -6.810
  272    HA   ASN  31           HA       ASN  31   4.947   1.262  -7.511
  273   1HB   ASN  31          HB1       ASN  31   7.143   0.991  -8.765
  274   2HB   ASN  31          HB2       ASN  31   7.574  -0.253  -7.601
  275   1HD2  ASN  31          HD21      ASN  31   5.724   0.459 -10.436
  276   2HD2  ASN  31          HD22      ASN  31   5.108  -1.146 -10.655
  277    H    LEU  32           HN       LEU  32   3.785  -0.520  -6.694
  278    HA   LEU  32           HA       LEU  32   4.410  -1.466  -3.987
  279   1HB   LEU  32          HB1       LEU  32   1.752  -0.851  -5.281
  280   2HB   LEU  32          HB2       LEU  32   1.928  -1.598  -3.706
  281    HG   LEU  32           HG       LEU  32   2.724   1.215  -4.488
  282   1HD1  LEU  32          HD11      LEU  32   0.720   0.104  -2.517
  283   2HD1  LEU  32          HD12      LEU  32   0.363   0.964  -4.015
  284   3HD1  LEU  32          HD13      LEU  32   1.136   1.812  -2.677
  285   1HD2  LEU  32          HD21      LEU  32   3.268  -0.278  -1.919
  286   2HD2  LEU  32          HD22      LEU  32   3.331   1.479  -2.068
  287   3HD2  LEU  32          HD23      LEU  32   4.448   0.475  -2.992
  288    H    HIS  33           HN       HIS  33   3.946  -2.521  -7.173
  289    HA   HIS  33           HA       HIS  33   2.676  -5.001  -6.959
  290   1HB   HIS  33          HB1       HIS  33   3.146  -3.559  -9.021
  291   2HB   HIS  33          HB2       HIS  33   4.765  -4.250  -9.003
  292    HD2  HIS  33           HD2      HIS  33   1.696  -6.427  -8.173
  293    HE1  HIS  33           HE1      HIS  33   3.044  -7.610 -12.026
  294    HE2  HIS  33           HE2      HIS  33   1.482  -8.180 -10.104
  295    H    GLY  34           HN       GLY  34   3.490  -6.264  -5.319
  296   1HA   GLY  34          HA1       GLY  34   4.810  -8.305  -5.114
  297   2HA   GLY  34          HA2       GLY  34   6.193  -7.391  -5.677
  298    H    ILE  35           HN       ILE  35   4.129  -5.826  -3.279
  299    HA   ILE  35           HA       ILE  35   6.341  -5.854  -1.453
  300    HB   ILE  35           HB       ILE  35   4.969  -4.578   0.105
  301   1HG1  ILE  35          HG11      ILE  35   2.760  -5.147  -1.806
  302   2HG1  ILE  35          HG12      ILE  35   2.708  -4.874  -0.066
  303   1HG2  ILE  35          HG21      ILE  35   5.115  -3.490  -2.698
  304   2HG2  ILE  35          HG22      ILE  35   6.434  -3.560  -1.531
  305   3HG2  ILE  35          HG23      ILE  35   5.032  -2.539  -1.215
  306   1HD1  ILE  35          HD11      ILE  35   1.555  -3.076  -1.201
  307   2HD1  ILE  35          HD12      ILE  35   2.967  -2.758  -2.209
  308   3HD1  ILE  35          HD13      ILE  35   3.035  -2.445  -0.476
  309    H    PHE  36           HN       PHE  36   3.393  -7.756  -1.651
  310    HA   PHE  36           HA       PHE  36   3.198  -8.666   0.956
  311   1HB   PHE  36          HB1       PHE  36   2.392  -9.898  -1.665
  312   2HB   PHE  36          HB2       PHE  36   2.115 -10.727  -0.135
  313    HD1  PHE  36           HD1      PHE  36   1.354  -8.615   1.692
  314    HD2  PHE  36           HD2      PHE  36   0.314  -9.153  -2.448
  315    HE1  PHE  36           HE1      PHE  36  -0.701  -7.258   2.040
  316    HE2  PHE  36           HE2      PHE  36  -1.743  -7.796  -2.104
  317    HZ   PHE  36           HZ       PHE  36  -2.246  -6.839   0.136
  318    H    GLY  37           HN       GLY  37   4.575  -9.614   2.167
  319   1HA   GLY  37          HA1       GLY  37   5.822 -11.450   2.937
  320   2HA   GLY  37          HA2       GLY  37   6.229 -11.857   1.281
  321    H    ARG  38           HN       ARG  38   6.757  -8.609   1.445
  322    HA   ARG  38           HA       ARG  38   9.612  -8.896   2.126
  323   1HB   ARG  38          HB1       ARG  38   8.125  -7.244   0.096
  324   2HB   ARG  38          HB2       ARG  38   9.679  -6.684   0.694
  325   1HG   ARG  38          HG1       ARG  38  10.847  -8.334  -0.377
  326   2HG   ARG  38          HG2       ARG  38   9.508  -9.482  -0.302
  327   1HD   ARG  38          HD1       ARG  38   9.580  -8.938  -2.571
  328   2HD   ARG  38          HD2       ARG  38   8.337  -7.847  -1.955
  329    HE   ARG  38           HE       ARG  38  10.522  -7.057  -1.524
  330   1HH1  ARG  38          HH21      ARG  38   8.637  -7.523  -4.371
  331   2HH1  ARG  38          HH22      ARG  38   8.990  -6.011  -5.033
  332   1HH2  ARG  38          HH11      ARG  38  11.482  -4.955  -3.187
  333   2HH2  ARG  38          HH12      ARG  38  10.950  -5.238  -4.788
  334    H    HIS  39           HN       HIS  39  10.599  -6.860   2.959
  335    HA   HIS  39           HA       HIS  39   9.014  -5.847   5.162
  336   1HB   HIS  39          HB1       HIS  39  11.878  -5.123   4.507
  337   2HB   HIS  39          HB2       HIS  39  11.078  -5.088   6.081
  338    HD2  HIS  39           HD2      HIS  39  10.714  -7.429   7.364
  339    HE1  HIS  39           HE1      HIS  39  12.998  -9.855   4.718
  340    HE2  HIS  39           HE2      HIS  39  11.751  -9.791   6.930
  341    H    SER  40           HN       SER  40   9.090  -3.451   5.661
  342    HA   SER  40           HA       SER  40   8.125  -1.927   3.512
  343   1HB   SER  40          HB1       SER  40   9.227  -0.556   5.936
  344   2HB   SER  40          HB2       SER  40   7.820  -0.142   4.968
  345    HG   SER  40           HG       SER  40   7.162  -2.402   5.910
  346    H    GLY  41           HN       GLY  41   8.974  -0.237   2.341
  347   1HA   GLY  41          HA1       GLY  41  10.592   1.135   1.422
  348   2HA   GLY  41          HA2       GLY  41  11.710   0.611   2.658
  349    H    GLN  42           HN       GLN  42  10.127  -1.416   0.084
  350    HA   GLN  42           HA       GLN  42  12.846  -2.014  -0.847
  351   1HB   GLN  42          HB1       GLN  42  10.528  -3.899  -0.586
  352   2HB   GLN  42          HB2       GLN  42  11.991  -4.295  -1.481
  353   1HG   GLN  42          HG1       GLN  42  13.291  -3.777   0.628
  354   2HG   GLN  42          HG2       GLN  42  11.743  -3.696   1.466
  355   1HE2  GLN  42          HE21      GLN  42  12.564  -5.499   2.781
  356   2HE2  GLN  42          HE22      GLN  42  12.508  -7.104   2.150
  357    H    ALA  43           HN       ALA  43  10.755  -0.068  -2.133
  358    HA   ALA  43           HA       ALA  43  10.016  -1.027  -4.635
  359   1HB   ALA  43          HB1       ALA  43   9.820   1.312  -5.293
  360   2HB   ALA  43          HB2       ALA  43  10.762   1.791  -3.882
  361   3HB   ALA  43          HB3       ALA  43   9.182   1.039  -3.673
  362    H    GLU  44           HN       GLU  44  11.062  -1.646  -6.390
  363    HA   GLU  44           HA       GLU  44  13.862  -1.565  -6.667
  364   1HB   GLU  44          HB1       GLU  44  11.947  -2.371  -8.865
  365   2HB   GLU  44          HB2       GLU  44  13.587  -2.946  -8.582
  366   1HG   GLU  44          HG1       GLU  44  12.416  -4.723  -7.739
  367   2HG   GLU  44          HG2       GLU  44  12.586  -3.760  -6.285
  368    H    GLY  45           HN       GLY  45  14.292   0.706  -6.531
  369   1HA   GLY  45          HA1       GLY  45  15.531   2.172  -8.075
  370   2HA   GLY  45          HA2       GLY  45  14.122   2.139  -9.111
  371    H    TYR  46           HN       TYR  46  13.178   2.412  -5.867
  372    HA   TYR  46           HA       TYR  46  13.164   5.334  -5.884
  373   1HB   TYR  46          HB1       TYR  46  11.022   4.122  -6.734
  374   2HB   TYR  46          HB2       TYR  46  10.708   3.880  -5.021
  375    HD1  TYR  46           HD1      TYR  46  10.742   6.267  -7.780
  376    HD2  TYR  46           HD2      TYR  46  10.448   5.844  -3.515
  377    HE1  TYR  46           HE1      TYR  46   9.676   8.515  -7.644
  378    HE2  TYR  46           HE2      TYR  46   9.280   8.040  -3.369
  379    HH   TYR  46           HH       TYR  46   7.992   9.613  -6.073
  380    H    SER  47           HN       SER  47  13.525   6.343  -4.003
  381    HA   SER  47           HA       SER  47  14.445   4.829  -1.739
  382   1HB   SER  47          HB1       SER  47  14.340   7.691  -1.294
  383   2HB   SER  47          HB2       SER  47  15.736   6.613  -1.355
  384    HG   SER  47           HG       SER  47  16.030   7.082  -3.409
  385    H    TYR  48           HN       TYR  48  13.914   5.407   0.447
  386    HA   TYR  48           HA       TYR  48  11.168   6.217   1.063
  387   1HB   TYR  48          HB1       TYR  48  12.714   3.779   1.932
  388   2HB   TYR  48          HB2       TYR  48  11.282   4.338   2.793
  389    HD1  TYR  48           HD1      TYR  48   9.078   4.269   1.761
  390    HD2  TYR  48           HD2      TYR  48  12.540   2.761  -0.297
  391    HE1  TYR  48           HE1      TYR  48   7.600   2.958   0.252
  392    HE2  TYR  48           HE2      TYR  48  11.072   1.446  -1.812
  393    HH   TYR  48           HH       TYR  48   8.189   0.499  -1.099
  394    H    THR  49           HN       THR  49  10.993   6.514   3.651
  395    HA   THR  49           HA       THR  49  12.911   8.536   4.434
  396    HB   THR  49           HB       THR  49  11.425   8.536   6.566
  397    HG1  THR  49           HG1      THR  49   9.372   7.651   4.959
  398   1HG2  THR  49          HG21      THR  49  10.581   9.497   3.857
  399   2HG2  THR  49          HG22      THR  49  11.350  10.402   5.162
  400   3HG2  THR  49          HG23      THR  49   9.672   9.881   5.319
  401    H    ASP  50           HN       ASP  50  13.704   8.662   6.700
  402    HA   ASP  50           HA       ASP  50  15.372   6.545   7.404
  403   1HB   ASP  50          HB1       ASP  50  15.770   8.915   7.927
  404   2HB   ASP  50          HB2       ASP  50  14.426   8.893   9.066
  405    H    ALA  51           HN       ALA  51  12.141   7.340   8.556
  406    HA   ALA  51           HA       ALA  51  12.150   5.441  10.712
  407   1HB   ALA  51          HB1       ALA  51  11.051   7.610  10.924
  408   2HB   ALA  51          HB2       ALA  51   9.904   6.289  11.146
  409   3HB   ALA  51          HB3       ALA  51   9.936   7.180   9.625
  410    H    ASN  52           HN       ASN  52  10.818   5.446   7.385
  411    HA   ASN  52           HA       ASN  52   9.118   3.189   7.838
  412   1HB   ASN  52          HB1       ASN  52   8.283   4.428   6.115
  413   2HB   ASN  52          HB2       ASN  52   9.874   4.898   5.531
  414   1HD2  ASN  52          HD21      ASN  52   7.295   2.578   5.202
  415   2HD2  ASN  52          HD22      ASN  52   7.982   1.824   3.809
  416    H    ILE  53           HN       ILE  53  12.403   3.566   6.597
  417    HA   ILE  53           HA       ILE  53  12.775   0.856   5.843
  418    HB   ILE  53           HB       ILE  53  14.754   3.029   6.464
  419   1HG1  ILE  53          HG11      ILE  53  13.897   1.938   3.766
  420   2HG1  ILE  53          HG12      ILE  53  13.160   3.354   4.510
  421   1HG2  ILE  53          HG21      ILE  53  15.306   0.429   5.012
  422   2HG2  ILE  53          HG22      ILE  53  15.760   0.749   6.686
  423   3HG2  ILE  53          HG23      ILE  53  16.468   1.705   5.386
  424   1HD1  ILE  53          HD11      ILE  53  14.805   4.072   2.900
  425   2HD1  ILE  53          HD12      ILE  53  16.041   3.060   3.647
  426   3HD1  ILE  53          HD13      ILE  53  15.397   4.450   4.518
  427    H    LYS  54           HN       LYS  54  14.496   2.475   8.567
  428    HA   LYS  54           HA       LYS  54  15.221   0.454  10.144
  429   1HB   LYS  54          HB1       LYS  54  13.912   3.039  10.970
  430   2HB   LYS  54          HB2       LYS  54  14.707   1.948  12.108
  431   1HG   LYS  54          HG1       LYS  54  16.807   2.143  10.878
  432   2HG   LYS  54          HG2       LYS  54  16.029   3.186   9.685
  433   1HD   LYS  54          HD1       LYS  54  15.527   4.812  11.516
  434   2HD   LYS  54          HD2       LYS  54  16.470   3.794  12.616
  435   1HE   LYS  54          HE1       LYS  54  18.479   4.191  11.449
  436   2HE   LYS  54          HE2       LYS  54  17.630   4.796  10.024
  437   1HZ   LYS  54          HZ1       LYS  54  17.793   6.148  12.657
  438   2HZ   LYS  54          HZ2       LYS  54  16.910   6.706  11.321
  439   3HZ   LYS  54          HZ3       LYS  54  18.598   6.606  11.237
  440    H    LYS  55           HN       LYS  55  11.936   0.992   9.366
  441    HA   LYS  55           HA       LYS  55  10.771  -0.254  11.697
  442   1HB   LYS  55          HB1       LYS  55   9.777   1.641  10.406
  443   2HB   LYS  55          HB2       LYS  55   9.459   0.526   9.098
  444   1HG   LYS  55          HG1       LYS  55   7.437   0.893  10.258
  445   2HG   LYS  55          HG2       LYS  55   7.962  -0.744  10.612
  446   1HD   LYS  55          HD1       LYS  55   8.932   0.295  12.785
  447   2HD   LYS  55          HD2       LYS  55   7.869   1.652  12.418
  448   1HE   LYS  55          HE1       LYS  55   6.994  -1.225  12.763
  449   2HE   LYS  55          HE2       LYS  55   6.821   0.050  13.970
  450   1HZ   LYS  55          HZ1       LYS  55   5.597   0.161  11.264
  451   2HZ   LYS  55          HZ2       LYS  55   5.327   1.222  12.549
  452   3HZ   LYS  55          HZ3       LYS  55   4.784  -0.375  12.652
  453    H    ASN  56           HN       ASN  56  11.498  -1.288   8.435
  454    HA   ASN  56           HA       ASN  56  11.220  -3.117   7.189
  455   1HB   ASN  56          HB1       ASN  56  12.746  -3.800   9.596
  456   2HB   ASN  56          HB2       ASN  56  12.138  -5.188   8.722
  457   1HD2  ASN  56          HD21      ASN  56  14.377  -2.421   8.533
  458   2HD2  ASN  56          HD22      ASN  56  14.933  -2.994   7.021
  459    H    VAL  57           HN       VAL  57   8.689  -2.563   8.199
  460    HA   VAL  57           HA       VAL  57   7.469  -4.803   9.445
  461    HB   VAL  57           HB       VAL  57   6.642  -2.217   8.535
  462   1HG1  VAL  57          HG11      VAL  57   4.541  -4.328   8.064
  463   2HG1  VAL  57          HG12      VAL  57   5.321  -3.392   6.789
  464   3HG1  VAL  57          HG13      VAL  57   4.326  -2.579   7.997
  465   1HG2  VAL  57          HG21      VAL  57   6.646  -2.967  10.811
  466   2HG2  VAL  57          HG22      VAL  57   5.502  -4.254  10.431
  467   3HG2  VAL  57          HG23      VAL  57   4.994  -2.568  10.337
  468    H    LEU  58           HN       LEU  58   6.856  -6.712   8.617
  469    HA   LEU  58           HA       LEU  58   7.305  -7.161   5.793
  470   1HB   LEU  58          HB1       LEU  58   8.139  -8.722   7.595
  471   2HB   LEU  58          HB2       LEU  58   6.467  -9.196   7.863
  472    HG   LEU  58           HG       LEU  58   7.353  -9.351   5.043
  473   1HD1  LEU  58          HD11      LEU  58   8.328 -11.469   6.946
  474   2HD1  LEU  58          HD12      LEU  58   9.344 -10.106   6.477
  475   3HD1  LEU  58          HD13      LEU  58   8.755 -11.228   5.250
  476   1HD2  LEU  58          HD21      LEU  58   6.087 -11.367   5.007
  477   2HD2  LEU  58          HD22      LEU  58   5.149 -10.215   5.956
  478   3HD2  LEU  58          HD23      LEU  58   6.077 -11.475   6.768
  479    H    TRP  59           HN       TRP  59   5.736  -6.367   4.568
  480    HA   TRP  59           HA       TRP  59   3.057  -6.006   5.218
  481   1HB   TRP  59          HB1       TRP  59   4.291  -6.380   2.490
  482   2HB   TRP  59          HB2       TRP  59   2.715  -5.683   2.807
  483    HD1  TRP  59           HD1      TRP  59   6.005  -4.650   1.909
  484    HE1  TRP  59           HE1      TRP  59   6.451  -2.190   2.538
  485    HE3  TRP  59           HE3      TRP  59   2.057  -3.816   5.052
  486    HZ2  TRP  59           HZ2      TRP  59   5.383  -0.184   4.274
  487    HZ3  TRP  59           HZ3      TRP  59   1.784  -1.624   6.146
  488    HH2  TRP  59           HH2      TRP  59   3.414   0.192   5.774
  489    H    ASP  60           HN       ASP  60   1.746  -7.524   5.790
  490    HA   ASP  60           HA       ASP  60   1.458 -10.064   4.363
  491   1HB   ASP  60          HB1       ASP  60   1.914 -10.984   6.353
  492   2HB   ASP  60          HB2       ASP  60   1.890  -9.418   7.143
  493    H    GLU  61           HN       GLU  61  -0.954 -10.884   5.274
  494    HA   GLU  61           HA       GLU  61  -2.797  -9.451   3.687
  495   1HB   GLU  61          HB1       GLU  61  -2.752 -11.986   4.571
  496   2HB   GLU  61          HB2       GLU  61  -3.837 -11.306   5.780
  497   1HG   GLU  61          HG1       GLU  61  -5.373 -11.935   4.203
  498   2HG   GLU  61          HG2       GLU  61  -5.031 -10.299   3.635
  499    H    ASN  62           HN       ASN  62  -2.746  -9.873   7.251
  500    HA   ASN  62           HA       ASN  62  -4.617  -7.740   7.669
  501   1HB   ASN  62          HB1       ASN  62  -4.631  -9.697   9.085
  502   2HB   ASN  62          HB2       ASN  62  -2.967  -9.420   9.565
  503   1HD2  ASN  62          HD21      ASN  62  -2.524  -7.624  10.945
  504   2HD2  ASN  62          HD22      ASN  62  -3.772  -6.941  11.923
  505    H    ASN  63           HN       ASN  63  -1.069  -8.056   8.194
  506    HA   ASN  63           HA       ASN  63  -0.506  -5.650   9.362
  507   1HB   ASN  63          HB1       ASN  63   1.148  -7.346   9.090
  508   2HB   ASN  63          HB2       ASN  63   1.068  -7.239   7.342
  509   1HD2  ASN  63          HD21      ASN  63   2.263  -5.611  10.258
  510   2HD2  ASN  63          HD22      ASN  63   3.169  -4.499   9.293
  511    H    MET  64           HN       MET  64  -0.733  -6.018   5.743
  512    HA   MET  64           HA       MET  64  -0.155  -3.390   5.089
  513   1HB   MET  64          HB1       MET  64  -0.327  -5.016   3.373
  514   2HB   MET  64          HB2       MET  64  -2.001  -5.372   3.776
  515   1HG   MET  64          HG1       MET  64  -2.545  -3.007   3.105
  516   2HG   MET  64          HG2       MET  64  -0.909  -2.885   2.486
  517   1HE   MET  64          HE1       MET  64  -4.111  -5.754   0.777
  518   2HE   MET  64          HE2       MET  64  -4.404  -4.666   2.135
  519   3HE   MET  64          HE3       MET  64  -3.287  -6.020   2.316
  520    H    SER  65           HN       SER  65  -3.277  -4.636   6.261
  521    HA   SER  65           HA       SER  65  -4.758  -2.257   5.914
  522   1HB   SER  65          HB1       SER  65  -5.337  -4.293   8.050
  523   2HB   SER  65          HB2       SER  65  -6.469  -3.266   7.180
  524    HG   SER  65           HG       SER  65  -5.322  -5.673   6.458
  525    H    GLU  66           HN       GLU  66  -2.790  -3.375   8.640
  526    HA   GLU  66           HA       GLU  66  -3.463  -1.561  10.604
  527   1HB   GLU  66          HB1       GLU  66  -0.734  -2.696   9.925
  528   2HB   GLU  66          HB2       GLU  66  -1.170  -1.964  11.466
  529   1HG   GLU  66          HG1       GLU  66  -2.644  -3.718  12.015
  530   2HG   GLU  66          HG2       GLU  66  -2.663  -4.327  10.360
  531    H    TYR  67           HN       TYR  67  -1.059  -1.171   8.035
  532    HA   TYR  67           HA       TYR  67  -0.378   1.540   8.561
  533   1HB   TYR  67          HB1       TYR  67   1.127  -0.106   7.536
  534   2HB   TYR  67          HB2       TYR  67   0.081  -0.184   6.130
  535    HD1  TYR  67           HD1      TYR  67   0.451   1.237   4.292
  536    HD2  TYR  67           HD2      TYR  67   2.199   2.160   8.105
  537    HE1  TYR  67           HE1      TYR  67   1.897   2.949   3.207
  538    HE2  TYR  67           HE2      TYR  67   3.691   3.837   7.034
  539    HH   TYR  67           HH       TYR  67   4.568   4.450   4.985
  540    H    LEU  68           HN       LEU  68  -2.565   0.036   6.103
  541    HA   LEU  68           HA       LEU  68  -3.115   2.377   4.691
  542   1HB   LEU  68          HB1       LEU  68  -4.932   0.032   5.212
  543   2HB   LEU  68          HB2       LEU  68  -5.215   1.272   4.003
  544    HG   LEU  68           HG       LEU  68  -3.038  -0.820   4.031
  545   1HD1  LEU  68          HD11      LEU  68  -5.160  -0.044   2.016
  546   2HD1  LEU  68          HD12      LEU  68  -5.330  -1.342   3.197
  547   3HD1  LEU  68          HD13      LEU  68  -4.097  -1.450   1.941
  548   1HD2  LEU  68          HD21      LEU  68  -3.298   1.517   2.110
  549   2HD2  LEU  68          HD22      LEU  68  -2.162   0.176   1.968
  550   3HD2  LEU  68          HD23      LEU  68  -2.009   1.323   3.298
  551    H    THR  69           HN       THR  69  -4.657   1.297   7.728
  552    HA   THR  69           HA       THR  69  -6.739   3.215   7.707
  553    HB   THR  69           HB       THR  69  -5.629   2.163  10.271
  554    HG1  THR  69           HG1      THR  69  -5.698   0.336   9.053
  555   1HG2  THR  69          HG21      THR  69  -7.630   3.620  10.343
  556   2HG2  THR  69          HG22      THR  69  -7.993   1.975  10.866
  557   3HG2  THR  69          HG23      THR  69  -8.459   2.509   9.252
  558    H    ASN  70           HN       ASN  70  -3.419   3.390   8.935
  559    HA   ASN  70           HA       ASN  70  -3.475   6.236   8.827
  560   1HB   ASN  70          HB1       ASN  70  -4.570   5.696  11.065
  561   2HB   ASN  70          HB2       ASN  70  -2.992   5.118  11.590
  562   1HD2  ASN  70          HD21      ASN  70  -4.504   7.339  12.680
  563   2HD2  ASN  70          HD22      ASN  70  -3.328   8.601  12.575
  564    HA   PRO  71           HA       PRO  71   0.638   4.451   7.775
  565   1HB   PRO  71          HB1       PRO  71   1.341   6.644   6.261
  566   2HB   PRO  71          HB2       PRO  71   0.489   5.227   5.641
  567   1HG   PRO  71          HG1       PRO  71  -0.610   7.874   6.502
  568   2HG   PRO  71          HG2       PRO  71  -1.055   6.877   5.104
  569   1HD   PRO  71          HD1       PRO  71  -2.570   6.937   7.312
  570   2HD   PRO  71          HD2       PRO  71  -2.348   5.438   6.385
  571    H    LYS  72           HN       LYS  72   0.028   7.850   8.635
  572    HA   LYS  72           HA       LYS  72   2.617   8.475   9.546
  573   1HB   LYS  72          HB1       LYS  72  -0.041   9.761  10.178
  574   2HB   LYS  72          HB2       LYS  72   1.510  10.429  10.657
  575   1HG   LYS  72          HG1       LYS  72   1.534   9.899   7.841
  576   2HG   LYS  72          HG2       LYS  72   0.103  10.838   8.251
  577   1HD   LYS  72          HD1       LYS  72   1.521  12.526   9.333
  578   2HD   LYS  72          HD2       LYS  72   2.954  11.576   8.939
  579   1HE   LYS  72          HE1       LYS  72   1.039  12.821   6.963
  580   2HE   LYS  72          HE2       LYS  72   2.641  13.423   7.361
  581   1HZ   LYS  72          HZ1       LYS  72   2.082  10.798   6.092
  582   2HZ   LYS  72          HZ2       LYS  72   3.607  11.461   6.394
  583   3HZ   LYS  72          HZ3       LYS  72   2.583  12.198   5.272
  584    H    LYS  73           HN       LYS  73  -0.180   7.147  11.242
  585    HA   LYS  73           HA       LYS  73   1.075   7.373  13.821
  586   1HB   LYS  73          HB1       LYS  73  -1.370   7.477  13.585
  587   2HB   LYS  73          HB2       LYS  73  -1.388   5.808  13.038
  588   1HG   LYS  73          HG1       LYS  73  -2.045   5.978  15.384
  589   2HG   LYS  73          HG2       LYS  73  -0.558   5.057  15.206
  590   1HD   LYS  73          HD1       LYS  73   0.422   7.572  15.630
  591   2HD   LYS  73          HD2       LYS  73  -1.054   7.614  16.592
  592   1HE   LYS  73          HE1       LYS  73   0.536   6.857  18.114
  593   2HE   LYS  73          HE2       LYS  73  -0.216   5.363  17.562
  594   1HZ   LYS  73          HZ1       LYS  73   2.041   4.925  17.494
  595   2HZ   LYS  73          HZ2       LYS  73   2.437   6.448  16.881
  596   3HZ   LYS  73          HZ3       LYS  73   1.686   5.311  15.883
  597    H    TYR  74           HN       TYR  74   0.640   4.717  11.506
  598    HA   TYR  74           HA       TYR  74   1.838   2.700  13.090
  599   1HB   TYR  74          HB1       TYR  74   0.343   2.480  11.024
  600   2HB   TYR  74          HB2       TYR  74   1.812   2.739  10.085
  601    HD1  TYR  74           HD1      TYR  74   3.036   0.825   9.419
  602    HD2  TYR  74           HD2      TYR  74   0.600   0.728  12.960
  603    HE1  TYR  74           HE1      TYR  74   3.538  -1.606   9.697
  604    HE2  TYR  74           HE2      TYR  74   1.083  -1.687  13.246
  605    HH   TYR  74           HH       TYR  74   1.715  -3.620  11.675
  606    H    ILE  75           HN       ILE  75   3.177   4.840  10.635
  607    HA   ILE  75           HA       ILE  75   5.904   4.249  11.543
  608    HB   ILE  75           HB       ILE  75   5.053   4.609   8.657
  609   1HG1  ILE  75          HG11      ILE  75   6.157   2.194  10.139
  610   2HG1  ILE  75          HG12      ILE  75   4.549   2.340   9.447
  611   1HG2  ILE  75          HG21      ILE  75   7.806   4.117   9.829
  612   2HG2  ILE  75          HG22      ILE  75   7.223   5.672   9.239
  613   3HG2  ILE  75          HG23      ILE  75   7.416   4.323   8.121
  614   1HD1  ILE  75          HD11      ILE  75   5.978   0.924   8.068
  615   2HD1  ILE  75          HD12      ILE  75   7.140   2.238   7.892
  616   3HD1  ILE  75          HD13      ILE  75   5.529   2.387   7.191
  617    HA   PRO  76           HA       PRO  76   5.073   8.708  12.167
  618   1HB   PRO  76          HB1       PRO  76   6.982   8.988  14.096
  619   2HB   PRO  76          HB2       PRO  76   5.339   8.428  14.422
  620   1HG   PRO  76          HG1       PRO  76   7.852   6.841  14.091
  621   2HG   PRO  76          HG2       PRO  76   6.539   6.629  15.263
  622   1HD   PRO  76          HD1       PRO  76   6.773   5.091  13.052
  623   2HD   PRO  76          HD2       PRO  76   5.199   5.520  13.751
  624    H    GLY  77           HN       GLY  77   5.879   9.775  10.431
  625   1HA   GLY  77          HA1       GLY  77   7.704  11.304   9.837
  626   2HA   GLY  77          HA2       GLY  77   8.809   9.975  10.128
  627    H    THR  78           HN       THR  78   6.103   8.758   8.557
  628    HA   THR  78           HA       THR  78   7.457   8.317   6.076
  629    HB   THR  78           HB       THR  78   5.532   7.000   7.476
  630    HG1  THR  78           HG1      THR  78   6.925   6.635   5.257
  631   1HG2  THR  78          HG21      THR  78   3.622   6.669   5.942
  632   2HG2  THR  78          HG22      THR  78   4.154   8.072   5.016
  633   3HG2  THR  78          HG23      THR  78   3.638   8.266   6.691
  634    H    LYS  79           HN       LYS  79   6.997   9.029   4.039
  635    HA   LYS  79           HA       LYS  79   5.969  11.667   3.730
  636   1HB   LYS  79          HB1       LYS  79   6.494   9.680   1.526
  637   2HB   LYS  79          HB2       LYS  79   6.532  11.433   1.423
  638   1HG   LYS  79          HG1       LYS  79   8.542  11.459   2.853
  639   2HG   LYS  79          HG2       LYS  79   8.511   9.689   2.895
  640   1HD   LYS  79          HD1       LYS  79   8.321  10.189   0.202
  641   2HD   LYS  79          HD2       LYS  79   9.377  11.502   0.739
  642   1HE   LYS  79          HE1       LYS  79  11.005   9.940   0.491
  643   2HE   LYS  79          HE2       LYS  79  10.468   9.431   2.092
  644   1HZ   LYS  79          HZ1       LYS  79  10.602   7.827  -0.057
  645   2HZ   LYS  79          HZ2       LYS  79   8.978   8.284  -0.097
  646   3HZ   LYS  79          HZ3       LYS  79   9.606   7.549   1.287
  647    H    MET  80           HN       MET  80   4.384   8.516   3.378
  648    HA   MET  80           HA       MET  80   2.330   9.361   1.648
  649   1HB   MET  80          HB1       MET  80   2.507   7.089   1.602
  650   2HB   MET  80          HB2       MET  80   2.800   6.962   3.340
  651   1HG   MET  80          HG1       MET  80   0.585   7.054   3.877
  652   2HG   MET  80          HG2       MET  80   0.159   7.978   2.448
  653   1HE   MET  80          HE1       MET  80  -2.030   4.658   2.514
  654   2HE   MET  80          HE2       MET  80  -2.118   6.418   2.441
  655   3HE   MET  80          HE3       MET  80  -1.441   5.628   3.864
  656    H    ALA  81           HN       ALA  81   1.153  11.022   2.059
  657    HA   ALA  81           HA       ALA  81  -0.052  11.452   4.682
  658   1HB   ALA  81          HB1       ALA  81   0.535  13.432   2.500
  659   2HB   ALA  81          HB2       ALA  81   1.470  13.176   3.972
  660   3HB   ALA  81          HB3       ALA  81  -0.173  13.807   4.072
  661    H    PHE  82           HN       PHE  82  -1.158   9.781   2.580
  662    HA   PHE  82           HA       PHE  82  -3.399  10.693   1.278
  663   1HB   PHE  82          HB1       PHE  82  -2.470   8.707   0.529
  664   2HB   PHE  82          HB2       PHE  82  -2.436   7.994   2.136
  665    HD1  PHE  82           HD1      PHE  82  -4.671   8.937  -0.690
  666    HD2  PHE  82           HD2      PHE  82  -4.248   6.704   2.963
  667    HE1  PHE  82           HE1      PHE  82  -6.886   7.872  -1.083
  668    HE2  PHE  82           HE2      PHE  82  -6.465   5.650   2.578
  669    HZ   PHE  82           HZ       PHE  82  -7.792   6.250   0.566
  670    H    GLY  83           HN       GLY  83  -3.181  10.270   4.690
  671   1HA   GLY  83          HA1       GLY  83  -4.908  10.950   6.164
  672   2HA   GLY  83          HA2       GLY  83  -6.078  10.665   4.896
  673    H    GLY  84           HN       GLY  84  -5.349   7.951   4.311
  674   1HA   GLY  84          HA1       GLY  84  -5.328   5.771   5.147
  675   2HA   GLY  84          HA2       GLY  84  -5.584   6.399   6.764
  676    H    LEU  85           HN       LEU  85  -6.963   4.588   4.446
  677    HA   LEU  85           HA       LEU  85  -9.699   5.419   4.497
  678   1HB   LEU  85          HB1       LEU  85  -8.283   2.966   3.482
  679   2HB   LEU  85          HB2       LEU  85 -10.030   3.081   3.480
  680    HG   LEU  85           HG       LEU  85  -8.092   4.802   1.919
  681   1HD1  LEU  85          HD11      LEU  85  -8.591   2.536   1.045
  682   2HD1  LEU  85          HD12      LEU  85  -9.210   3.813  -0.002
  683   3HD1  LEU  85          HD13      LEU  85 -10.310   2.932   1.058
  684   1HD2  LEU  85          HD21      LEU  85 -10.087   5.862   0.914
  685   2HD2  LEU  85          HD22      LEU  85  -9.943   6.242   2.630
  686   3HD2  LEU  85          HD23      LEU  85 -11.109   5.035   2.090
  687    H    LYS  86           HN       LYS  86 -10.225   5.579   6.581
  688    HA   LYS  86           HA       LYS  86  -9.950   3.877   8.725
  689   1HB   LYS  86          HB1       LYS  86 -12.217   5.812   8.220
  690   2HB   LYS  86          HB2       LYS  86 -11.684   5.211   9.785
  691   1HG   LYS  86          HG1       LYS  86  -9.876   6.789   7.956
  692   2HG   LYS  86          HG2       LYS  86 -10.916   7.550   9.162
  693   1HD   LYS  86          HD1       LYS  86  -9.794   6.362  10.952
  694   2HD   LYS  86          HD2       LYS  86  -8.845   5.433   9.793
  695   1HE   LYS  86          HE1       LYS  86  -8.698   8.438  10.104
  696   2HE   LYS  86          HE2       LYS  86  -7.585   7.306  10.868
  697   1HZ   LYS  86          HZ1       LYS  86  -7.998   7.395   7.938
  698   2HZ   LYS  86          HZ2       LYS  86  -6.740   6.656   8.792
  699   3HZ   LYS  86          HZ3       LYS  86  -6.832   8.342   8.723
  700    H    LYS  87           HN       LYS  87 -12.426   3.754   6.231
  701    HA   LYS  87           HA       LYS  87 -14.294   2.057   7.519
  702   1HB   LYS  87          HB1       LYS  87 -13.712   2.497   4.599
  703   2HB   LYS  87          HB2       LYS  87 -15.090   1.620   5.208
  704   1HG   LYS  87          HG1       LYS  87 -15.119   4.314   6.278
  705   2HG   LYS  87          HG2       LYS  87 -15.009   4.322   4.491
  706   1HD   LYS  87          HD1       LYS  87 -16.560   2.135   5.053
  707   2HD   LYS  87          HD2       LYS  87 -17.097   3.260   6.253
  708   1HE   LYS  87          HE1       LYS  87 -18.668   3.156   4.477
  709   2HE   LYS  87          HE2       LYS  87 -17.853   4.733   4.364
  710   1HZ   LYS  87          HZ1       LYS  87 -17.964   3.469   2.215
  711   2HZ   LYS  87          HZ2       LYS  87 -16.945   2.307   2.893
  712   3HZ   LYS  87          HZ3       LYS  87 -16.392   3.896   2.688
  713    H    GLU  88           HN       GLU  88 -13.444   0.155   8.308
  714    HA   GLU  88           HA       GLU  88 -11.584  -1.559   7.213
  715   1HB   GLU  88          HB1       GLU  88 -12.695  -1.520   9.526
  716   2HB   GLU  88          HB2       GLU  88 -13.930  -2.545   8.799
  717   1HG   GLU  88          HG1       GLU  88 -11.860  -3.979   8.024
  718   2HG   GLU  88          HG2       GLU  88 -11.061  -3.159   9.373
  719    H    LYS  89           HN       LYS  89 -15.102  -1.641   6.586
  720    HA   LYS  89           HA       LYS  89 -15.175  -4.072   5.205
  721   1HB   LYS  89          HB1       LYS  89 -17.044  -1.837   4.515
  722   2HB   LYS  89          HB2       LYS  89 -17.377  -3.555   4.718
  723   1HG   LYS  89          HG1       LYS  89 -16.434  -1.974   7.067
  724   2HG   LYS  89          HG2       LYS  89 -18.110  -1.830   6.556
  725   1HD   LYS  89          HD1       LYS  89 -18.119  -3.498   8.229
  726   2HD   LYS  89          HD2       LYS  89 -18.182  -4.399   6.705
  727   1HE   LYS  89          HE1       LYS  89 -16.072  -5.223   6.943
  728   2HE   LYS  89          HE2       LYS  89 -15.472  -3.753   7.710
  729   1HZ   LYS  89          HZ1       LYS  89 -16.979  -4.595   9.656
  730   2HZ   LYS  89          HZ2       LYS  89 -15.412  -5.193   9.453
  731   3HZ   LYS  89          HZ3       LYS  89 -16.735  -6.102   8.918
  732    H    ASP  90           HN       ASP  90 -14.581  -0.847   4.116
  733    HA   ASP  90           HA       ASP  90 -14.436  -1.175   1.366
  734   1HB   ASP  90          HB1       ASP  90 -13.397   0.803   3.375
  735   2HB   ASP  90          HB2       ASP  90 -13.066   0.996   1.667
  736    H    ARG  91           HN       ARG  91 -11.799  -1.350   3.847
  737    HA   ARG  91           HA       ARG  91  -9.766  -1.910   1.925
  738   1HB   ARG  91          HB1       ARG  91  -9.633  -2.618   4.864
  739   2HB   ARG  91          HB2       ARG  91  -8.282  -2.503   3.743
  740   1HG   ARG  91          HG1       ARG  91  -8.745  -0.097   3.469
  741   2HG   ARG  91          HG2       ARG  91 -10.049  -0.228   4.638
  742   1HD   ARG  91          HD1       ARG  91  -7.103  -0.656   5.163
  743   2HD   ARG  91          HD2       ARG  91  -8.055   0.738   5.648
  744    HE   ARG  91           HE       ARG  91  -7.807  -1.628   6.250
  745   1HH1  ARG  91          HH21      ARG  91  -9.523   1.266   7.116
  746   2HH1  ARG  91          HH22      ARG  91 -10.261   0.836   8.621
  747   1HH2  ARG  91          HH11      ARG  91  -8.945  -2.334   8.722
  748   2HH2  ARG  91          HH12      ARG  91  -9.975  -1.187   9.501
  749    H    ASN  92           HN       ASN  92 -11.876  -4.033   3.820
  750    HA   ASN  92           HA       ASN  92 -10.759  -6.480   3.486
  751   1HB   ASN  92          HB1       ASN  92 -13.643  -5.628   3.405
  752   2HB   ASN  92          HB2       ASN  92 -13.187  -7.321   3.297
  753   1HD2  ASN  92          HD21      ASN  92 -14.781  -6.180   5.319
  754   2HD2  ASN  92          HD22      ASN  92 -13.898  -6.612   6.742
  755    H    ASP  93           HN       ASP  93 -12.858  -4.950   1.005
  756    HA   ASP  93           HA       ASP  93 -12.449  -6.913  -0.982
  757   1HB   ASP  93          HB1       ASP  93 -14.153  -4.837  -0.743
  758   2HB   ASP  93          HB2       ASP  93 -12.999  -4.139  -1.869
  759    H    LEU  94           HN       LEU  94 -10.631  -3.871  -0.320
  760    HA   LEU  94           HA       LEU  94  -9.022  -3.772  -2.536
  761   1HB   LEU  94          HB1       LEU  94  -9.077  -2.642   0.162
  762   2HB   LEU  94          HB2       LEU  94  -7.490  -2.800  -0.495
  763    HG   LEU  94           HG       LEU  94  -9.670  -1.462  -2.066
  764   1HD1  LEU  94          HD11      LEU  94  -9.408  -0.428   0.199
  765   2HD1  LEU  94          HD12      LEU  94  -9.034   0.657  -1.144
  766   3HD1  LEU  94          HD13      LEU  94  -7.728  -0.077  -0.216
  767   1HD2  LEU  94          HD21      LEU  94  -7.937  -0.304  -3.228
  768   2HD2  LEU  94          HD22      LEU  94  -7.494  -2.011  -3.228
  769   3HD2  LEU  94          HD23      LEU  94  -6.703  -0.895  -2.115
  770    H    ILE  95           HN       ILE  95  -8.524  -5.666   0.427
  771    HA   ILE  95           HA       ILE  95  -5.937  -6.613  -0.060
  772    HB   ILE  95           HB       ILE  95  -8.108  -8.124   1.400
  773   1HG1  ILE  95          HG11      ILE  95  -6.295  -5.968   2.534
  774   2HG1  ILE  95          HG12      ILE  95  -7.978  -5.699   2.089
  775   1HG2  ILE  95          HG21      ILE  95  -5.116  -8.018   1.864
  776   2HG2  ILE  95          HG22      ILE  95  -5.981  -9.348   1.096
  777   3HG2  ILE  95          HG23      ILE  95  -6.282  -8.965   2.791
  778   1HD1  ILE  95          HD11      ILE  95  -7.708  -6.064   4.505
  779   2HD1  ILE  95          HD12      ILE  95  -7.023  -7.657   4.184
  780   3HD1  ILE  95          HD13      ILE  95  -8.701  -7.320   3.764
  781    H    THR  96           HN       THR  96  -9.084  -8.117  -0.896
  782    HA   THR  96           HA       THR  96  -8.168 -10.394  -2.188
  783    HB   THR  96           HB       THR  96 -10.536  -9.088  -3.411
  784    HG1  THR  96           HG1      THR  96 -11.099  -8.521  -1.395
  785   1HG2  THR  96          HG21      THR  96  -9.947 -11.810  -2.230
  786   2HG2  THR  96          HG22      THR  96 -10.071 -11.400  -3.941
  787   3HG2  THR  96          HG23      THR  96 -11.504 -11.341  -2.915
  788    H    TYR  97           HN       TYR  97  -8.664  -7.145  -3.635
  789    HA   TYR  97           HA       TYR  97  -7.931  -7.894  -6.254
  790   1HB   TYR  97          HB1       TYR  97  -9.119  -5.866  -5.994
  791   2HB   TYR  97          HB2       TYR  97  -7.936  -5.228  -4.862
  792    HD1  TYR  97           HD1      TYR  97  -6.411  -3.671  -5.619
  793    HD2  TYR  97           HD2      TYR  97  -8.107  -6.465  -8.413
  794    HE1  TYR  97           HE1      TYR  97  -5.191  -2.551  -7.473
  795    HE2  TYR  97           HE2      TYR  97  -6.989  -5.279 -10.292
  796    HH   TYR  97           HH       TYR  97  -4.468  -3.310  -9.990
  797    H    LEU  98           HN       LEU  98  -5.918  -6.223  -3.785
  798    HA   LEU  98           HA       LEU  98  -3.533  -6.201  -5.263
  799   1HB   LEU  98          HB1       LEU  98  -4.421  -5.383  -2.712
  800   2HB   LEU  98          HB2       LEU  98  -3.030  -6.428  -2.433
  801    HG   LEU  98           HG       LEU  98  -1.710  -5.061  -4.059
  802   1HD1  LEU  98          HD11      LEU  98  -4.175  -3.306  -4.012
  803   2HD1  LEU  98          HD12      LEU  98  -3.536  -4.173  -5.409
  804   3HD1  LEU  98          HD13      LEU  98  -2.616  -2.846  -4.698
  805   1HD2  LEU  98          HD21      LEU  98  -1.621  -4.574  -1.635
  806   2HD2  LEU  98          HD22      LEU  98  -2.961  -3.445  -1.830
  807   3HD2  LEU  98          HD23      LEU  98  -1.416  -3.122  -2.615
  808    H    LYS  99           HN       LYS  99  -4.822  -8.525  -2.986
  809    HA   LYS  99           HA       LYS  99  -2.652 -10.296  -2.849
  810   1HB   LYS  99          HB1       LYS  99  -4.004 -10.900  -1.165
  811   2HB   LYS  99          HB2       LYS  99  -5.424 -10.231  -1.947
  812   1HG   LYS  99          HG1       LYS  99  -5.817 -12.248  -3.153
  813   2HG   LYS  99          HG2       LYS  99  -4.258 -12.906  -2.699
  814   1HD   LYS  99          HD1       LYS  99  -6.029 -12.297  -0.425
  815   2HD   LYS  99          HD2       LYS  99  -6.639 -13.540  -1.521
  816   1HE   LYS  99          HE1       LYS  99  -5.261 -14.434   0.345
  817   2HE   LYS  99          HE2       LYS  99  -4.660 -14.852  -1.252
  818   1HZ   LYS  99          HZ1       LYS  99  -2.724 -14.060  -0.608
  819   2HZ   LYS  99          HZ2       LYS  99  -3.366 -13.480   0.851
  820   3HZ   LYS  99          HZ3       LYS  99  -3.415 -12.508  -0.534
  821    H    LYS 100           HN       LYS 100  -5.336 -10.091  -5.168
  822    HA   LYS 100           HA       LYS 100  -4.661 -12.498  -6.542
  823   1HB   LYS 100          HB1       LYS 100  -6.890 -10.918  -6.401
  824   2HB   LYS 100          HB2       LYS 100  -6.343 -10.676  -8.043
  825   1HG   LYS 100          HG1       LYS 100  -8.074 -12.459  -7.789
  826   2HG   LYS 100          HG2       LYS 100  -6.583 -13.030  -8.541
  827   1HD   LYS 100          HD1       LYS 100  -6.783 -13.220  -5.610
  828   2HD   LYS 100          HD2       LYS 100  -7.847 -14.259  -6.505
  829   1HE   LYS 100          HE1       LYS 100  -6.161 -15.696  -6.043
  830   2HE   LYS 100          HE2       LYS 100  -5.536 -15.049  -7.568
  831   1HZ   LYS 100          HZ1       LYS 100  -3.771 -14.253  -6.474
  832   2HZ   LYS 100          HZ2       LYS 100  -4.360 -14.898  -5.026
  833   3HZ   LYS 100          HZ3       LYS 100  -4.782 -13.323  -5.479
  834    H    ALA 101           HN       ALA 101  -3.725  -9.303  -6.944
  835    HA   ALA 101           HA       ALA 101  -2.569  -9.403  -9.547
  836   1HB   ALA 101          HB1       ALA 101  -2.452  -7.315  -7.368
  837   2HB   ALA 101          HB2       ALA 101  -3.639  -7.396  -8.669
  838   3HB   ALA 101          HB3       ALA 101  -1.943  -7.089  -9.041
  839    H    THR 102           HN       THR 102  -1.316  -9.638  -6.246
  840    HA   THR 102           HA       THR 102   1.468  -9.729  -7.009
  841    HB   THR 102           HB       THR 102   0.332 -10.331  -4.281
  842    HG1  THR 102           HG1      THR 102  -0.377  -8.280  -4.777
  843   1HG2  THR 102          HG21      THR 102   2.740 -10.854  -4.679
  844   2HG2  THR 102          HG22      THR 102   2.483  -9.602  -3.463
  845   3HG2  THR 102          HG23      THR 102   2.998  -9.157  -5.090
  846    H    GLU 103           HN       GLU 103  -1.009 -12.066  -5.931
  847    HA   GLU 103           HA       GLU 103   0.839 -14.225  -6.724
  848   1HB   GLU 103          HB1       GLU 103  -0.728 -15.544  -4.965
  849   2HB   GLU 103          HB2       GLU 103   0.806 -14.806  -4.535
  850   1HG   GLU 103          HG1       GLU 103  -0.175 -13.428  -3.111
  851   2HG   GLU 103          HG2       GLU 103  -1.326 -12.890  -4.329
  852    HHA  HEC 104           HA       HEC 104   5.219   3.494   1.377
  853    HHB  HEC 104           HB       HEC 104  -0.454   0.637   0.017
  854    HHC  HEC 104           HC       HEC 104  -2.981   6.435  -1.400
  855    HHD  HEC 104           HD       HEC 104   2.955   8.977  -1.236
  856   1HMA  HEC 104          HMA1      HEC 104   1.328  -0.823   1.800
  857   2HMA  HEC 104          HMA2      HEC 104   2.851  -1.167   0.978
  858   3HMA  HEC 104          HMA3      HEC 104   1.369  -0.970   0.043
  859   1HAA  HEC 104          HAA1      HEC 104   4.381  -0.189   1.933
  860   2HAA  HEC 104          HAA2      HEC 104   5.059   1.370   2.365
  861   1HBA  HEC 104          HBA1      HEC 104   5.939   1.595   0.053
  862   2HBA  HEC 104          HBA2      HEC 104   5.320  -0.007  -0.314
  863   1HMB  HEC 104          HMB1      HEC 104  -2.329   0.343  -0.631
  864   2HMB  HEC 104          HMB2      HEC 104  -3.241   0.984  -1.998
  865   3HMB  HEC 104          HMB3      HEC 104  -3.915   1.070  -0.371
  866    HAB  HEC 104           HAB      HEC 104  -4.385   5.108  -1.499
  867   1HBB  HEC 104          HBB1      HEC 104  -4.732   3.815   0.747
  868   2HBB  HEC 104          HBB2      HEC 104  -5.721   2.775  -0.277
  869   3HBB  HEC 104          HBB3      HEC 104  -6.076   4.500  -0.166
  870   1HMC  HEC 104          HMC1      HEC 104  -3.037   9.006  -1.481
  871   2HMC  HEC 104          HMC2      HEC 104  -2.687   8.330  -3.072
  872   3HMC  HEC 104          HMC3      HEC 104  -2.082   9.929  -2.641
  873    HAC  HEC 104           HAC      HEC 104   1.765  10.066  -2.487
  874   1HBC  HEC 104          HBC1      HEC 104   0.960  11.402  -0.778
  875   2HBC  HEC 104          HBC2      HEC 104  -0.696  11.350  -1.382
  876   3HBC  HEC 104          HBC3      HEC 104   0.540  12.240  -2.272
  877   1HMD  HEC 104          HMD1      HEC 104   5.082   9.348  -0.298
  878   2HMD  HEC 104          HMD2      HEC 104   5.543   8.406  -1.716
  879   3HMD  HEC 104          HMD3      HEC 104   6.554   8.377  -0.271
  880   1HAD  HEC 104          HAD1      HEC 104   7.355   6.481   0.454
  881   2HAD  HEC 104          HAD2      HEC 104   6.898   4.917   1.118
  882   1HBD  HEC 104          HBD1      HEC 104   6.366   5.800   3.193
  883   2HBD  HEC 104          HBD2      HEC 104   6.049   7.397   2.550
  884    H2   4NL 105           H2       4NL 105  -0.166 -12.989  -1.147
  885    H6   4NL 105           H6       4NL 105   2.931 -13.390   2.626
  886    H3   4NL 105           H3       4NL 105  -1.616 -10.501   2.105
  887    H5   4NL 105           H5       4NL 105  -2.433 -10.409   0.010
  888    H4   4NL 105           H4       4NL 105   0.125 -11.476   3.627
  889    H1   4NL 105           H1       4NL 105   1.574 -13.963   0.373
  890    H7   4NL 105           H7       4NL 105   1.704 -13.645   3.890
  Start of MODEL    3
    1   1H    THR  -5          HT1       THR  -5 -10.894  -6.296  13.182
    2   2H    THR  -5          HT2       THR  -5 -11.438  -5.224  11.989
    3   3H    THR  -5          HT3       THR  -5  -9.840  -5.133  12.538
    4    HA   THR  -5           HA       THR  -5  -9.983  -6.196  10.365
    5    HB   THR  -5           HB       THR  -5  -9.235  -8.236  12.485
    6    HG1  THR  -5           HG1      THR  -5  -7.088  -7.009  11.907
    7   1HG2  THR  -5          HG21      THR  -5  -9.092  -8.991  10.153
    8   2HG2  THR  -5          HG22      THR  -5  -7.484  -8.813  10.855
    9   3HG2  THR  -5          HG23      THR  -5  -8.107  -7.583   9.754
   10    H    GLU  -4           HN       GLU  -4 -12.383  -6.300  10.028
   11    HA   GLU  -4           HA       GLU  -4 -13.524  -8.958  10.568
   12   1HB   GLU  -4          HB1       GLU  -4 -14.785  -6.864  11.365
   13   2HB   GLU  -4          HB2       GLU  -4 -15.045  -6.489   9.665
   14   1HG   GLU  -4          HG1       GLU  -4 -15.850  -9.142   9.915
   15   2HG   GLU  -4          HG2       GLU  -4 -16.438  -8.368  11.381
   16    H    PHE  -3           HN       PHE  -3 -11.634  -9.030   8.754
   17    HA   PHE  -3           HA       PHE  -3 -12.059  -8.228   6.158
   18   1HB   PHE  -3          HB1       PHE  -3  -9.913  -9.092   6.915
   19   2HB   PHE  -3          HB2       PHE  -3 -10.592 -10.709   7.056
   20    HD1  PHE  -3           HD1      PHE  -3  -9.951  -7.990   4.547
   21    HD2  PHE  -3           HD2      PHE  -3 -10.446 -12.203   5.254
   22    HE1  PHE  -3           HE1      PHE  -3  -9.436  -8.450   2.157
   23    HE2  PHE  -3           HE2      PHE  -3  -9.981 -12.661   2.854
   24    HZ   PHE  -3           HZ       PHE  -3  -9.507 -10.780   1.295
   25    H    LYS  -2           HN       LYS  -2 -12.852  -9.096   4.338
   26    HA   LYS  -2           HA       LYS  -2 -14.385 -11.525   4.215
   27   1HB   LYS  -2          HB1       LYS  -2 -15.741  -9.270   5.069
   28   2HB   LYS  -2          HB2       LYS  -2 -16.026  -9.249   3.328
   29   1HG   LYS  -2          HG1       LYS  -2 -17.349 -11.077   3.383
   30   2HG   LYS  -2          HG2       LYS  -2 -16.346 -11.891   4.581
   31   1HD   LYS  -2          HD1       LYS  -2 -18.045  -9.563   5.408
   32   2HD   LYS  -2          HD2       LYS  -2 -18.792 -11.144   5.180
   33   1HE   LYS  -2          HE1       LYS  -2 -18.278 -11.081   7.466
   34   2HE   LYS  -2          HE2       LYS  -2 -16.973 -12.029   6.762
   35   1HZ   LYS  -2          HZ1       LYS  -2 -16.877  -9.201   7.661
   36   2HZ   LYS  -2          HZ2       LYS  -2 -15.654  -9.913   6.739
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.006 -10.524   8.272
   38    H    ALA  -1           HN       ALA  -1 -13.931 -12.343   2.327
   39    HA   ALA  -1           HA       ALA  -1 -12.185 -11.387   0.481
   40   1HB   ALA  -1          HB1       ALA  -1 -12.880 -13.726   0.707
   41   2HB   ALA  -1          HB2       ALA  -1 -12.961 -13.186  -0.971
   42   3HB   ALA  -1          HB3       ALA  -1 -14.439 -13.333  -0.020
   43    H    GLY   1           HN       GLY   1 -12.244 -10.343  -1.463
   44   1HA   GLY   1          HA1       GLY   1 -14.703  -8.889  -2.208
   45   2HA   GLY   1          HA2       GLY   1 -13.077  -8.250  -2.395
   46    H    SER   2           HN       SER   2 -13.088  -7.922  -4.533
   47    HA   SER   2           HA       SER   2 -12.756 -10.167  -6.318
   48   1HB   SER   2          HB1       SER   2 -14.790  -8.171  -7.231
   49   2HB   SER   2          HB2       SER   2 -14.570  -9.855  -7.721
   50    HG   SER   2           HG       SER   2 -15.175 -10.285  -5.397
   51    H    ALA   3           HN       ALA   3 -11.335  -9.659  -7.918
   52    HA   ALA   3           HA       ALA   3  -9.704  -7.489  -7.860
   53   1HB   ALA   3          HB1       ALA   3  -9.125  -9.470  -9.056
   54   2HB   ALA   3          HB2       ALA   3  -9.058  -8.111 -10.178
   55   3HB   ALA   3          HB3       ALA   3 -10.429  -9.216 -10.216
   56    H    LYS   4           HN       LYS   4 -12.775  -7.588  -9.721
   57    HA   LYS   4           HA       LYS   4 -12.268  -5.015 -10.880
   58   1HB   LYS   4          HB1       LYS   4 -13.525  -7.002 -11.938
   59   2HB   LYS   4          HB2       LYS   4 -14.925  -6.343 -11.092
   60   1HG   LYS   4          HG1       LYS   4 -13.931  -4.083 -12.204
   61   2HG   LYS   4          HG2       LYS   4 -13.435  -5.266 -13.408
   62   1HD   LYS   4          HD1       LYS   4 -15.557  -4.422 -14.095
   63   2HD   LYS   4          HD2       LYS   4 -15.844  -6.047 -13.461
   64   1HE   LYS   4          HE1       LYS   4 -17.532  -4.421 -12.654
   65   2HE   LYS   4          HE2       LYS   4 -16.593  -5.118 -11.332
   66   1HZ   LYS   4          HZ1       LYS   4 -15.881  -2.534 -12.576
   67   2HZ   LYS   4          HZ2       LYS   4 -15.365  -3.160 -11.093
   68   3HZ   LYS   4          HZ3       LYS   4 -16.964  -2.642 -11.277
   69    H    LYS   5           HN       LYS   5 -13.061  -5.578  -7.825
   70    HA   LYS   5           HA       LYS   5 -14.818  -3.212  -7.617
   71   1HB   LYS   5          HB1       LYS   5 -14.504  -5.524  -5.690
   72   2HB   LYS   5          HB2       LYS   5 -15.377  -4.045  -5.309
   73   1HG   LYS   5          HG1       LYS   5 -16.685  -4.635  -7.533
   74   2HG   LYS   5          HG2       LYS   5 -16.126  -6.266  -7.154
   75   1HD   LYS   5          HD1       LYS   5 -17.200  -4.914  -4.809
   76   2HD   LYS   5          HD2       LYS   5 -18.384  -5.001  -6.113
   77   1HE   LYS   5          HE1       LYS   5 -18.670  -6.963  -4.784
   78   2HE   LYS   5          HE2       LYS   5 -17.874  -7.468  -6.274
   79   1HZ   LYS   5          HZ1       LYS   5 -17.022  -8.067  -3.787
   80   2HZ   LYS   5          HZ2       LYS   5 -16.059  -6.722  -4.165
   81   3HZ   LYS   5          HZ3       LYS   5 -16.049  -8.082  -5.176
   82    H    GLY   6           HN       GLY   6 -12.198  -4.890  -5.835
   83   1HA   GLY   6          HA1       GLY   6 -11.456  -2.740  -4.200
   84   2HA   GLY   6          HA2       GLY   6 -10.399  -4.062  -4.666
   85    H    ALA   7           HN       ALA   7 -10.455  -3.488  -7.523
   86    HA   ALA   7           HA       ALA   7  -8.345  -1.697  -7.787
   87   1HB   ALA   7          HB1       ALA   7  -8.798  -3.439  -9.425
   88   2HB   ALA   7          HB2       ALA   7  -8.723  -1.858 -10.204
   89   3HB   ALA   7          HB3       ALA   7 -10.284  -2.619  -9.908
   90    H    THR   8           HN       THR   8 -11.848  -1.056  -8.527
   91    HA   THR   8           HA       THR   8 -11.554   1.529  -9.462
   92    HB   THR   8           HB       THR   8 -13.885   1.774  -8.046
   93    HG1  THR   8           HG1      THR   8 -13.582  -0.474  -7.406
   94   1HG2  THR   8          HG21      THR   8 -13.597   2.207 -10.439
   95   2HG2  THR   8          HG22      THR   8 -14.999   1.177 -10.143
   96   3HG2  THR   8          HG23      THR   8 -13.499   0.472 -10.746
   97    H    LEU   9           HN       LEU   9 -11.549   0.533  -6.076
   98    HA   LEU   9           HA       LEU   9 -11.631   3.151  -4.959
   99   1HB   LEU   9          HB1       LEU   9 -10.665   0.571  -3.685
  100   2HB   LEU   9          HB2       LEU   9 -11.126   2.047  -2.839
  101    HG   LEU   9           HG       LEU   9 -13.003   0.381  -4.535
  102   1HD1  LEU   9          HD11      LEU   9 -13.987  -0.353  -2.471
  103   2HD1  LEU   9          HD12      LEU   9 -12.926   0.696  -1.533
  104   3HD1  LEU   9          HD13      LEU   9 -12.258  -0.691  -2.392
  105   1HD2  LEU   9          HD21      LEU   9 -14.772   1.762  -3.601
  106   2HD2  LEU   9          HD22      LEU   9 -13.600   2.793  -4.421
  107   3HD2  LEU   9          HD23      LEU   9 -13.596   2.684  -2.661
  108    H    PHE  10           HN       PHE  10  -9.006   0.770  -5.364
  109    HA   PHE  10           HA       PHE  10  -6.872   2.368  -4.490
  110   1HB   PHE  10          HB1       PHE  10  -6.820  -0.088  -4.676
  111   2HB   PHE  10          HB2       PHE  10  -6.864   0.045  -6.427
  112    HD1  PHE  10           HD1      PHE  10  -4.885   1.312  -7.569
  113    HD2  PHE  10           HD2      PHE  10  -4.796  -0.216  -3.550
  114    HE1  PHE  10           HE1      PHE  10  -2.393   1.317  -7.617
  115    HE2  PHE  10           HE2      PHE  10  -2.315  -0.089  -3.556
  116    HZ   PHE  10           HZ       PHE  10  -1.107   0.652  -5.594
  117    H    LYS  11           HN       LYS  11  -8.303   1.983  -7.704
  118    HA   LYS  11           HA       LYS  11  -6.295   3.393  -9.129
  119   1HB   LYS  11          HB1       LYS  11  -8.406   1.754  -9.803
  120   2HB   LYS  11          HB2       LYS  11  -8.892   3.321 -10.447
  121   1HG   LYS  11          HG1       LYS  11  -7.627   2.759 -12.220
  122   2HG   LYS  11          HG2       LYS  11  -6.276   3.241 -11.198
  123   1HD   LYS  11          HD1       LYS  11  -6.156   0.831 -10.425
  124   2HD   LYS  11          HD2       LYS  11  -7.309   0.449 -11.705
  125   1HE   LYS  11          HE1       LYS  11  -5.694   1.446 -13.350
  126   2HE   LYS  11          HE2       LYS  11  -4.533   1.608 -12.036
  127   1HZ   LYS  11          HZ1       LYS  11  -5.099  -0.959 -11.806
  128   2HZ   LYS  11          HZ2       LYS  11  -3.883  -0.390 -12.834
  129   3HZ   LYS  11          HZ3       LYS  11  -5.403  -0.778 -13.464
  130    H    THR  12           HN       THR  12  -8.214   4.751  -6.922
  131    HA   THR  12           HA       THR  12  -8.116   7.388  -8.160
  132    HB   THR  12           HB       THR  12 -10.481   5.979  -7.742
  133    HG1  THR  12           HG1      THR  12  -9.976   7.527  -9.350
  134   1HG2  THR  12          HG21      THR  12 -10.500   6.811  -5.391
  135   2HG2  THR  12          HG22      THR  12 -11.862   7.357  -6.371
  136   3HG2  THR  12          HG23      THR  12 -10.525   8.456  -6.029
  137    H    ARG  13           HN       ARG  13  -8.364   5.584  -5.172
  138    HA   ARG  13           HA       ARG  13  -7.666   7.797  -3.438
  139   1HB   ARG  13          HB1       ARG  13  -8.401   4.919  -2.995
  140   2HB   ARG  13          HB2       ARG  13  -7.722   5.874  -1.694
  141   1HG   ARG  13          HG1       ARG  13 -10.160   6.800  -3.161
  142   2HG   ARG  13          HG2       ARG  13 -10.277   5.600  -1.882
  143   1HD   ARG  13          HD1       ARG  13 -10.703   8.000  -1.201
  144   2HD   ARG  13          HD2       ARG  13  -9.489   7.139  -0.247
  145    HE   ARG  13           HE       ARG  13  -8.736   8.424  -2.568
  146   1HH1  ARG  13          HH11      ARG  13  -9.130   8.846   0.877
  147   2HH1  ARG  13          HH12      ARG  13  -7.755   9.838   1.202
  148   1HH2  ARG  13          HH21      ARG  13  -6.617   9.909  -2.025
  149   2HH2  ARG  13          HH22      ARG  13  -6.389  10.437  -0.394
  150    H    CYS  14           HN       CYS  14  -5.987   5.342  -5.096
  151    HA   CYS  14           HA       CYS  14  -3.534   5.850  -3.546
  152   1HB   CYS  14          HB1       CYS  14  -4.035   3.229  -4.894
  153   2HB   CYS  14          HB2       CYS  14  -2.920   3.602  -3.598
  154    H    LEU  15           HN       LEU  15  -4.936   5.189  -6.734
  155    HA   LEU  15           HA       LEU  15  -2.676   4.979  -8.294
  156   1HB   LEU  15          HB1       LEU  15  -5.132   4.677  -8.915
  157   2HB   LEU  15          HB2       LEU  15  -5.174   6.417  -9.169
  158    HG   LEU  15           HG       LEU  15  -3.289   6.159 -10.819
  159   1HD1  LEU  15          HD11      LEU  15  -3.880   3.227 -10.435
  160   2HD1  LEU  15          HD12      LEU  15  -2.348   4.051 -10.142
  161   3HD1  LEU  15          HD13      LEU  15  -2.963   3.891 -11.789
  162   1HD2  LEU  15          HD21      LEU  15  -5.965   4.885 -11.266
  163   2HD2  LEU  15          HD22      LEU  15  -4.763   4.930 -12.557
  164   3HD2  LEU  15          HD23      LEU  15  -5.359   6.433 -11.853
  165    H    GLN  16           HN       GLN  16  -4.222   7.970  -7.185
  166    HA   GLN  16           HA       GLN  16  -3.110   9.955  -8.590
  167   1HB   GLN  16          HB1       GLN  16  -3.040  11.200  -6.290
  168   2HB   GLN  16          HB2       GLN  16  -4.567  10.679  -6.986
  169   1HG   GLN  16          HG1       GLN  16  -4.501   8.660  -5.537
  170   2HG   GLN  16          HG2       GLN  16  -3.028   9.283  -4.791
  171   1HE2  GLN  16          HE21      GLN  16  -4.069  12.092  -4.985
  172   2HE2  GLN  16          HE22      GLN  16  -5.231  12.210  -3.718
  173    H    CYS  17           HN       CYS  17  -1.278   8.108  -6.172
  174    HA   CYS  17           HA       CYS  17   1.166   9.510  -7.016
  175   1HB   CYS  17          HB1       CYS  17   1.184   8.176  -4.382
  176   2HB   CYS  17          HB2       CYS  17   1.903   9.686  -4.913
  177    H    HIS  18           HN       HIS  18  -0.211   6.353  -6.244
  178    HA   HIS  18           HA       HIS  18   2.328   4.962  -6.562
  179   1HB   HIS  18          HB1       HIS  18  -0.388   4.240  -5.540
  180   2HB   HIS  18          HB2       HIS  18   0.749   2.976  -5.971
  181    HD1  HIS  18           HD1      HIS  18   3.224   3.296  -4.574
  182    HD2  HIS  18           HD2      HIS  18  -0.302   4.971  -3.061
  183    HE1  HIS  18           HE1      HIS  18   3.604   3.607  -2.086
  184    H    THR  19           HN       THR  19   1.754   2.622  -7.440
  185    HA   THR  19           HA       THR  19   0.173   2.500  -9.846
  186    HB   THR  19           HB       THR  19   2.462   1.474 -10.865
  187    HG1  THR  19           HG1      THR  19   4.112   2.961 -10.427
  188   1HG2  THR  19          HG21      THR  19   1.644   4.375 -11.041
  189   2HG2  THR  19          HG22      THR  19   0.974   3.062 -12.009
  190   3HG2  THR  19          HG23      THR  19   2.669   3.510 -12.187
  191    H    VAL  20           HN       VAL  20  -0.858   0.569  -9.759
  192    HA   VAL  20           HA       VAL  20  -0.136  -1.459  -7.876
  193    HB   VAL  20           HB       VAL  20  -2.441  -0.584  -8.866
  194   1HG1  VAL  20          HG11      VAL  20  -2.260  -1.575 -11.044
  195   2HG1  VAL  20          HG12      VAL  20  -3.567  -2.343 -10.142
  196   3HG1  VAL  20          HG13      VAL  20  -2.024  -3.174 -10.337
  197   1HG2  VAL  20          HG21      VAL  20  -1.941  -3.263  -7.598
  198   2HG2  VAL  20          HG22      VAL  20  -3.545  -2.572  -7.831
  199   3HG2  VAL  20          HG23      VAL  20  -2.371  -1.746  -6.809
  200    H    GLU  21           HN       GLU  21   0.327  -1.142 -11.281
  201    HA   GLU  21           HA       GLU  21   1.197  -3.915 -11.637
  202   1HB   GLU  21          HB1       GLU  21   1.187  -1.932 -13.881
  203   2HB   GLU  21          HB2       GLU  21   0.822  -3.646 -13.917
  204   1HG   GLU  21          HG1       GLU  21  -1.220  -2.609 -14.400
  205   2HG   GLU  21          HG2       GLU  21  -1.353  -3.039 -12.697
  206    H    LYS  22           HN       LYS  22   3.412  -4.237 -12.732
  207    HA   LYS  22           HA       LYS  22   5.284  -2.322 -11.682
  208   1HB   LYS  22          HB1       LYS  22   5.347  -5.081 -12.224
  209   2HB   LYS  22          HB2       LYS  22   6.634  -4.332 -13.187
  210   1HG   LYS  22          HG1       LYS  22   7.657  -3.365 -11.320
  211   2HG   LYS  22          HG2       LYS  22   6.208  -3.523 -10.327
  212   1HD   LYS  22          HD1       LYS  22   6.515  -5.871 -10.112
  213   2HD   LYS  22          HD2       LYS  22   7.784  -5.879 -11.337
  214   1HE   LYS  22          HE1       LYS  22   8.804  -6.071  -9.156
  215   2HE   LYS  22          HE2       LYS  22   9.206  -4.507  -9.840
  216   1HZ   LYS  22          HZ1       LYS  22   7.297  -3.633  -8.396
  217   2HZ   LYS  22          HZ2       LYS  22   8.720  -4.084  -7.606
  218   3HZ   LYS  22          HZ3       LYS  22   7.383  -5.114  -7.581
  219    H    GLY  23           HN       GLY  23   3.778  -2.437 -14.707
  220   1HA   GLY  23          HA1       GLY  23   5.991  -1.454 -16.278
  221   2HA   GLY  23          HA2       GLY  23   4.307  -1.509 -16.771
  222    H    GLY  24           HN       GLY  24   3.942   0.031 -14.017
  223   1HA   GLY  24          HA1       GLY  24   3.861   2.676 -15.174
  224   2HA   GLY  24          HA2       GLY  24   3.219   2.181 -13.616
  225    HA   PRO  25           HA       PRO  25   7.850   3.829 -13.426
  226   1HB   PRO  25          HB1       PRO  25   7.496   6.550 -13.727
  227   2HB   PRO  25          HB2       PRO  25   8.106   5.472 -14.986
  228   1HG   PRO  25          HG1       PRO  25   5.346   6.548 -14.581
  229   2HG   PRO  25          HG2       PRO  25   6.252   6.320 -16.089
  230   1HD   PRO  25          HD1       PRO  25   4.324   4.610 -15.326
  231   2HD   PRO  25          HD2       PRO  25   5.781   4.053 -16.175
  232    H    HIS  26           HN       HIS  26   8.567   4.626 -11.448
  233    HA   HIS  26           HA       HIS  26   6.764   4.705  -9.296
  234   1HB   HIS  26          HB1       HIS  26   9.644   5.585  -9.577
  235   2HB   HIS  26          HB2       HIS  26   8.796   5.553  -8.040
  236    HD2  HIS  26           HD2      HIS  26  10.611   3.309 -10.527
  237    HE1  HIS  26           HE1      HIS  26   9.470   0.809  -7.290
  238    HE2  HIS  26           HE2      HIS  26  10.873   0.969  -9.400
  239    H    LYS  27           HN       LYS  27   5.292   6.326  -9.026
  240    HA   LYS  27           HA       LYS  27   5.905   9.054  -9.836
  241   1HB   LYS  27          HB1       LYS  27   3.793   7.749 -10.480
  242   2HB   LYS  27          HB2       LYS  27   3.243   8.060  -8.838
  243   1HG   LYS  27          HG1       LYS  27   3.709  10.543  -9.355
  244   2HG   LYS  27          HG2       LYS  27   3.757  10.036 -11.047
  245   1HD   LYS  27          HD1       LYS  27   1.441   9.800  -9.111
  246   2HD   LYS  27          HD2       LYS  27   1.508  10.739 -10.608
  247   1HE   LYS  27          HE1       LYS  27   0.474   8.937 -11.514
  248   2HE   LYS  27          HE2       LYS  27   2.097   8.246 -11.533
  249   1HZ   LYS  27          HZ1       LYS  27   0.636   6.678 -10.538
  250   2HZ   LYS  27          HZ2       LYS  27  -0.003   7.831  -9.482
  251   3HZ   LYS  27          HZ3       LYS  27   1.598   7.318  -9.297
  252    H    VAL  28           HN       VAL  28   3.874   9.991  -7.717
  253    HA   VAL  28           HA       VAL  28   5.647  10.959  -5.789
  254    HB   VAL  28           HB       VAL  28   2.679  10.585  -5.390
  255   1HG1  VAL  28          HG11      VAL  28   3.950  11.288  -3.397
  256   2HG1  VAL  28          HG12      VAL  28   2.855  12.551  -3.960
  257   3HG1  VAL  28          HG13      VAL  28   4.582  12.667  -4.298
  258   1HG2  VAL  28          HG21      VAL  28   2.399  12.872  -6.293
  259   2HG2  VAL  28          HG22      VAL  28   2.970  11.739  -7.516
  260   3HG2  VAL  28          HG23      VAL  28   4.096  12.875  -6.775
  261    H    GLY  29           HN       GLY  29   4.025   7.935  -6.047
  262   1HA   GLY  29          HA1       GLY  29   5.052   7.015  -3.439
  263   2HA   GLY  29          HA2       GLY  29   3.507   6.491  -4.086
  264    HA   PRO  30           HA       PRO  30   7.281   3.880  -5.643
  265   1HB   PRO  30          HB1       PRO  30   7.356   1.903  -3.796
  266   2HB   PRO  30          HB2       PRO  30   8.296   3.392  -3.649
  267   1HG   PRO  30          HG1       PRO  30   5.679   2.674  -2.375
  268   2HG   PRO  30          HG2       PRO  30   7.107   3.429  -1.642
  269   1HD   PRO  30          HD1       PRO  30   4.960   4.868  -2.406
  270   2HD   PRO  30          HD2       PRO  30   6.613   5.509  -2.516
  271    H    ASN  31           HN       ASN  31   7.159   1.732  -6.566
  272    HA   ASN  31           HA       ASN  31   4.551   0.979  -7.397
  273   1HB   ASN  31          HB1       ASN  31   6.345   0.711  -8.937
  274   2HB   ASN  31          HB2       ASN  31   7.321  -0.178  -7.776
  275   1HD2  ASN  31          HD21      ASN  31   4.596  -0.422  -9.991
  276   2HD2  ASN  31          HD22      ASN  31   4.598  -2.154 -10.038
  277    H    LEU  32           HN       LEU  32   3.140  -0.348  -6.399
  278    HA   LEU  32           HA       LEU  32   3.784  -1.712  -3.925
  279   1HB   LEU  32          HB1       LEU  32   1.147  -1.112  -5.272
  280   2HB   LEU  32          HB2       LEU  32   1.325  -1.832  -3.684
  281    HG   LEU  32           HG       LEU  32   2.122   0.979  -4.484
  282   1HD1  LEU  32          HD11      LEU  32   0.012  -0.074  -2.590
  283   2HD1  LEU  32          HD12      LEU  32  -0.276   0.692  -4.153
  284   3HD1  LEU  32          HD13      LEU  32   0.416   1.628  -2.828
  285   1HD2  LEU  32          HD21      LEU  32   3.739   0.180  -2.860
  286   2HD2  LEU  32          HD22      LEU  32   2.445  -0.425  -1.825
  287   3HD2  LEU  32          HD23      LEU  32   2.631   1.310  -2.080
  288    H    HIS  33           HN       HIS  33   3.697  -2.665  -7.107
  289    HA   HIS  33           HA       HIS  33   2.405  -5.180  -7.072
  290   1HB   HIS  33          HB1       HIS  33   2.854  -3.696  -9.070
  291   2HB   HIS  33          HB2       HIS  33   4.539  -4.197  -8.974
  292    HD2  HIS  33           HD2      HIS  33   1.730  -6.757  -8.370
  293    HE1  HIS  33           HE1      HIS  33   3.378  -7.620 -12.191
  294    HE2  HIS  33           HE2      HIS  33   1.820  -8.451 -10.362
  295    H    GLY  34           HN       GLY  34   3.172  -6.519  -5.492
  296   1HA   GLY  34          HA1       GLY  34   4.542  -8.456  -5.138
  297   2HA   GLY  34          HA2       GLY  34   5.910  -7.561  -5.766
  298    H    ILE  35           HN       ILE  35   3.747  -6.128  -3.306
  299    HA   ILE  35           HA       ILE  35   6.043  -5.994  -1.548
  300    HB   ILE  35           HB       ILE  35   4.660  -4.690  -0.004
  301   1HG1  ILE  35          HG11      ILE  35   2.474  -5.262  -1.950
  302   2HG1  ILE  35          HG12      ILE  35   2.397  -5.004  -0.209
  303   1HG2  ILE  35          HG21      ILE  35   4.881  -3.685  -2.833
  304   2HG2  ILE  35          HG22      ILE  35   6.147  -3.689  -1.607
  305   3HG2  ILE  35          HG23      ILE  35   4.718  -2.678  -1.395
  306   1HD1  ILE  35          HD11      ILE  35   2.655  -2.594  -0.536
  307   2HD1  ILE  35          HD12      ILE  35   1.272  -3.206  -1.445
  308   3HD1  ILE  35          HD13      ILE  35   2.779  -2.835  -2.280
  309    H    PHE  36           HN       PHE  36   2.954  -7.749  -1.497
  310    HA   PHE  36           HA       PHE  36   2.983  -8.661   1.112
  311   1HB   PHE  36          HB1       PHE  36   1.869  -9.913  -1.394
  312   2HB   PHE  36          HB2       PHE  36   1.631 -10.612   0.207
  313    HD1  PHE  36           HD1      PHE  36   0.967  -8.630   2.015
  314    HD2  PHE  36           HD2      PHE  36   0.032  -8.731  -2.183
  315    HE1  PHE  36           HE1      PHE  36  -0.934  -7.075   2.409
  316    HE2  PHE  36           HE2      PHE  36  -1.871  -7.177  -1.792
  317    HZ   PHE  36           HZ       PHE  36  -2.349  -6.339   0.500
  318    H    GLY  37           HN       GLY  37   4.449  -9.662   2.171
  319   1HA   GLY  37          HA1       GLY  37   5.603 -11.681   2.738
  320   2HA   GLY  37          HA2       GLY  37   5.988 -11.899   1.041
  321    H    ARG  38           HN       ARG  38   6.558  -8.720   1.410
  322    HA   ARG  38           HA       ARG  38   9.395  -9.068   2.140
  323   1HB   ARG  38          HB1       ARG  38   8.002  -7.298   0.127
  324   2HB   ARG  38          HB2       ARG  38   9.606  -6.896   0.722
  325   1HG   ARG  38          HG1       ARG  38  10.608  -8.641  -0.383
  326   2HG   ARG  38          HG2       ARG  38   9.149  -9.634  -0.363
  327   1HD   ARG  38          HD1       ARG  38   9.228  -9.029  -2.594
  328   2HD   ARG  38          HD2       ARG  38   8.214  -7.742  -1.940
  329    HE   ARG  38           HE       ARG  38  10.502  -7.365  -1.517
  330   1HH1  ARG  38          HH21      ARG  38   8.573  -7.461  -4.371
  331   2HH1  ARG  38          HH22      ARG  38   9.188  -6.027  -5.016
  332   1HH2  ARG  38          HH11      ARG  38  11.821  -5.447  -3.156
  333   2HH2  ARG  38          HH12      ARG  38  11.255  -5.617  -4.762
  334    H    HIS  39           HN       HIS  39  10.373  -6.957   2.924
  335    HA   HIS  39           HA       HIS  39   8.761  -5.970   5.131
  336   1HB   HIS  39          HB1       HIS  39  11.636  -5.249   4.526
  337   2HB   HIS  39          HB2       HIS  39  10.811  -5.224   6.087
  338    HD2  HIS  39           HD2      HIS  39  10.416  -7.578   7.342
  339    HE1  HIS  39           HE1      HIS  39  12.761  -9.980   4.728
  340    HE2  HIS  39           HE2      HIS  39  11.466  -9.936   6.912
  341    H    SER  40           HN       SER  40   8.802  -3.582   5.626
  342    HA   SER  40           HA       SER  40   7.922  -2.037   3.460
  343   1HB   SER  40          HB1       SER  40   8.984  -0.641   5.877
  344   2HB   SER  40          HB2       SER  40   7.555  -0.285   4.917
  345    HG   SER  40           HG       SER  40   6.768  -2.378   5.851
  346    H    GLY  41           HN       GLY  41   8.844  -0.517   2.190
  347   1HA   GLY  41          HA1       GLY  41  10.497   0.873   1.336
  348   2HA   GLY  41          HA2       GLY  41  11.571   0.364   2.616
  349    H    GLN  42           HN       GLN  42  10.047  -1.522  -0.114
  350    HA   GLN  42           HA       GLN  42  12.784  -2.197  -0.924
  351   1HB   GLN  42          HB1       GLN  42  10.501  -4.155  -0.863
  352   2HB   GLN  42          HB2       GLN  42  12.141  -4.495  -1.403
  353   1HG   GLN  42          HG1       GLN  42  12.803  -3.630   0.982
  354   2HG   GLN  42          HG2       GLN  42  11.126  -4.003   1.369
  355   1HE2  GLN  42          HE21      GLN  42  13.503  -5.304   2.442
  356   2HE2  GLN  42          HE22      GLN  42  13.400  -6.964   1.982
  357    H    ALA  43           HN       ALA  43  10.477  -0.410  -2.257
  358    HA   ALA  43           HA       ALA  43   9.945  -1.455  -4.778
  359   1HB   ALA  43          HB1       ALA  43   9.401   0.795  -5.438
  360   2HB   ALA  43          HB2       ALA  43  10.325   1.450  -4.087
  361   3HB   ALA  43          HB3       ALA  43   8.863   0.514  -3.783
  362    H    GLU  44           HN       GLU  44  11.089  -1.881  -6.534
  363    HA   GLU  44           HA       GLU  44  13.872  -1.365  -6.733
  364   1HB   GLU  44          HB1       GLU  44  12.205  -2.583  -8.939
  365   2HB   GLU  44          HB2       GLU  44  13.900  -2.871  -8.555
  366   1HG   GLU  44          HG1       GLU  44  12.958  -4.781  -7.694
  367   2HG   GLU  44          HG2       GLU  44  12.953  -3.753  -6.275
  368    H    GLY  45           HN       GLY  45  13.778   0.978  -6.659
  369   1HA   GLY  45          HA1       GLY  45  14.755   2.536  -8.400
  370   2HA   GLY  45          HA2       GLY  45  13.239   2.304  -9.241
  371    H    TYR  46           HN       TYR  46  13.098   2.589  -5.777
  372    HA   TYR  46           HA       TYR  46  12.578   5.439  -5.800
  373   1HB   TYR  46          HB1       TYR  46  10.452   4.458  -6.407
  374   2HB   TYR  46          HB2       TYR  46  10.489   3.430  -4.982
  375    HD1  TYR  46           HD1      TYR  46   9.743   6.753  -6.295
  376    HD2  TYR  46           HD2      TYR  46  10.277   4.436  -2.717
  377    HE1  TYR  46           HE1      TYR  46   8.465   8.464  -5.012
  378    HE2  TYR  46           HE2      TYR  46   8.907   6.078  -1.438
  379    HH   TYR  46           HH       TYR  46   7.142   8.643  -3.044
  380    H    SER  47           HN       SER  47  12.937   6.499  -3.911
  381    HA   SER  47           HA       SER  47  14.218   5.042  -1.741
  382   1HB   SER  47          HB1       SER  47  14.183   7.908  -1.376
  383   2HB   SER  47          HB2       SER  47  15.559   6.820  -1.573
  384    HG   SER  47           HG       SER  47  15.514   7.116  -3.722
  385    H    TYR  48           HN       TYR  48  13.575   4.986   0.292
  386    HA   TYR  48           HA       TYR  48  10.973   5.994   1.162
  387   1HB   TYR  48          HB1       TYR  48  12.671   3.630   1.964
  388   2HB   TYR  48          HB2       TYR  48  11.203   4.094   2.817
  389    HD1  TYR  48           HD1      TYR  48   9.023   3.791   1.847
  390    HD2  TYR  48           HD2      TYR  48  12.562   2.721  -0.348
  391    HE1  TYR  48           HE1      TYR  48   7.644   2.396   0.319
  392    HE2  TYR  48           HE2      TYR  48  11.194   1.324  -1.882
  393    HH   TYR  48           HH       TYR  48   8.204   0.203  -1.082
  394    H    THR  49           HN       THR  49  10.782   6.681   3.504
  395    HA   THR  49           HA       THR  49  12.787   8.543   4.315
  396    HB   THR  49           HB       THR  49  11.321   8.591   6.471
  397    HG1  THR  49           HG1      THR  49   9.257   7.739   4.841
  398   1HG2  THR  49          HG21      THR  49   9.795  10.149   5.438
  399   2HG2  THR  49          HG22      THR  49  10.192   9.515   3.841
  400   3HG2  THR  49          HG23      THR  49  11.420  10.360   4.785
  401    H    ASP  50           HN       ASP  50  13.705   8.689   6.494
  402    HA   ASP  50           HA       ASP  50  15.326   6.591   7.245
  403   1HB   ASP  50          HB1       ASP  50  15.757   8.916   7.803
  404   2HB   ASP  50          HB2       ASP  50  14.342   8.959   8.852
  405    H    ALA  51           HN       ALA  51  12.083   7.340   8.398
  406    HA   ALA  51           HA       ALA  51  12.117   5.421  10.538
  407   1HB   ALA  51          HB1       ALA  51   9.917   6.272  11.048
  408   2HB   ALA  51          HB2       ALA  51   9.843   7.107   9.497
  409   3HB   ALA  51          HB3       ALA  51  11.007   7.619  10.717
  410    H    ASN  52           HN       ASN  52  10.762   5.458   7.220
  411    HA   ASN  52           HA       ASN  52   9.081   3.187   7.637
  412   1HB   ASN  52          HB1       ASN  52   8.309   4.497   5.912
  413   2HB   ASN  52          HB2       ASN  52   9.922   4.843   5.301
  414   1HD2  ASN  52          HD21      ASN  52   7.130   2.949   4.815
  415   2HD2  ASN  52          HD22      ASN  52   7.808   1.997   3.545
  416    H    ILE  53           HN       ILE  53  12.382   3.569   6.424
  417    HA   ILE  53           HA       ILE  53  12.791   0.863   5.704
  418    HB   ILE  53           HB       ILE  53  14.721   3.066   6.367
  419   1HG1  ILE  53          HG11      ILE  53  13.985   1.876   3.673
  420   2HG1  ILE  53          HG12      ILE  53  13.228   3.321   4.336
  421   1HG2  ILE  53          HG21      ILE  53  15.342   0.378   5.116
  422   2HG2  ILE  53          HG22      ILE  53  15.831   0.902   6.727
  423   3HG2  ILE  53          HG23      ILE  53  16.478   1.715   5.303
  424   1HD1  ILE  53          HD11      ILE  53  15.523   4.361   4.427
  425   2HD1  ILE  53          HD12      ILE  53  14.907   4.042   2.807
  426   3HD1  ILE  53          HD13      ILE  53  16.110   2.968   3.519
  427    H    LYS  54           HN       LYS  54  14.418   2.486   8.485
  428    HA   LYS  54           HA       LYS  54  15.060   0.473  10.106
  429   1HB   LYS  54          HB1       LYS  54  13.720   3.063  10.870
  430   2HB   LYS  54          HB2       LYS  54  14.489   1.981  12.034
  431   1HG   LYS  54          HG1       LYS  54  16.623   2.189  10.874
  432   2HG   LYS  54          HG2       LYS  54  15.875   3.210   9.643
  433   1HD   LYS  54          HD1       LYS  54  15.305   4.859  11.426
  434   2HD   LYS  54          HD2       LYS  54  16.204   3.860  12.579
  435   1HE   LYS  54          HE1       LYS  54  18.258   4.234  11.470
  436   2HE   LYS  54          HE2       LYS  54  17.456   4.850  10.023
  437   1HZ   LYS  54          HZ1       LYS  54  17.556   6.186  12.667
  438   2HZ   LYS  54          HZ2       LYS  54  16.698   6.752  11.319
  439   3HZ   LYS  54          HZ3       LYS  54  18.386   6.654  11.264
  440    H    LYS  55           HN       LYS  55  11.814   1.028   9.182
  441    HA   LYS  55           HA       LYS  55  10.559  -0.204  11.481
  442   1HB   LYS  55          HB1       LYS  55   9.476   1.662  10.482
  443   2HB   LYS  55          HB2       LYS  55   9.524   0.931   8.895
  444   1HG   LYS  55          HG1       LYS  55   7.336   0.663   9.398
  445   2HG   LYS  55          HG2       LYS  55   7.969  -0.859  10.000
  446   1HD   LYS  55          HD1       LYS  55   7.379   1.568  11.705
  447   2HD   LYS  55          HD2       LYS  55   6.299   0.191  11.501
  448   1HE   LYS  55          HE1       LYS  55   9.087   0.075  12.673
  449   2HE   LYS  55          HE2       LYS  55   7.587   0.062  13.602
  450   1HZ   LYS  55          HZ1       LYS  55   8.533  -2.013  11.696
  451   2HZ   LYS  55          HZ2       LYS  55   6.979  -1.990  12.358
  452   3HZ   LYS  55          HZ3       LYS  55   8.319  -2.170  13.371
  453    H    ASN  56           HN       ASN  56  11.283  -1.180   8.193
  454    HA   ASN  56           HA       ASN  56  10.810  -2.969   6.903
  455   1HB   ASN  56          HB1       ASN  56  12.700  -3.571   9.032
  456   2HB   ASN  56          HB2       ASN  56  11.999  -5.015   8.337
  457   1HD2  ASN  56          HD21      ASN  56  12.686  -2.099   6.388
  458   2HD2  ASN  56          HD22      ASN  56  13.688  -3.110   5.441
  459    H    VAL  57           HN       VAL  57   8.381  -2.593   8.020
  460    HA   VAL  57           HA       VAL  57   7.382  -4.825   9.465
  461    HB   VAL  57           HB       VAL  57   6.338  -2.351   8.464
  462   1HG1  VAL  57          HG11      VAL  57   4.423  -4.664   8.168
  463   2HG1  VAL  57          HG12      VAL  57   4.959  -3.586   6.879
  464   3HG1  VAL  57          HG13      VAL  57   3.978  -2.957   8.203
  465   1HG2  VAL  57          HG21      VAL  57   5.485  -4.333  10.557
  466   2HG2  VAL  57          HG22      VAL  57   4.818  -2.710  10.387
  467   3HG2  VAL  57          HG23      VAL  57   6.526  -2.925  10.772
  468    H    LEU  58           HN       LEU  58   6.658  -6.776   8.784
  469    HA   LEU  58           HA       LEU  58   7.127  -7.470   6.029
  470   1HB   LEU  58          HB1       LEU  58   7.759  -8.948   7.961
  471   2HB   LEU  58          HB2       LEU  58   6.046  -9.240   8.228
  472    HG   LEU  58           HG       LEU  58   5.976 -10.032   5.765
  473   1HD1  LEU  58          HD11      LEU  58   8.942  -9.919   6.284
  474   2HD1  LEU  58          HD12      LEU  58   8.040  -9.257   4.920
  475   3HD1  LEU  58          HD13      LEU  58   8.238 -11.002   5.081
  476   1HD2  LEU  58          HD21      LEU  58   5.738 -11.708   7.448
  477   2HD2  LEU  58          HD22      LEU  58   7.440 -11.597   7.894
  478   3HD2  LEU  58          HD23      LEU  58   6.980 -12.285   6.336
  479    H    TRP  59           HN       TRP  59   5.684  -6.597   4.694
  480    HA   TRP  59           HA       TRP  59   3.002  -6.040   5.159
  481   1HB   TRP  59          HB1       TRP  59   4.470  -6.591   2.583
  482   2HB   TRP  59          HB2       TRP  59   2.834  -5.965   2.658
  483    HD1  TRP  59           HD1      TRP  59   5.958  -4.723   1.804
  484    HE1  TRP  59           HE1      TRP  59   6.277  -2.236   2.406
  485    HE3  TRP  59           HE3      TRP  59   2.071  -4.103   5.070
  486    HZ2  TRP  59           HZ2      TRP  59   5.148  -0.285   4.166
  487    HZ3  TRP  59           HZ3      TRP  59   1.702  -1.923   6.161
  488    HH2  TRP  59           HH2      TRP  59   3.209  -0.016   5.727
  489    H    ASP  60           HN       ASP  60   1.726  -7.553   5.904
  490    HA   ASP  60           HA       ASP  60   1.239 -10.069   4.488
  491   1HB   ASP  60          HB1       ASP  60   1.759 -11.009   6.454
  492   2HB   ASP  60          HB2       ASP  60   1.827  -9.447   7.248
  493    H    GLU  61           HN       GLU  61  -1.158 -10.780   5.490
  494    HA   GLU  61           HA       GLU  61  -3.005  -9.241   4.008
  495   1HB   GLU  61          HB1       GLU  61  -3.002 -11.794   5.056
  496   2HB   GLU  61          HB2       GLU  61  -4.195 -10.979   6.062
  497   1HG   GLU  61          HG1       GLU  61  -5.470 -11.835   4.305
  498   2HG   GLU  61          HG2       GLU  61  -5.207 -10.154   3.831
  499    H    ASN  62           HN       ASN  62  -2.440  -9.501   7.522
  500    HA   ASN  62           HA       ASN  62  -4.352  -7.381   8.059
  501   1HB   ASN  62          HB1       ASN  62  -4.377  -9.378   9.446
  502   2HB   ASN  62          HB2       ASN  62  -2.696  -9.128   9.890
  503   1HD2  ASN  62          HD21      ASN  62  -2.193  -7.356  11.275
  504   2HD2  ASN  62          HD22      ASN  62  -3.409  -6.658  12.284
  505    H    ASN  63           HN       ASN  63  -0.803  -7.868   8.454
  506    HA   ASN  63           HA       ASN  63  -0.116  -5.474   9.602
  507   1HB   ASN  63          HB1       ASN  63   1.191  -7.659   8.607
  508   2HB   ASN  63          HB2       ASN  63   1.764  -6.390   7.542
  509   1HD2  ASN  63          HD21      ASN  63   1.015  -6.030  11.018
  510   2HD2  ASN  63          HD22      ASN  63   2.621  -5.431  11.241
  511    H    MET  64           HN       MET  64  -0.585  -5.899   6.027
  512    HA   MET  64           HA       MET  64   0.174  -3.262   5.376
  513   1HB   MET  64          HB1       MET  64   0.122  -4.812   3.620
  514   2HB   MET  64          HB2       MET  64  -1.524  -5.309   3.983
  515   1HG   MET  64          HG1       MET  64  -1.110  -2.481   3.226
  516   2HG   MET  64          HG2       MET  64  -0.876  -3.678   1.966
  517   1HE   MET  64          HE1       MET  64  -4.521  -5.440   2.335
  518   2HE   MET  64          HE2       MET  64  -3.248  -5.690   3.532
  519   3HE   MET  64          HE3       MET  64  -2.860  -5.725   1.811
  520    H    SER  65           HN       SER  65  -3.021  -4.525   6.330
  521    HA   SER  65           HA       SER  65  -4.499  -2.171   5.914
  522   1HB   SER  65          HB1       SER  65  -5.080  -4.277   7.994
  523   2HB   SER  65          HB2       SER  65  -6.223  -3.163   7.257
  524    HG   SER  65           HG       SER  65  -5.025  -5.460   6.203
  525    H    GLU  66           HN       GLU  66  -2.632  -3.212   8.739
  526    HA   GLU  66           HA       GLU  66  -3.393  -1.384  10.650
  527   1HB   GLU  66          HB1       GLU  66  -0.618  -2.449  10.045
  528   2HB   GLU  66          HB2       GLU  66  -1.098  -1.692  11.561
  529   1HG   GLU  66          HG1       GLU  66  -2.632  -3.469  12.050
  530   2HG   GLU  66          HG2       GLU  66  -2.404  -4.174  10.450
  531    H    TYR  67           HN       TYR  67  -0.779  -0.957   8.284
  532    HA   TYR  67           HA       TYR  67  -0.170   1.736   8.766
  533   1HB   TYR  67          HB1       TYR  67   1.421   0.315   7.740
  534   2HB   TYR  67          HB2       TYR  67   0.308  -0.131   6.460
  535    HD1  TYR  67           HD1      TYR  67   0.451   0.925   4.376
  536    HD2  TYR  67           HD2      TYR  67   2.135   2.814   7.846
  537    HE1  TYR  67           HE1      TYR  67   1.590   2.587   2.911
  538    HE2  TYR  67           HE2      TYR  67   3.323   4.451   6.400
  539    HH   TYR  67           HH       TYR  67   2.794   4.582   2.919
  540    H    LEU  68           HN       LEU  68  -2.389   0.310   6.292
  541    HA   LEU  68           HA       LEU  68  -2.899   2.717   4.952
  542   1HB   LEU  68          HB1       LEU  68  -4.615   0.271   5.299
  543   2HB   LEU  68          HB2       LEU  68  -5.038   1.606   4.241
  544    HG   LEU  68           HG       LEU  68  -2.780  -0.366   3.947
  545   1HD1  LEU  68          HD11      LEU  68  -4.977   0.647   2.125
  546   2HD1  LEU  68          HD12      LEU  68  -5.033  -0.850   3.055
  547   3HD1  LEU  68          HD13      LEU  68  -3.846  -0.658   1.765
  548   1HD2  LEU  68          HD21      LEU  68  -3.104   2.198   2.355
  549   2HD2  LEU  68          HD22      LEU  68  -1.916   0.928   2.068
  550   3HD2  LEU  68          HD23      LEU  68  -1.822   1.908   3.531
  551    H    THR  69           HN       THR  69  -4.606   1.419   7.829
  552    HA   THR  69           HA       THR  69  -6.655   3.362   7.859
  553    HB   THR  69           HB       THR  69  -5.727   2.192  10.429
  554    HG1  THR  69           HG1      THR  69  -5.610   0.356   9.326
  555   1HG2  THR  69          HG21      THR  69  -8.124   1.823  10.759
  556   2HG2  THR  69          HG22      THR  69  -8.453   2.414   9.130
  557   3HG2  THR  69          HG23      THR  69  -7.815   3.512  10.354
  558    H    ASN  70           HN       ASN  70  -3.354   3.492   9.053
  559    HA   ASN  70           HA       ASN  70  -3.503   6.325   9.328
  560   1HB   ASN  70          HB1       ASN  70  -4.480   5.475  11.513
  561   2HB   ASN  70          HB2       ASN  70  -2.878   4.850  11.890
  562   1HD2  ASN  70          HD21      ASN  70  -4.354   6.873  13.343
  563   2HD2  ASN  70          HD22      ASN  70  -3.199   8.158  13.363
  564    HA   PRO  71           HA       PRO  71   0.625   4.742   7.955
  565   1HB   PRO  71          HB1       PRO  71   1.117   6.968   6.416
  566   2HB   PRO  71          HB2       PRO  71   0.304   5.511   5.836
  567   1HG   PRO  71          HG1       PRO  71  -0.876   8.097   6.769
  568   2HG   PRO  71          HG2       PRO  71  -1.348   7.082   5.394
  569   1HD   PRO  71          HD1       PRO  71  -2.729   7.067   7.696
  570   2HD   PRO  71          HD2       PRO  71  -2.509   5.590   6.734
  571    H    LYS  72           HN       LYS  72  -0.328   7.882   9.221
  572    HA   LYS  72           HA       LYS  72   2.274   8.822   9.874
  573   1HB   LYS  72          HB1       LYS  72  -0.371   9.863   9.932
  574   2HB   LYS  72          HB2       LYS  72   0.311  10.059  11.537
  575   1HG   LYS  72          HG1       LYS  72   1.244  11.931  10.792
  576   2HG   LYS  72          HG2       LYS  72   2.339  10.918   9.858
  577   1HD   LYS  72          HD1       LYS  72  -0.291  12.047   8.880
  578   2HD   LYS  72          HD2       LYS  72   1.309  12.670   8.478
  579   1HE   LYS  72          HE1       LYS  72   0.402   9.860   7.865
  580   2HE   LYS  72          HE2       LYS  72   0.247  11.194   6.732
  581   1HZ   LYS  72          HZ1       LYS  72   2.760  10.037   7.797
  582   2HZ   LYS  72          HZ2       LYS  72   2.693  11.444   6.865
  583   3HZ   LYS  72          HZ3       LYS  72   2.188   9.977   6.199
  584    H    LYS  73           HN       LYS  73  -0.172   7.043  11.699
  585    HA   LYS  73           HA       LYS  73   1.305   7.268  14.163
  586   1HB   LYS  73          HB1       LYS  73  -1.126   7.180  14.234
  587   2HB   LYS  73          HB2       LYS  73  -1.112   5.584  13.498
  588   1HG   LYS  73          HG1       LYS  73  -1.507   5.375  15.871
  589   2HG   LYS  73          HG2       LYS  73   0.066   4.694  15.478
  590   1HD   LYS  73          HD1       LYS  73   0.736   7.267  16.124
  591   2HD   LYS  73          HD2       LYS  73  -0.634   6.985  17.196
  592   1HE   LYS  73          HE1       LYS  73   1.198   6.314  18.475
  593   2HE   LYS  73          HE2       LYS  73   0.581   4.797  17.829
  594   1HZ   LYS  73          HZ1       LYS  73   2.993   6.291  17.028
  595   2HZ   LYS  73          HZ2       LYS  73   2.292   5.153  15.995
  596   3HZ   LYS  73          HZ3       LYS  73   2.857   4.673  17.513
  597    H    TYR  74           HN       TYR  74   0.886   4.728  11.727
  598    HA   TYR  74           HA       TYR  74   2.325   2.718  13.122
  599   1HB   TYR  74          HB1       TYR  74   0.650   2.609  11.103
  600   2HB   TYR  74          HB2       TYR  74   2.124   2.749  10.143
  601    HD1  TYR  74           HD1      TYR  74   3.042   0.700   9.416
  602    HD2  TYR  74           HD2      TYR  74   0.998   0.944  13.190
  603    HE1  TYR  74           HE1      TYR  74   3.399  -1.747   9.767
  604    HE2  TYR  74           HE2      TYR  74   1.338  -1.485  13.551
  605    HH   TYR  74           HH       TYR  74   1.682  -3.505  12.150
  606    H    ILE  75           HN       ILE  75   3.297   5.027  10.650
  607    HA   ILE  75           HA       ILE  75   6.131   4.509  11.211
  608    HB   ILE  75           HB       ILE  75   4.936   5.041   8.478
  609   1HG1  ILE  75          HG11      ILE  75   6.324   2.572   9.588
  610   2HG1  ILE  75          HG12      ILE  75   4.613   2.694   9.207
  611   1HG2  ILE  75          HG21      ILE  75   7.801   4.723   9.413
  612   2HG2  ILE  75          HG22      ILE  75   7.065   6.159   8.701
  613   3HG2  ILE  75          HG23      ILE  75   7.309   4.715   7.719
  614   1HD1  ILE  75          HD11      ILE  75   5.113   2.880   6.841
  615   2HD1  ILE  75          HD12      ILE  75   5.907   1.452   7.503
  616   3HD1  ILE  75          HD13      ILE  75   6.844   2.909   7.179
  617    HA   PRO  76           HA       PRO  76   5.167   8.886  12.228
  618   1HB   PRO  76          HB1       PRO  76   7.170   9.092  14.070
  619   2HB   PRO  76          HB2       PRO  76   5.562   8.463  14.443
  620   1HG   PRO  76          HG1       PRO  76   8.095   6.977  13.876
  621   2HG   PRO  76          HG2       PRO  76   6.851   6.647  15.095
  622   1HD   PRO  76          HD1       PRO  76   7.012   5.271  12.772
  623   2HD   PRO  76          HD2       PRO  76   5.466   5.598  13.581
  624    H    GLY  77           HN       GLY  77   5.852   9.861  10.343
  625   1HA   GLY  77          HA1       GLY  77   7.593  11.547   9.773
  626   2HA   GLY  77          HA2       GLY  77   8.756  10.253   9.981
  627    H    THR  78           HN       THR  78   6.256   8.726   8.532
  628    HA   THR  78           HA       THR  78   7.496   8.460   6.007
  629    HB   THR  78           HB       THR  78   5.711   7.011   7.452
  630    HG1  THR  78           HG1      THR  78   6.927   6.804   5.041
  631   1HG2  THR  78          HG21      THR  78   3.743   8.258   6.653
  632   2HG2  THR  78          HG22      THR  78   3.738   6.576   6.122
  633   3HG2  THR  78          HG23      THR  78   4.182   7.855   4.992
  634    H    LYS  79           HN       LYS  79   6.922   9.111   3.972
  635    HA   LYS  79           HA       LYS  79   5.749  11.695   3.698
  636   1HB   LYS  79          HB1       LYS  79   6.158   9.917   1.341
  637   2HB   LYS  79          HB2       LYS  79   6.495  11.631   1.520
  638   1HG   LYS  79          HG1       LYS  79   8.459  11.060   2.929
  639   2HG   LYS  79          HG2       LYS  79   8.139   9.346   2.616
  640   1HD   LYS  79          HD1       LYS  79   8.095  10.265   0.083
  641   2HD   LYS  79          HD2       LYS  79   9.211  11.439   0.794
  642   1HE   LYS  79          HE1       LYS  79  10.687   9.776   0.175
  643   2HE   LYS  79          HE2       LYS  79  10.320   9.289   1.830
  644   1HZ   LYS  79          HZ1       LYS  79   8.637   8.240  -0.323
  645   2HZ   LYS  79          HZ2       LYS  79   9.092   7.523   1.138
  646   3HZ   LYS  79          HZ3       LYS  79  10.194   7.596  -0.139
  647    H    MET  80           HN       MET  80   4.293   8.500   3.508
  648    HA   MET  80           HA       MET  80   2.181   9.192   1.758
  649   1HB   MET  80          HB1       MET  80   2.482   6.929   1.767
  650   2HB   MET  80          HB2       MET  80   2.788   6.861   3.506
  651   1HG   MET  80          HG1       MET  80   0.584   6.815   4.050
  652   2HG   MET  80          HG2       MET  80   0.100   7.746   2.645
  653   1HE   MET  80          HE1       MET  80  -1.115   5.047   4.201
  654   2HE   MET  80          HE2       MET  80  -1.845   4.218   2.826
  655   3HE   MET  80          HE3       MET  80  -2.044   5.960   3.012
  656    H    ALA  81           HN       ALA  81   0.951  10.821   2.164
  657    HA   ALA  81           HA       ALA  81  -0.368  11.133   4.753
  658   1HB   ALA  81          HB1       ALA  81   1.147  12.935   4.010
  659   2HB   ALA  81          HB2       ALA  81  -0.502  13.467   4.331
  660   3HB   ALA  81          HB3       ALA  81   0.046  13.255   2.669
  661    H    PHE  82           HN       PHE  82  -1.267   9.475   2.528
  662    HA   PHE  82           HA       PHE  82  -3.379  10.164   1.030
  663   1HB   PHE  82          HB1       PHE  82  -2.718   8.080   0.536
  664   2HB   PHE  82          HB2       PHE  82  -2.343   7.680   2.207
  665    HD1  PHE  82           HD1      PHE  82  -5.127   7.976  -0.257
  666    HD2  PHE  82           HD2      PHE  82  -3.836   6.420   3.541
  667    HE1  PHE  82           HE1      PHE  82  -7.264   6.717  -0.044
  668    HE2  PHE  82           HE2      PHE  82  -5.974   5.174   3.760
  669    HZ   PHE  82           HZ       PHE  82  -7.696   5.339   1.977
  670    H    GLY  83           HN       GLY  83  -3.613   9.712   4.540
  671   1HA   GLY  83          HA1       GLY  83  -5.520  10.967   5.533
  672   2HA   GLY  83          HA2       GLY  83  -6.519  10.236   4.297
  673    H    GLY  84           HN       GLY  84  -5.601   7.548   4.549
  674   1HA   GLY  84          HA1       GLY  84  -5.484   5.691   5.962
  675   2HA   GLY  84          HA2       GLY  84  -5.930   6.709   7.319
  676    H    LEU  85           HN       LEU  85  -6.987   4.346   5.216
  677    HA   LEU  85           HA       LEU  85  -9.797   4.952   5.119
  678   1HB   LEU  85          HB1       LEU  85  -8.075   2.698   4.162
  679   2HB   LEU  85          HB2       LEU  85  -9.808   2.475   4.262
  680    HG   LEU  85           HG       LEU  85  -8.383   4.549   2.574
  681   1HD1  LEU  85          HD11      LEU  85  -8.163   2.277   1.713
  682   2HD1  LEU  85          HD12      LEU  85  -9.284   3.198   0.709
  683   3HD1  LEU  85          HD13      LEU  85  -9.903   2.027   1.873
  684   1HD2  LEU  85          HD21      LEU  85 -10.540   5.459   3.208
  685   2HD2  LEU  85          HD22      LEU  85 -11.335   3.928   2.845
  686   3HD2  LEU  85          HD23      LEU  85 -10.634   4.887   1.542
  687    H    LYS  86           HN       LYS  86 -10.462   5.116   7.141
  688    HA   LYS  86           HA       LYS  86 -10.078   3.357   9.307
  689   1HB   LYS  86          HB1       LYS  86 -12.321   5.350   9.072
  690   2HB   LYS  86          HB2       LYS  86 -11.472   4.824  10.519
  691   1HG   LYS  86          HG1       LYS  86 -10.033   6.304   8.329
  692   2HG   LYS  86          HG2       LYS  86 -10.934   7.162   9.580
  693   1HD   LYS  86          HD1       LYS  86  -9.571   5.926  11.295
  694   2HD   LYS  86          HD2       LYS  86  -8.593   5.285   9.977
  695   1HE   LYS  86          HE1       LYS  86  -8.980   8.242  10.443
  696   2HE   LYS  86          HE2       LYS  86  -7.666   7.326  11.175
  697   1HZ   LYS  86          HZ1       LYS  86  -6.738   6.877   9.085
  698   2HZ   LYS  86          HZ2       LYS  86  -7.156   8.515   9.031
  699   3HZ   LYS  86          HZ3       LYS  86  -8.130   7.374   8.254
  700    H    LYS  87           HN       LYS  87 -12.074   2.955   6.635
  701    HA   LYS  87           HA       LYS  87 -14.175   1.436   7.999
  702   1HB   LYS  87          HB1       LYS  87 -14.007   1.677   5.048
  703   2HB   LYS  87          HB2       LYS  87 -15.413   1.614   6.076
  704   1HG   LYS  87          HG1       LYS  87 -15.177   4.005   6.593
  705   2HG   LYS  87          HG2       LYS  87 -13.690   4.070   5.597
  706   1HD   LYS  87          HD1       LYS  87 -15.028   2.866   3.827
  707   2HD   LYS  87          HD2       LYS  87 -16.447   3.215   4.753
  708   1HE   LYS  87          HE1       LYS  87 -16.525   5.399   3.988
  709   2HE   LYS  87          HE2       LYS  87 -14.802   5.408   3.548
  710   1HZ   LYS  87          HZ1       LYS  87 -16.799   3.581   2.318
  711   2HZ   LYS  87          HZ2       LYS  87 -15.198   3.800   1.836
  712   3HZ   LYS  87          HZ3       LYS  87 -16.323   5.049   1.612
  713    H    GLU  88           HN       GLU  88 -13.712  -0.658   8.356
  714    HA   GLU  88           HA       GLU  88 -11.812  -2.263   7.123
  715   1HB   GLU  88          HB1       GLU  88 -14.340  -3.206   8.467
  716   2HB   GLU  88          HB2       GLU  88 -12.820  -4.083   8.314
  717   1HG   GLU  88          HG1       GLU  88 -12.202  -1.614   9.555
  718   2HG   GLU  88          HG2       GLU  88 -13.632  -2.263  10.370
  719    H    LYS  89           HN       LYS  89 -15.319  -2.168   6.360
  720    HA   LYS  89           HA       LYS  89 -15.415  -4.260   4.555
  721   1HB   LYS  89          HB1       LYS  89 -17.054  -1.760   4.218
  722   2HB   LYS  89          HB2       LYS  89 -17.512  -3.431   3.911
  723   1HG   LYS  89          HG1       LYS  89 -16.750  -2.606   6.678
  724   2HG   LYS  89          HG2       LYS  89 -18.352  -2.215   6.069
  725   1HD   LYS  89          HD1       LYS  89 -18.834  -4.576   5.723
  726   2HD   LYS  89          HD2       LYS  89 -17.184  -5.005   6.202
  727   1HE   LYS  89          HE1       LYS  89 -17.555  -4.120   8.434
  728   2HE   LYS  89          HE2       LYS  89 -19.159  -3.549   7.977
  729   1HZ   LYS  89          HZ1       LYS  89 -19.932  -5.760   7.781
  730   2HZ   LYS  89          HZ2       LYS  89 -19.109  -5.673   9.254
  731   3HZ   LYS  89          HZ3       LYS  89 -18.370  -6.405   7.924
  732    H    ASP  90           HN       ASP  90 -14.701  -0.915   3.973
  733    HA   ASP  90           HA       ASP  90 -14.306  -0.815   1.258
  734   1HB   ASP  90          HB1       ASP  90 -13.728   0.749   3.660
  735   2HB   ASP  90          HB2       ASP  90 -12.579   1.036   2.365
  736    H    ARG  91           HN       ARG  91 -11.783  -1.428   3.804
  737    HA   ARG  91           HA       ARG  91  -9.730  -1.896   1.869
  738   1HB   ARG  91          HB1       ARG  91  -9.584  -2.915   4.706
  739   2HB   ARG  91          HB2       ARG  91  -8.256  -2.528   3.619
  740   1HG   ARG  91          HG1       ARG  91  -8.798  -0.167   3.745
  741   2HG   ARG  91          HG2       ARG  91 -10.199  -0.515   4.745
  742   1HD   ARG  91          HD1       ARG  91  -7.286  -0.623   5.457
  743   2HD   ARG  91          HD2       ARG  91  -8.581   0.264   6.243
  744    HE   ARG  91           HE       ARG  91  -8.007  -2.156   5.949
  745   1HH1  ARG  91          HH21      ARG  91  -9.373   0.214   8.092
  746   2HH1  ARG  91          HH22      ARG  91  -9.877  -0.740   9.444
  747   1HH2  ARG  91          HH11      ARG  91  -8.834  -3.733   8.126
  748   2HH2  ARG  91          HH12      ARG  91  -9.629  -2.949   9.447
  749    H    ASN  92           HN       ASN  92 -11.968  -4.063   3.536
  750    HA   ASN  92           HA       ASN  92 -10.911  -6.519   3.167
  751   1HB   ASN  92          HB1       ASN  92 -13.757  -5.587   2.868
  752   2HB   ASN  92          HB2       ASN  92 -13.328  -7.286   2.754
  753   1HD2  ASN  92          HD21      ASN  92 -15.089  -6.354   4.645
  754   2HD2  ASN  92          HD22      ASN  92 -14.311  -6.751   6.138
  755    H    ASP  93           HN       ASP  93 -12.912  -4.973   0.606
  756    HA   ASP  93           HA       ASP  93 -12.227  -6.826  -1.416
  757   1HB   ASP  93          HB1       ASP  93 -14.111  -4.890  -1.199
  758   2HB   ASP  93          HB2       ASP  93 -12.971  -4.097  -2.275
  759    H    LEU  94           HN       LEU  94 -10.736  -3.661  -0.555
  760    HA   LEU  94           HA       LEU  94  -9.014  -3.348  -2.670
  761   1HB   LEU  94          HB1       LEU  94  -9.326  -2.311   0.051
  762   2HB   LEU  94          HB2       LEU  94  -7.701  -2.296  -0.525
  763    HG   LEU  94           HG       LEU  94  -9.919  -1.125  -2.173
  764   1HD1  LEU  94          HD11      LEU  94  -9.879  -0.136   0.122
  765   2HD1  LEU  94          HD12      LEU  94  -9.529   1.019  -1.167
  766   3HD1  LEU  94          HD13      LEU  94  -8.217   0.375  -0.181
  767   1HD2  LEU  94          HD21      LEU  94  -7.012  -0.307  -2.052
  768   2HD2  LEU  94          HD22      LEU  94  -8.238   0.251  -3.189
  769   3HD2  LEU  94          HD23      LEU  94  -7.668  -1.416  -3.257
  770    H    ILE  95           HN       ILE  95  -8.547  -5.307   0.250
  771    HA   ILE  95           HA       ILE  95  -5.846  -6.005  -0.152
  772    HB   ILE  95           HB       ILE  95  -8.026  -7.465   1.358
  773   1HG1  ILE  95          HG11      ILE  95  -5.852  -5.655   2.451
  774   2HG1  ILE  95          HG12      ILE  95  -7.460  -5.069   2.037
  775   1HG2  ILE  95          HG21      ILE  95  -6.259  -9.045   1.027
  776   2HG2  ILE  95          HG22      ILE  95  -6.088  -8.425   2.668
  777   3HG2  ILE  95          HG23      ILE  95  -5.025  -7.836   1.390
  778   1HD1  ILE  95          HD11      ILE  95  -6.973  -7.294   4.016
  779   2HD1  ILE  95          HD12      ILE  95  -8.475  -6.416   3.727
  780   3HD1  ILE  95          HD13      ILE  95  -7.104  -5.594   4.470
  781    H    THR  96           HN       THR  96  -8.860  -7.724  -1.050
  782    HA   THR  96           HA       THR  96  -7.786  -9.979  -2.237
  783    HB   THR  96           HB       THR  96 -10.207  -8.643  -3.422
  784    HG1  THR  96           HG1      THR  96 -10.580  -8.573  -1.213
  785   1HG2  THR  96          HG21      THR  96  -9.684 -11.539  -2.742
  786   2HG2  THR  96          HG22      THR  96  -9.321 -10.836  -4.319
  787   3HG2  THR  96          HG23      THR  96 -10.985 -10.884  -3.737
  788    H    TYR  97           HN       TYR  97  -8.281  -6.776  -3.768
  789    HA   TYR  97           HA       TYR  97  -7.429  -7.567  -6.346
  790   1HB   TYR  97          HB1       TYR  97  -8.708  -5.526  -5.986
  791   2HB   TYR  97          HB2       TYR  97  -7.369  -4.826  -5.087
  792    HD1  TYR  97           HD1      TYR  97  -6.127  -3.246  -6.198
  793    HD2  TYR  97           HD2      TYR  97  -7.867  -6.478  -8.438
  794    HE1  TYR  97           HE1      TYR  97  -5.163  -2.310  -8.289
  795    HE2  TYR  97           HE2      TYR  97  -7.010  -5.485 -10.552
  796    HH   TYR  97           HH       TYR  97  -4.685  -3.587 -10.891
  797    H    LEU  98           HN       LEU  98  -5.558  -5.819  -3.819
  798    HA   LEU  98           HA       LEU  98  -3.092  -5.817  -5.139
  799   1HB   LEU  98          HB1       LEU  98  -4.029  -4.747  -2.845
  800   2HB   LEU  98          HB2       LEU  98  -3.091  -6.084  -2.185
  801    HG   LEU  98           HG       LEU  98  -1.087  -5.296  -3.407
  802   1HD1  LEU  98          HD11      LEU  98  -1.146  -3.058  -4.468
  803   2HD1  LEU  98          HD12      LEU  98  -2.895  -3.017  -4.243
  804   3HD1  LEU  98          HD13      LEU  98  -2.171  -4.221  -5.310
  805   1HD2  LEU  98          HD21      LEU  98  -0.642  -3.327  -2.079
  806   2HD2  LEU  98          HD22      LEU  98  -1.579  -4.462  -1.107
  807   3HD2  LEU  98          HD23      LEU  98  -2.368  -3.060  -1.829
  808    H    LYS  99           HN       LYS  99  -4.324  -8.034  -2.696
  809    HA   LYS  99           HA       LYS  99  -2.254  -9.850  -2.538
  810   1HB   LYS  99          HB1       LYS  99  -3.663 -10.502  -0.933
  811   2HB   LYS  99          HB2       LYS  99  -5.026  -9.721  -1.714
  812   1HG   LYS  99          HG1       LYS  99  -5.366 -11.707  -3.112
  813   2HG   LYS  99          HG2       LYS  99  -3.992 -12.488  -2.354
  814   1HD   LYS  99          HD1       LYS  99  -6.079 -11.621  -0.468
  815   2HD   LYS  99          HD2       LYS  99  -6.608 -12.837  -1.635
  816   1HE   LYS  99          HE1       LYS  99  -5.583 -13.630   0.593
  817   2HE   LYS  99          HE2       LYS  99  -5.070 -14.406  -0.897
  818   1HZ   LYS  99          HZ1       LYS  99  -2.997 -13.793  -0.525
  819   2HZ   LYS  99          HZ2       LYS  99  -3.473 -13.294   1.025
  820   3HZ   LYS  99          HZ3       LYS  99  -3.444 -12.176  -0.245
  821    H    LYS 100           HN       LYS 100  -4.886  -9.742  -4.939
  822    HA   LYS 100           HA       LYS 100  -4.220 -12.186  -6.208
  823   1HB   LYS 100          HB1       LYS 100  -6.409 -10.680  -6.194
  824   2HB   LYS 100          HB2       LYS 100  -5.756 -10.196  -7.742
  825   1HG   LYS 100          HG1       LYS 100  -7.495 -12.081  -7.714
  826   2HG   LYS 100          HG2       LYS 100  -6.032 -12.354  -8.663
  827   1HD   LYS 100          HD1       LYS 100  -5.927 -13.181  -5.853
  828   2HD   LYS 100          HD2       LYS 100  -7.071 -14.059  -6.818
  829   1HE   LYS 100          HE1       LYS 100  -5.326 -15.488  -6.897
  830   2HE   LYS 100          HE2       LYS 100  -4.867 -14.480  -8.280
  831   1HZ   LYS 100          HZ1       LYS 100  -3.042 -14.829  -6.611
  832   2HZ   LYS 100          HZ2       LYS 100  -3.967 -13.971  -5.485
  833   3HZ   LYS 100          HZ3       LYS 100  -3.418 -13.199  -6.889
  834    H    ALA 101           HN       ALA 101  -3.169  -9.032  -6.764
  835    HA   ALA 101           HA       ALA 101  -1.849  -9.345  -9.266
  836   1HB   ALA 101          HB1       ALA 101  -2.856  -7.247  -8.727
  837   2HB   ALA 101          HB2       ALA 101  -1.109  -7.004  -8.766
  838   3HB   ALA 101          HB3       ALA 101  -1.948  -7.132  -7.219
  839    H    THR 102           HN       THR 102  -0.808  -9.378  -5.883
  840    HA   THR 102           HA       THR 102   2.011  -9.582  -6.427
  841    HB   THR 102           HB       THR 102   0.621 -10.097  -3.798
  842    HG1  THR 102           HG1      THR 102   0.113  -8.001  -4.545
  843   1HG2  THR 102          HG21      THR 102   3.016 -10.766  -3.955
  844   2HG2  THR 102          HG22      THR 102   2.730  -9.466  -2.797
  845   3HG2  THR 102          HG23      THR 102   3.415  -9.102  -4.381
  846    H    GLU 103           HN       GLU 103  -0.587 -11.845  -5.491
  847    HA   GLU 103           HA       GLU 103   1.245 -14.069  -6.139
  848   1HB   GLU 103          HB1       GLU 103  -0.453 -15.333  -4.488
  849   2HB   GLU 103          HB2       GLU 103   1.033 -14.580  -3.934
  850   1HG   GLU 103          HG1       GLU 103  -0.171 -13.415  -2.498
  851   2HG   GLU 103          HG2       GLU 103  -0.876 -12.553  -3.861
  852    HHA  HEC 104           HA       HEC 104   5.037   3.347   1.394
  853    HHB  HEC 104           HB       HEC 104  -0.641   0.469   0.101
  854    HHC  HEC 104           HC       HEC 104  -3.203   6.257  -1.296
  855    HHD  HEC 104           HD       HEC 104   2.726   8.818  -1.203
  856   1HMA  HEC 104          HMA1      HEC 104   1.165  -0.982   1.866
  857   2HMA  HEC 104          HMA2      HEC 104   2.681  -1.322   1.028
  858   3HMA  HEC 104          HMA3      HEC 104   1.187  -1.132   0.109
  859   1HAA  HEC 104          HAA1      HEC 104   4.218  -0.338   1.964
  860   2HAA  HEC 104          HAA2      HEC 104   4.895   1.224   2.386
  861   1HBA  HEC 104          HBA1      HEC 104   5.749   1.448   0.065
  862   2HBA  HEC 104          HBA2      HEC 104   5.131  -0.157  -0.293
  863   1HMB  HEC 104          HMB1      HEC 104  -2.522   0.168  -0.526
  864   2HMB  HEC 104          HMB2      HEC 104  -3.451   0.804  -1.883
  865   3HMB  HEC 104          HMB3      HEC 104  -4.107   0.891  -0.249
  866    HAB  HEC 104           HAB      HEC 104  -4.603   4.925  -1.378
  867   1HBB  HEC 104          HBB1      HEC 104  -4.921   3.635   0.874
  868   2HBB  HEC 104          HBB2      HEC 104  -5.918   2.590  -0.138
  869   3HBB  HEC 104          HBB3      HEC 104  -6.278   4.314  -0.025
  870   1HMC  HEC 104          HMC1      HEC 104  -3.268   8.827  -1.381
  871   2HMC  HEC 104          HMC2      HEC 104  -2.933   8.150  -2.975
  872   3HMC  HEC 104          HMC3      HEC 104  -2.329   9.752  -2.553
  873    HAC  HEC 104           HAC      HEC 104   1.519   9.902  -2.443
  874   1HBC  HEC 104          HBC1      HEC 104   0.728  11.238  -0.727
  875   2HBC  HEC 104          HBC2      HEC 104  -0.934  11.180  -1.311
  876   3HBC  HEC 104          HBC3      HEC 104   0.290  12.072  -2.217
  877   1HMD  HEC 104          HMD1      HEC 104   4.863   9.198  -0.289
  878   2HMD  HEC 104          HMD2      HEC 104   5.311   8.255  -1.711
  879   3HMD  HEC 104          HMD3      HEC 104   6.338   8.232  -0.277
  880   1HAD  HEC 104          HAD1      HEC 104   7.153   6.340   0.442
  881   2HAD  HEC 104          HAD2      HEC 104   6.708   4.775   1.113
  882   1HBD  HEC 104          HBD1      HEC 104   6.197   5.660   3.193
  883   2HBD  HEC 104          HBD2      HEC 104   5.868   7.255   2.551
  884    H2   4NL 105           H2       4NL 105  -0.150 -13.141  -0.752
  885    H6   4NL 105           H6       4NL 105   2.464 -14.100   3.160
  886    H3   4NL 105           H3       4NL 105  -1.565 -10.447   2.348
  887    H5   4NL 105           H5       4NL 105  -2.350 -10.436   0.244
  888    H4   4NL 105           H4       4NL 105  -0.041 -11.553   4.005
  889    H1   4NL 105           H1       4NL 105   1.374 -14.246   0.905
  890    H7   4NL 105           H7       4NL 105   1.446 -13.517   4.499
  Start of MODEL    4
    1   1H    THR  -5          HT1       THR  -5 -13.190  -5.982  13.733
    2   2H    THR  -5          HT2       THR  -5 -12.522  -5.416  12.284
    3   3H    THR  -5          HT3       THR  -5 -11.600  -5.394  13.702
    4    HA   THR  -5           HA       THR  -5 -11.007  -7.216  12.163
    5    HB   THR  -5           HB       THR  -5 -12.144  -8.532  14.599
    6    HG1  THR  -5           HG1      THR  -5 -10.203  -7.501  15.672
    7   1HG2  THR  -5          HG21      THR  -5  -9.786  -9.337  14.745
    8   2HG2  THR  -5          HG22      THR  -5  -9.426  -8.423  13.280
    9   3HG2  THR  -5          HG23      THR  -5 -10.575  -9.761  13.225
   10    H    GLU  -4           HN       GLU  -4 -12.791  -7.105  10.523
   11    HA   GLU  -4           HA       GLU  -4 -14.365  -9.522  10.561
   12   1HB   GLU  -4          HB1       GLU  -4 -15.801  -7.648  11.650
   13   2HB   GLU  -4          HB2       GLU  -4 -15.845  -6.928  10.045
   14   1HG   GLU  -4          HG1       GLU  -4 -16.644  -9.790  10.415
   15   2HG   GLU  -4          HG2       GLU  -4 -17.772  -8.505  10.827
   16    H    PHE  -3           HN       PHE  -3 -12.620  -9.783   9.001
   17    HA   PHE  -3           HA       PHE  -3 -12.692  -8.209   6.585
   18   1HB   PHE  -3          HB1       PHE  -3 -10.498  -8.735   7.287
   19   2HB   PHE  -3          HB2       PHE  -3 -10.877 -10.444   7.459
   20    HD1  PHE  -3           HD1      PHE  -3 -10.248  -7.722   5.005
   21    HD2  PHE  -3           HD2      PHE  -3 -10.737 -11.953   5.599
   22    HE1  PHE  -3           HE1      PHE  -3  -9.537  -8.132   2.657
   23    HE2  PHE  -3           HE2      PHE  -3 -10.075 -12.361   3.236
   24    HZ   PHE  -3           HZ       PHE  -3  -9.503 -10.447   1.754
   25    H    LYS  -2           HN       LYS  -2 -13.879  -8.537   4.968
   26    HA   LYS  -2           HA       LYS  -2 -14.995 -11.173   4.315
   27   1HB   LYS  -2          HB1       LYS  -2 -16.196  -8.506   4.563
   28   2HB   LYS  -2          HB2       LYS  -2 -16.577  -9.289   3.033
   29   1HG   LYS  -2          HG1       LYS  -2 -17.259 -11.327   4.351
   30   2HG   LYS  -2          HG2       LYS  -2 -17.093 -10.354   5.809
   31   1HD   LYS  -2          HD1       LYS  -2 -18.738  -8.725   4.648
   32   2HD   LYS  -2          HD2       LYS  -2 -19.088 -10.077   3.572
   33   1HE   LYS  -2          HE1       LYS  -2 -20.738 -10.101   5.296
   34   2HE   LYS  -2          HE2       LYS  -2 -19.641 -11.441   5.610
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.528 -10.062   7.284
   36   2HZ   LYS  -2          HZ2       LYS  -2 -20.161 -10.295   7.644
   37   3HZ   LYS  -2          HZ3       LYS  -2 -19.651  -8.822   7.000
   38    H    ALA  -1           HN       ALA  -1 -14.184 -12.010   2.565
   39    HA   ALA  -1           HA       ALA  -1 -12.220 -10.944   0.948
   40   1HB   ALA  -1          HB1       ALA  -1 -12.628 -12.903  -0.487
   41   2HB   ALA  -1          HB2       ALA  -1 -14.140 -13.202   0.373
   42   3HB   ALA  -1          HB3       ALA  -1 -12.601 -13.324   1.226
   43    H    GLY   1           HN       GLY   1 -12.140 -10.038  -1.072
   44   1HA   GLY   1          HA1       GLY   1 -14.614  -8.865  -2.160
   45   2HA   GLY   1          HA2       GLY   1 -13.022  -8.128  -2.258
   46    H    SER   2           HN       SER   2 -12.884  -7.955  -4.413
   47    HA   SER   2           HA       SER   2 -12.098 -10.217  -5.973
   48   1HB   SER   2          HB1       SER   2 -14.296  -8.866  -7.385
   49   2HB   SER   2          HB2       SER   2 -13.906 -10.588  -7.285
   50    HG   SER   2           HG       SER   2 -14.804 -10.559  -5.153
   51    H    ALA   3           HN       ALA   3 -11.031  -9.587  -7.894
   52    HA   ALA   3           HA       ALA   3  -9.655  -7.218  -7.887
   53   1HB   ALA   3          HB1       ALA   3  -8.963  -7.786 -10.159
   54   2HB   ALA   3          HB2       ALA   3 -10.268  -8.969 -10.262
   55   3HB   ALA   3          HB3       ALA   3  -8.960  -9.200  -9.104
   56    H    LYS   4           HN       LYS   4 -12.762  -7.758  -9.617
   57    HA   LYS   4           HA       LYS   4 -12.673  -5.184 -10.847
   58   1HB   LYS   4          HB1       LYS   4 -13.722  -7.239 -11.843
   59   2HB   LYS   4          HB2       LYS   4 -15.090  -6.949 -10.769
   60   1HG   LYS   4          HG1       LYS   4 -14.441  -4.485 -12.041
   61   2HG   LYS   4          HG2       LYS   4 -14.522  -5.729 -13.282
   62   1HD   LYS   4          HD1       LYS   4 -16.772  -6.042 -13.008
   63   2HD   LYS   4          HD2       LYS   4 -16.723  -5.660 -11.283
   64   1HE   LYS   4          HE1       LYS   4 -16.259  -3.551 -13.390
   65   2HE   LYS   4          HE2       LYS   4 -17.882  -3.963 -12.833
   66   1HZ   LYS   4          HZ1       LYS   4 -17.415  -3.221 -10.697
   67   2HZ   LYS   4          HZ2       LYS   4 -16.688  -2.059 -11.685
   68   3HZ   LYS   4          HZ3       LYS   4 -15.737  -3.242 -10.939
   69    H    LYS   5           HN       LYS   5 -13.159  -5.712  -7.717
   70    HA   LYS   5           HA       LYS   5 -15.065  -3.472  -7.452
   71   1HB   LYS   5          HB1       LYS   5 -14.540  -5.690  -5.456
   72   2HB   LYS   5          HB2       LYS   5 -15.572  -4.296  -5.166
   73   1HG   LYS   5          HG1       LYS   5 -16.801  -5.137  -7.341
   74   2HG   LYS   5          HG2       LYS   5 -16.050  -6.675  -6.908
   75   1HD   LYS   5          HD1       LYS   5 -17.332  -5.302  -4.649
   76   2HD   LYS   5          HD2       LYS   5 -18.453  -5.751  -5.934
   77   1HE   LYS   5          HE1       LYS   5 -18.333  -7.544  -4.305
   78   2HE   LYS   5          HE2       LYS   5 -17.602  -8.079  -5.818
   79   1HZ   LYS   5          HZ1       LYS   5 -16.428  -8.397  -3.477
   80   2HZ   LYS   5          HZ2       LYS   5 -15.830  -6.855  -3.855
   81   3HZ   LYS   5          HZ3       LYS   5 -15.552  -8.152  -4.908
   82    H    GLY   6           HN       GLY   6 -12.326  -5.013  -5.720
   83   1HA   GLY   6          HA1       GLY   6 -11.575  -2.804  -4.182
   84   2HA   GLY   6          HA2       GLY   6 -10.491  -4.090  -4.686
   85    H    ALA   7           HN       ALA   7 -10.980  -3.426  -7.586
   86    HA   ALA   7           HA       ALA   7  -8.849  -1.670  -8.028
   87   1HB   ALA   7          HB1       ALA   7 -11.024  -2.472  -9.963
   88   2HB   ALA   7          HB2       ALA   7  -9.544  -3.377  -9.643
   89   3HB   ALA   7          HB3       ALA   7  -9.456  -1.780 -10.382
   90    H    THR   8           HN       THR   8 -12.407  -0.978  -8.340
   91    HA   THR   8           HA       THR   8 -12.227   1.633  -9.199
   92    HB   THR   8           HB       THR   8 -14.312   1.837  -7.426
   93    HG1  THR   8           HG1      THR   8 -13.950  -0.437  -6.941
   94   1HG2  THR   8          HG21      THR   8 -15.740   1.398  -9.343
   95   2HG2  THR   8          HG22      THR   8 -14.397   0.637 -10.197
   96   3HG2  THR   8          HG23      THR   8 -14.348   2.363  -9.837
   97    H    LEU   9           HN       LEU   9 -11.695   0.522  -5.892
   98    HA   LEU   9           HA       LEU   9 -11.633   3.059  -4.641
   99   1HB   LEU   9          HB1       LEU   9 -10.949   0.265  -3.895
  100   2HB   LEU   9          HB2       LEU   9 -10.127   1.531  -2.987
  101    HG   LEU   9           HG       LEU   9 -12.091   1.080  -1.752
  102   1HD1  LEU   9          HD11      LEU   9 -13.417   3.141  -1.967
  103   2HD1  LEU   9          HD12      LEU   9 -12.667   3.451  -3.532
  104   3HD1  LEU   9          HD13      LEU   9 -11.687   3.473  -2.067
  105   1HD2  LEU   9          HD21      LEU   9 -14.360   1.111  -2.756
  106   2HD2  LEU   9          HD22      LEU   9 -13.366  -0.198  -3.392
  107   3HD2  LEU   9          HD23      LEU   9 -13.626   1.257  -4.354
  108    H    PHE  10           HN       PHE  10  -8.831   0.904  -4.747
  109    HA   PHE  10           HA       PHE  10  -6.764   2.610  -4.499
  110   1HB   PHE  10          HB1       PHE  10  -6.652   0.128  -4.692
  111   2HB   PHE  10          HB2       PHE  10  -6.801   0.289  -6.435
  112    HD1  PHE  10           HD1      PHE  10  -4.960   1.790  -7.610
  113    HD2  PHE  10           HD2      PHE  10  -4.559  -0.032  -3.735
  114    HE1  PHE  10           HE1      PHE  10  -2.478   1.922  -7.799
  115    HE2  PHE  10           HE2      PHE  10  -2.091   0.218  -3.872
  116    HZ   PHE  10           HZ       PHE  10  -1.043   1.170  -5.911
  117    H    LYS  11           HN       LYS  11  -8.507   2.050  -7.533
  118    HA   LYS  11           HA       LYS  11  -6.763   3.435  -9.246
  119   1HB   LYS  11          HB1       LYS  11  -8.961   1.825  -9.566
  120   2HB   LYS  11          HB2       LYS  11  -9.548   3.389 -10.132
  121   1HG   LYS  11          HG1       LYS  11  -7.900   3.547 -11.798
  122   2HG   LYS  11          HG2       LYS  11  -6.903   2.300 -11.055
  123   1HD   LYS  11          HD1       LYS  11  -9.609   1.797 -12.309
  124   2HD   LYS  11          HD2       LYS  11  -8.070   1.566 -13.141
  125   1HE   LYS  11          HE1       LYS  11  -8.847   0.151 -10.580
  126   2HE   LYS  11          HE2       LYS  11  -9.063  -0.535 -12.187
  127   1HZ   LYS  11          HZ1       LYS  11  -6.461   0.245 -10.978
  128   2HZ   LYS  11          HZ2       LYS  11  -6.670  -0.423 -12.516
  129   3HZ   LYS  11          HZ3       LYS  11  -7.041  -1.341 -11.146
  130    H    THR  12           HN       THR  12  -8.923   4.773  -6.990
  131    HA   THR  12           HA       THR  12  -8.459   7.462  -7.981
  132    HB   THR  12           HB       THR  12 -10.624   6.614  -8.882
  133    HG1  THR  12           HG1      THR  12 -10.463   8.962  -7.341
  134   1HG2  THR  12          HG21      THR  12 -12.627   6.737  -7.544
  135   2HG2  THR  12          HG22      THR  12 -11.679   7.089  -6.098
  136   3HG2  THR  12          HG23      THR  12 -11.544   5.513  -6.879
  137    H    ARG  13           HN       ARG  13  -7.455   5.840  -5.803
  138    HA   ARG  13           HA       ARG  13  -7.762   7.700  -3.566
  139   1HB   ARG  13          HB1       ARG  13  -8.078   4.705  -3.364
  140   2HB   ARG  13          HB2       ARG  13  -7.805   5.744  -1.981
  141   1HG   ARG  13          HG1       ARG  13 -10.172   6.036  -3.810
  142   2HG   ARG  13          HG2       ARG  13 -10.174   4.995  -2.394
  143   1HD   ARG  13          HD1       ARG  13 -11.233   7.155  -1.928
  144   2HD   ARG  13          HD2       ARG  13  -9.769   6.944  -0.959
  145    HE   ARG  13           HE       ARG  13  -9.823   8.124  -3.496
  146   1HH1  ARG  13          HH11      ARG  13  -9.424   8.578  -0.054
  147   2HH1  ARG  13          HH12      ARG  13  -8.363   9.939  -0.067
  148   1HH2  ARG  13          HH21      ARG  13  -8.169  10.186  -3.474
  149   2HH2  ARG  13          HH22      ARG  13  -7.691  10.833  -1.944
  150    H    CYS  14           HN       CYS  14  -5.900   5.310  -5.255
  151    HA   CYS  14           HA       CYS  14  -3.497   5.995  -3.694
  152   1HB   CYS  14          HB1       CYS  14  -3.898   3.294  -4.921
  153   2HB   CYS  14          HB2       CYS  14  -2.786   3.767  -3.656
  154    H    LEU  15           HN       LEU  15  -4.878   5.226  -6.841
  155    HA   LEU  15           HA       LEU  15  -2.682   4.929  -8.449
  156   1HB   LEU  15          HB1       LEU  15  -5.263   4.897  -8.922
  157   2HB   LEU  15          HB2       LEU  15  -4.995   6.565  -9.410
  158    HG   LEU  15           HG       LEU  15  -3.221   5.756 -10.999
  159   1HD1  LEU  15          HD11      LEU  15  -3.280   3.364 -11.637
  160   2HD1  LEU  15          HD12      LEU  15  -4.310   3.046 -10.240
  161   3HD1  LEU  15          HD13      LEU  15  -2.659   3.626 -10.006
  162   1HD2  LEU  15          HD21      LEU  15  -5.417   6.253 -11.871
  163   2HD2  LEU  15          HD22      LEU  15  -6.011   4.667 -11.381
  164   3HD2  LEU  15          HD23      LEU  15  -4.801   4.801 -12.658
  165    H    GLN  16           HN       GLN  16  -4.031   8.009  -7.329
  166    HA   GLN  16           HA       GLN  16  -2.870   9.916  -8.798
  167   1HB   GLN  16          HB1       GLN  16  -2.671  11.196  -6.529
  168   2HB   GLN  16          HB2       GLN  16  -4.242  10.730  -7.161
  169   1HG   GLN  16          HG1       GLN  16  -3.986   8.623  -5.685
  170   2HG   GLN  16          HG2       GLN  16  -2.710   9.532  -4.871
  171   1HE2  GLN  16          HE21      GLN  16  -3.316  11.456  -3.704
  172   2HE2  GLN  16          HE22      GLN  16  -4.956  11.728  -3.249
  173    H    CYS  17           HN       CYS  17  -1.048   8.006  -6.427
  174    HA   CYS  17           HA       CYS  17   1.426   9.329  -7.306
  175   1HB   CYS  17          HB1       CYS  17   1.430   8.115  -4.617
  176   2HB   CYS  17          HB2       CYS  17   2.161   9.595  -5.215
  177    H    HIS  18           HN       HIS  18  -0.028   6.248  -6.380
  178    HA   HIS  18           HA       HIS  18   2.457   4.768  -6.745
  179   1HB   HIS  18          HB1       HIS  18  -0.248   4.130  -5.625
  180   2HB   HIS  18          HB2       HIS  18   0.884   2.848  -6.014
  181    HD1  HIS  18           HD1      HIS  18   3.383   3.245  -4.671
  182    HD2  HIS  18           HD2      HIS  18  -0.133   4.961  -3.179
  183    HE1  HIS  18           HE1      HIS  18   3.797   3.664  -2.205
  184    H    THR  19           HN       THR  19   1.915   2.470  -7.589
  185    HA   THR  19           HA       THR  19   0.315   2.405 -10.024
  186    HB   THR  19           HB       THR  19   2.528   1.038 -10.820
  187    HG1  THR  19           HG1      THR  19   4.146   2.862 -10.392
  188   1HG2  THR  19          HG21      THR  19   3.114   3.086 -12.139
  189   2HG2  THR  19          HG22      THR  19   1.872   3.951 -11.235
  190   3HG2  THR  19          HG23      THR  19   1.426   2.592 -12.265
  191    H    VAL  20           HN       VAL  20  -0.958   0.615  -9.963
  192    HA   VAL  20           HA       VAL  20  -0.580  -1.444  -8.001
  193    HB   VAL  20           HB       VAL  20  -2.719  -0.283  -9.086
  194   1HG1  VAL  20          HG11      VAL  20  -2.573  -1.390 -11.227
  195   2HG1  VAL  20          HG12      VAL  20  -4.035  -1.874 -10.364
  196   3HG1  VAL  20          HG13      VAL  20  -2.654  -2.969 -10.438
  197   1HG2  VAL  20          HG21      VAL  20  -2.699  -2.997  -7.785
  198   2HG2  VAL  20          HG22      VAL  20  -4.118  -1.969  -7.978
  199   3HG2  VAL  20          HG23      VAL  20  -2.771  -1.430  -6.979
  200    H    GLU  21           HN       GLU  21   0.258  -1.180 -11.285
  201    HA   GLU  21           HA       GLU  21   0.780  -4.065 -11.572
  202   1HB   GLU  21          HB1       GLU  21   0.909  -3.221 -14.115
  203   2HB   GLU  21          HB2       GLU  21  -0.605  -3.716 -13.384
  204   1HG   GLU  21          HG1       GLU  21  -0.688  -1.601 -14.754
  205   2HG   GLU  21          HG2       GLU  21  -1.330  -1.470 -13.119
  206    H    LYS  22           HN       LYS  22   2.750  -4.177 -13.469
  207    HA   LYS  22           HA       LYS  22   4.826  -2.448 -12.361
  208   1HB   LYS  22          HB1       LYS  22   4.756  -5.213 -12.926
  209   2HB   LYS  22          HB2       LYS  22   5.997  -4.483 -13.960
  210   1HG   LYS  22          HG1       LYS  22   7.274  -3.808 -12.205
  211   2HG   LYS  22          HG2       LYS  22   5.880  -3.485 -11.177
  212   1HD   LYS  22          HD1       LYS  22   5.631  -5.809 -10.674
  213   2HD   LYS  22          HD2       LYS  22   6.854  -6.250 -11.867
  214   1HE   LYS  22          HE1       LYS  22   7.863  -6.388  -9.692
  215   2HE   LYS  22          HE2       LYS  22   8.546  -5.003 -10.523
  216   1HZ   LYS  22          HZ1       LYS  22   6.875  -3.637  -9.186
  217   2HZ   LYS  22          HZ2       LYS  22   8.170  -4.300  -8.330
  218   3HZ   LYS  22          HZ3       LYS  22   6.647  -5.022  -8.241
  219    H    GLY  23           HN       GLY  23   3.009  -1.612 -14.680
  220   1HA   GLY  23          HA1       GLY  23   5.020  -1.235 -16.794
  221   2HA   GLY  23          HA2       GLY  23   3.298  -0.932 -16.947
  222    H    GLY  24           HN       GLY  24   3.387   0.583 -14.318
  223   1HA   GLY  24          HA1       GLY  24   4.011   3.199 -15.390
  224   2HA   GLY  24          HA2       GLY  24   3.170   2.843 -13.890
  225    HA   PRO  25           HA       PRO  25   8.011   3.279 -13.320
  226   1HB   PRO  25          HB1       PRO  25   8.415   5.989 -13.583
  227   2HB   PRO  25          HB2       PRO  25   8.793   4.802 -14.835
  228   1HG   PRO  25          HG1       PRO  25   6.400   6.574 -14.560
  229   2HG   PRO  25          HG2       PRO  25   7.312   6.137 -16.018
  230   1HD   PRO  25          HD1       PRO  25   4.950   4.991 -15.416
  231   2HD   PRO  25          HD2       PRO  25   6.254   4.089 -16.217
  232    H    HIS  26           HN       HIS  26   8.875   4.191 -11.359
  233    HA   HIS  26           HA       HIS  26   7.094   4.450  -9.231
  234   1HB   HIS  26          HB1       HIS  26   9.990   5.247  -9.567
  235   2HB   HIS  26          HB2       HIS  26   9.151   5.352  -8.029
  236    HD2  HIS  26           HD2      HIS  26  11.242   3.037 -10.044
  237    HE1  HIS  26           HE1      HIS  26   9.444   0.559  -7.102
  238    HE2  HIS  26           HE2      HIS  26  11.270   0.710  -8.860
  239    H    LYS  27           HN       LYS  27   5.588   6.089  -9.215
  240    HA   LYS  27           HA       LYS  27   6.245   8.767 -10.086
  241   1HB   LYS  27          HB1       LYS  27   3.730   7.293  -9.399
  242   2HB   LYS  27          HB2       LYS  27   3.713   9.049  -9.455
  243   1HG   LYS  27          HG1       LYS  27   4.135   9.121 -11.740
  244   2HG   LYS  27          HG2       LYS  27   4.854   7.506 -11.758
  245   1HD   LYS  27          HD1       LYS  27   2.359   7.993 -12.649
  246   2HD   LYS  27          HD2       LYS  27   2.823   6.456 -11.908
  247   1HE   LYS  27          HE1       LYS  27   2.151   7.548  -9.675
  248   2HE   LYS  27          HE2       LYS  27   1.348   8.770 -10.662
  249   1HZ   LYS  27          HZ1       LYS  27   0.248   6.756 -11.782
  250   2HZ   LYS  27          HZ2       LYS  27  -0.311   7.237 -10.262
  251   3HZ   LYS  27          HZ3       LYS  27   0.720   5.904 -10.393
  252    H    VAL  28           HN       VAL  28   4.200   9.726  -7.921
  253    HA   VAL  28           HA       VAL  28   6.031  10.811  -6.088
  254    HB   VAL  28           HB       VAL  28   3.081  10.454  -5.575
  255   1HG1  VAL  28          HG11      VAL  28   5.010  12.622  -4.723
  256   2HG1  VAL  28          HG12      VAL  28   4.427  11.312  -3.697
  257   3HG1  VAL  28          HG13      VAL  28   3.299  12.524  -4.305
  258   1HG2  VAL  28          HG21      VAL  28   3.334  11.449  -7.813
  259   2HG2  VAL  28          HG22      VAL  28   4.390  12.691  -7.141
  260   3HG2  VAL  28          HG23      VAL  28   2.696  12.620  -6.657
  261    H    GLY  29           HN       GLY  29   4.435   7.772  -6.208
  262   1HA   GLY  29          HA1       GLY  29   5.524   6.950  -3.595
  263   2HA   GLY  29          HA2       GLY  29   3.933   6.444  -4.138
  264    HA   PRO  30           HA       PRO  30   7.528   3.607  -5.693
  265   1HB   PRO  30          HB1       PRO  30   7.432   1.639  -3.833
  266   2HB   PRO  30          HB2       PRO  30   8.478   3.056  -3.686
  267   1HG   PRO  30          HG1       PRO  30   5.803   2.542  -2.436
  268   2HG   PRO  30          HG2       PRO  30   7.273   3.204  -1.695
  269   1HD   PRO  30          HD1       PRO  30   5.240   4.781  -2.498
  270   2HD   PRO  30          HD2       PRO  30   6.934   5.303  -2.598
  271    H    ASN  31           HN       ASN  31   7.263   1.528  -6.677
  272    HA   ASN  31           HA       ASN  31   4.614   0.932  -7.500
  273   1HB   ASN  31          HB1       ASN  31   6.623   0.689  -8.929
  274   2HB   ASN  31          HB2       ASN  31   7.199  -0.614  -7.898
  275   1HD2  ASN  31          HD21      ASN  31   4.784   0.264 -10.303
  276   2HD2  ASN  31          HD22      ASN  31   4.369  -1.372 -10.696
  277    H    LEU  32           HN       LEU  32   3.141  -0.271  -6.447
  278    HA   LEU  32           HA       LEU  32   3.738  -1.690  -4.008
  279   1HB   LEU  32          HB1       LEU  32   1.147  -0.940  -5.366
  280   2HB   LEU  32          HB2       LEU  32   1.248  -1.738  -3.809
  281    HG   LEU  32           HG       LEU  32   2.249   1.049  -4.456
  282   1HD1  LEU  32          HD11      LEU  32   0.511   1.722  -2.813
  283   2HD1  LEU  32          HD12      LEU  32  -0.040   0.048  -2.753
  284   3HD1  LEU  32          HD13      LEU  32  -0.164   0.961  -4.255
  285   1HD2  LEU  32          HD21      LEU  32   3.659  -0.152  -2.757
  286   2HD2  LEU  32          HD22      LEU  32   2.214  -0.308  -1.758
  287   3HD2  LEU  32          HD23      LEU  32   2.847   1.291  -2.150
  288    H    HIS  33           HN       HIS  33   3.227  -2.594  -7.262
  289    HA   HIS  33           HA       HIS  33   2.017  -5.115  -7.100
  290   1HB   HIS  33          HB1       HIS  33   2.271  -3.675  -9.137
  291   2HB   HIS  33          HB2       HIS  33   3.980  -4.097  -9.165
  292    HD2  HIS  33           HD2      HIS  33   1.110  -6.626  -8.492
  293    HE1  HIS  33           HE1      HIS  33   2.898  -7.679 -12.200
  294    HE2  HIS  33           HE2      HIS  33   1.231  -8.392 -10.419
  295    H    GLY  34           HN       GLY  34   2.922  -6.416  -5.540
  296   1HA   GLY  34          HA1       GLY  34   4.309  -8.371  -5.306
  297   2HA   GLY  34          HA2       GLY  34   5.625  -7.473  -6.034
  298    H    ILE  35           HN       ILE  35   3.737  -5.861  -3.510
  299    HA   ILE  35           HA       ILE  35   6.109  -5.732  -1.905
  300    HB   ILE  35           HB       ILE  35   4.840  -4.464  -0.262
  301   1HG1  ILE  35          HG11      ILE  35   2.475  -5.190  -1.928
  302   2HG1  ILE  35          HG12      ILE  35   2.591  -4.909  -0.192
  303   1HG2  ILE  35          HG21      ILE  35   4.642  -3.485  -3.103
  304   2HG2  ILE  35          HG22      ILE  35   6.068  -3.429  -2.067
  305   3HG2  ILE  35          HG23      ILE  35   4.642  -2.476  -1.656
  306   1HD1  ILE  35          HD11      ILE  35   2.780  -2.460  -0.663
  307   2HD1  ILE  35          HD12      ILE  35   1.242  -3.169  -1.158
  308   3HD1  ILE  35          HD13      ILE  35   2.476  -2.814  -2.365
  309    H    PHE  36           HN       PHE  36   3.241  -7.762  -1.749
  310    HA   PHE  36           HA       PHE  36   3.406  -8.621   0.889
  311   1HB   PHE  36          HB1       PHE  36   2.376 -10.082  -1.546
  312   2HB   PHE  36          HB2       PHE  36   2.148 -10.634   0.113
  313    HD1  PHE  36           HD1      PHE  36   1.327  -8.543   1.712
  314    HD2  PHE  36           HD2      PHE  36   0.502  -9.073  -2.477
  315    HE1  PHE  36           HE1      PHE  36  -0.666  -7.070   1.926
  316    HE2  PHE  36           HE2      PHE  36  -1.492  -7.601  -2.267
  317    HZ   PHE  36           HZ       PHE  36  -2.071  -6.590  -0.069
  318    H    GLY  37           HN       GLY  37   4.985  -9.484   1.906
  319   1HA   GLY  37          HA1       GLY  37   6.302 -11.410   2.447
  320   2HA   GLY  37          HA2       GLY  37   6.662 -11.602   0.742
  321    H    ARG  38           HN       ARG  38   6.989  -8.384   1.114
  322    HA   ARG  38           HA       ARG  38   9.877  -8.518   1.678
  323   1HB   ARG  38          HB1       ARG  38   8.186  -6.718  -0.065
  324   2HB   ARG  38          HB2       ARG  38   9.803  -6.241   0.432
  325   1HG   ARG  38          HG1       ARG  38  10.826  -7.783  -0.914
  326   2HG   ARG  38          HG2       ARG  38   9.476  -8.917  -0.827
  327   1HD   ARG  38          HD1       ARG  38   9.470  -8.079  -3.051
  328   2HD   ARG  38          HD2       ARG  38   8.159  -7.240  -2.220
  329    HE   ARG  38           HE       ARG  38  10.438  -6.392  -1.936
  330   1HH1  ARG  38          HH21      ARG  38   7.829  -6.232  -4.182
  331   2HH1  ARG  38          HH22      ARG  38   7.977  -4.573  -4.460
  332   1HH2  ARG  38          HH11      ARG  38  10.906  -3.867  -3.166
  333   2HH2  ARG  38          HH12      ARG  38   9.932  -3.748  -4.568
  334    H    HIS  39           HN       HIS  39  10.772  -6.506   2.653
  335    HA   HIS  39           HA       HIS  39   9.185  -5.755   4.973
  336   1HB   HIS  39          HB1       HIS  39  12.066  -5.057   4.326
  337   2HB   HIS  39          HB2       HIS  39  11.274  -4.941   5.900
  338    HD2  HIS  39           HD2      HIS  39  10.454  -7.378   7.008
  339    HE1  HIS  39           HE1      HIS  39  13.202  -9.738   4.777
  340    HE2  HIS  39           HE2      HIS  39  11.550  -9.734   6.706
  341    H    SER  40           HN       SER  40   8.943  -3.492   5.617
  342    HA   SER  40           HA       SER  40   8.177  -1.733   3.602
  343   1HB   SER  40          HB1       SER  40   9.080  -0.582   6.207
  344   2HB   SER  40          HB2       SER  40   7.695  -0.150   5.214
  345    HG   SER  40           HG       SER  40   6.913  -2.348   5.873
  346    H    GLY  41           HN       GLY  41   9.186  -0.327   2.350
  347   1HA   GLY  41          HA1       GLY  41  10.827   1.218   1.714
  348   2HA   GLY  41          HA2       GLY  41  11.824   0.697   3.051
  349    H    GLN  42           HN       GLN  42  10.587  -1.497   0.459
  350    HA   GLN  42           HA       GLN  42  13.376  -1.779  -0.409
  351   1HB   GLN  42          HB1       GLN  42  11.400  -4.032  -0.151
  352   2HB   GLN  42          HB2       GLN  42  13.049  -4.176  -0.748
  353   1HG   GLN  42          HG1       GLN  42  13.912  -3.418   1.421
  354   2HG   GLN  42          HG2       GLN  42  12.265  -3.259   2.024
  355   1HE2  GLN  42          HE21      GLN  42  14.472  -4.978   3.010
  356   2HE2  GLN  42          HE22      GLN  42  13.862  -6.590   2.943
  357    H    ALA  43           HN       ALA  43  11.206  -0.183  -1.849
  358    HA   ALA  43           HA       ALA  43  10.424  -1.465  -4.195
  359   1HB   ALA  43          HB1       ALA  43   9.481   0.632  -3.420
  360   2HB   ALA  43          HB2       ALA  43  10.035   0.769  -5.088
  361   3HB   ALA  43          HB3       ALA  43  10.994   1.462  -3.781
  362    H    GLU  44           HN       GLU  44  11.252  -1.804  -6.188
  363    HA   GLU  44           HA       GLU  44  14.035  -1.916  -6.583
  364   1HB   GLU  44          HB1       GLU  44  12.018  -2.302  -8.798
  365   2HB   GLU  44          HB2       GLU  44  13.583  -3.082  -8.586
  366   1HG   GLU  44          HG1       GLU  44  12.206  -4.788  -7.918
  367   2HG   GLU  44          HG2       GLU  44  12.497  -4.008  -6.376
  368    H    GLY  45           HN       GLY  45  14.642   0.294  -6.212
  369   1HA   GLY  45          HA1       GLY  45  15.919   1.936  -7.387
  370   2HA   GLY  45          HA2       GLY  45  14.731   1.906  -8.672
  371    H    TYR  46           HN       TYR  46  13.715   2.170  -5.318
  372    HA   TYR  46           HA       TYR  46  13.305   5.051  -5.551
  373   1HB   TYR  46          HB1       TYR  46  11.253   3.990  -6.259
  374   2HB   TYR  46          HB2       TYR  46  11.184   3.063  -4.767
  375    HD1  TYR  46           HD1      TYR  46  10.640   6.347  -6.326
  376    HD2  TYR  46           HD2      TYR  46  10.626   4.138  -2.641
  377    HE1  TYR  46           HE1      TYR  46   9.231   8.118  -5.285
  378    HE2  TYR  46           HE2      TYR  46   9.125   5.842  -1.615
  379    HH   TYR  46           HH       TYR  46   7.583   8.307  -3.507
  380    H    SER  47           HN       SER  47  13.340   6.255  -3.680
  381    HA   SER  47           HA       SER  47  14.548   4.990  -1.341
  382   1HB   SER  47          HB1       SER  47  14.519   7.830  -1.096
  383   2HB   SER  47          HB2       SER  47  15.902   6.761  -1.337
  384    HG   SER  47           HG       SER  47  15.547   6.898  -3.572
  385    H    TYR  48           HN       TYR  48  13.825   5.195   0.680
  386    HA   TYR  48           HA       TYR  48  11.142   6.210   1.273
  387   1HB   TYR  48          HB1       TYR  48  12.729   3.863   2.311
  388   2HB   TYR  48          HB2       TYR  48  11.223   4.400   3.045
  389    HD1  TYR  48           HD1      TYR  48   9.106   4.007   2.023
  390    HD2  TYR  48           HD2      TYR  48  12.732   2.920  -0.017
  391    HE1  TYR  48           HE1      TYR  48   7.797   2.558   0.484
  392    HE2  TYR  48           HE2      TYR  48  11.434   1.468  -1.562
  393    HH   TYR  48           HH       TYR  48   8.423   0.339  -0.839
  394    H    THR  49           HN       THR  49  10.793   7.022   3.558
  395    HA   THR  49           HA       THR  49  12.759   8.908   4.403
  396    HB   THR  49           HB       THR  49  11.169   9.111   6.442
  397    HG1  THR  49           HG1      THR  49   9.301   7.964   4.700
  398   1HG2  THR  49          HG21      THR  49  11.270  10.812   4.782
  399   2HG2  THR  49          HG22      THR  49   9.571  10.458   5.099
  400   3HG2  THR  49          HG23      THR  49  10.346   9.831   3.643
  401    H    ASP  50           HN       ASP  50  13.272   9.172   6.799
  402    HA   ASP  50           HA       ASP  50  14.963   7.145   7.692
  403   1HB   ASP  50          HB1       ASP  50  15.316   9.467   8.241
  404   2HB   ASP  50          HB2       ASP  50  13.779   9.547   9.099
  405    H    ALA  51           HN       ALA  51  11.599   7.777   8.488
  406    HA   ALA  51           HA       ALA  51  11.511   5.972  10.727
  407   1HB   ALA  51          HB1       ALA  51   9.234   6.744  10.980
  408   2HB   ALA  51          HB2       ALA  51   9.287   7.514   9.393
  409   3HB   ALA  51          HB3       ALA  51  10.303   8.120  10.700
  410    H    ASN  52           HN       ASN  52  10.483   5.787   7.300
  411    HA   ASN  52           HA       ASN  52   8.884   3.445   7.685
  412   1HB   ASN  52          HB1       ASN  52   8.199   4.684   5.858
  413   2HB   ASN  52          HB2       ASN  52   9.843   5.022   5.331
  414   1HD2  ASN  52          HD21      ASN  52   7.123   2.972   4.874
  415   2HD2  ASN  52          HD22      ASN  52   7.883   1.978   3.685
  416    H    ILE  53           HN       ILE  53  12.247   3.979   6.738
  417    HA   ILE  53           HA       ILE  53  12.870   1.308   6.077
  418    HB   ILE  53           HB       ILE  53  14.625   3.579   6.961
  419   1HG1  ILE  53          HG11      ILE  53  14.176   2.470   4.171
  420   2HG1  ILE  53          HG12      ILE  53  13.288   3.846   4.818
  421   1HG2  ILE  53          HG21      ILE  53  15.808   1.468   7.337
  422   2HG2  ILE  53          HG22      ILE  53  16.513   2.331   5.970
  423   3HG2  ILE  53          HG23      ILE  53  15.446   0.956   5.687
  424   1HD1  ILE  53          HD11      ILE  53  15.391   5.091   5.059
  425   2HD1  ILE  53          HD12      ILE  53  15.133   4.578   3.393
  426   3HD1  ILE  53          HD13      ILE  53  16.281   3.712   4.412
  427    H    LYS  54           HN       LYS  54  14.074   3.004   9.029
  428    HA   LYS  54           HA       LYS  54  14.689   1.015  10.692
  429   1HB   LYS  54          HB1       LYS  54  13.073   3.474  11.349
  430   2HB   LYS  54          HB2       LYS  54  13.838   2.442  12.561
  431   1HG   LYS  54          HG1       LYS  54  16.032   2.874  11.619
  432   2HG   LYS  54          HG2       LYS  54  15.315   3.812  10.305
  433   1HD   LYS  54          HD1       LYS  54  14.420   5.410  11.997
  434   2HD   LYS  54          HD2       LYS  54  15.286   4.507  13.250
  435   1HE   LYS  54          HE1       LYS  54  17.398   5.069  12.351
  436   2HE   LYS  54          HE2       LYS  54  16.696   5.590  10.817
  437   1HZ   LYS  54          HZ1       LYS  54  15.624   7.423  12.039
  438   2HZ   LYS  54          HZ2       LYS  54  17.317   7.491  12.076
  439   3HZ   LYS  54          HZ3       LYS  54  16.466   6.950  13.435
  440    H    LYS  55           HN       LYS  55  11.530   1.356   9.432
  441    HA   LYS  55           HA       LYS  55  10.141  -0.060  11.545
  442   1HB   LYS  55          HB1       LYS  55   9.082   1.791  10.407
  443   2HB   LYS  55          HB2       LYS  55   9.246   0.987   8.864
  444   1HG   LYS  55          HG1       LYS  55   7.035   0.682   9.313
  445   2HG   LYS  55          HG2       LYS  55   7.716  -0.817   9.918
  446   1HD   LYS  55          HD1       LYS  55   7.143   1.533  11.716
  447   2HD   LYS  55          HD2       LYS  55   5.922   0.322  11.330
  448   1HE   LYS  55          HE1       LYS  55   8.592  -0.223  12.646
  449   2HE   LYS  55          HE2       LYS  55   7.035  -0.154  13.473
  450   1HZ   LYS  55          HZ1       LYS  55   7.922  -2.147  11.459
  451   2HZ   LYS  55          HZ2       LYS  55   6.316  -1.996  11.960
  452   3HZ   LYS  55          HZ3       LYS  55   7.508  -2.420  13.080
  453    H    ASN  56           HN       ASN  56  11.311  -0.847   8.336
  454    HA   ASN  56           HA       ASN  56  11.112  -2.637   6.960
  455   1HB   ASN  56          HB1       ASN  56  12.907  -3.062   9.210
  456   2HB   ASN  56          HB2       ASN  56  12.439  -4.562   8.441
  457   1HD2  ASN  56          HD21      ASN  56  13.959  -1.371   7.726
  458   2HD2  ASN  56          HD22      ASN  56  14.574  -2.047   6.280
  459    H    VAL  57           HN       VAL  57   8.582  -2.562   8.064
  460    HA   VAL  57           HA       VAL  57   7.857  -5.044   9.276
  461    HB   VAL  57           HB       VAL  57   6.619  -2.589   8.942
  462   1HG1  VAL  57          HG11      VAL  57   4.909  -4.670   7.582
  463   2HG1  VAL  57          HG12      VAL  57   5.523  -3.188   6.850
  464   3HG1  VAL  57          HG13      VAL  57   4.351  -3.101   8.165
  465   1HG2  VAL  57          HG21      VAL  57   6.599  -4.033  10.876
  466   2HG2  VAL  57          HG22      VAL  57   5.573  -5.191  10.029
  467   3HG2  VAL  57          HG23      VAL  57   4.952  -3.590  10.425
  468    H    LEU  58           HN       LEU  58   7.265  -6.943   8.353
  469    HA   LEU  58           HA       LEU  58   7.639  -7.189   5.500
  470   1HB   LEU  58          HB1       LEU  58   8.598  -8.844   7.092
  471   2HB   LEU  58          HB2       LEU  58   6.966  -9.340   7.518
  472    HG   LEU  58           HG       LEU  58   7.665  -9.399   4.618
  473   1HD1  LEU  58          HD11      LEU  58   9.674 -10.348   5.635
  474   2HD1  LEU  58          HD12      LEU  58   8.724 -11.609   4.849
  475   3HD1  LEU  58          HD13      LEU  58   8.684 -11.441   6.604
  476   1HD2  LEU  58          HD21      LEU  58   6.397 -11.557   4.755
  477   2HD2  LEU  58          HD22      LEU  58   5.455 -10.140   5.219
  478   3HD2  LEU  58          HD23      LEU  58   6.099 -11.214   6.460
  479    H    TRP  59           HN       TRP  59   6.018  -6.359   4.367
  480    HA   TRP  59           HA       TRP  59   3.352  -6.107   5.056
  481   1HB   TRP  59          HB1       TRP  59   4.554  -6.389   2.302
  482   2HB   TRP  59          HB2       TRP  59   2.953  -5.764   2.647
  483    HD1  TRP  59           HD1      TRP  59   6.188  -4.579   1.738
  484    HE1  TRP  59           HE1      TRP  59   6.540  -2.114   2.411
  485    HE3  TRP  59           HE3      TRP  59   2.244  -3.970   4.937
  486    HZ2  TRP  59           HZ2      TRP  59   5.411  -0.189   4.198
  487    HZ3  TRP  59           HZ3      TRP  59   1.893  -1.812   6.077
  488    HH2  TRP  59           HH2      TRP  59   3.444   0.076   5.725
  489    H    ASP  60           HN       ASP  60   2.007  -7.613   5.547
  490    HA   ASP  60           HA       ASP  60   1.697 -10.098   4.035
  491   1HB   ASP  60          HB1       ASP  60   2.273 -11.183   5.904
  492   2HB   ASP  60          HB2       ASP  60   2.387  -9.673   6.790
  493    H    GLU  61           HN       GLU  61  -0.632 -11.003   5.095
  494    HA   GLU  61           HA       GLU  61  -2.595  -9.365   3.822
  495   1HB   GLU  61          HB1       GLU  61  -2.457 -12.012   4.160
  496   2HB   GLU  61          HB2       GLU  61  -3.430 -11.635   5.578
  497   1HG   GLU  61          HG1       GLU  61  -5.162 -11.858   4.147
  498   2HG   GLU  61          HG2       GLU  61  -4.748 -10.205   3.685
  499    H    ASN  62           HN       ASN  62  -2.197 -10.410   7.227
  500    HA   ASN  62           HA       ASN  62  -4.176  -8.645   8.243
  501   1HB   ASN  62          HB1       ASN  62  -3.678 -10.697   9.372
  502   2HB   ASN  62          HB2       ASN  62  -1.985 -10.265   9.546
  503   1HD2  ASN  62          HD21      ASN  62  -1.397  -8.801  11.156
  504   2HD2  ASN  62          HD22      ASN  62  -2.479  -8.363  12.429
  505    H    ASN  63           HN       ASN  63  -0.573  -8.404   8.266
  506    HA   ASN  63           HA       ASN  63  -0.350  -5.968   9.571
  507   1HB   ASN  63          HB1       ASN  63   1.619  -7.122   9.362
  508   2HB   ASN  63          HB2       ASN  63   1.345  -7.520   7.678
  509   1HD2  ASN  63          HD21      ASN  63   2.097  -4.681   9.756
  510   2HD2  ASN  63          HD22      ASN  63   2.862  -3.922   8.403
  511    H    MET  64           HN       MET  64  -0.863  -6.366   6.004
  512    HA   MET  64           HA       MET  64  -0.512  -3.728   5.255
  513   1HB   MET  64          HB1       MET  64  -1.374  -6.030   4.032
  514   2HB   MET  64          HB2       MET  64  -2.788  -4.992   3.924
  515   1HG   MET  64          HG1       MET  64  -0.257  -3.701   3.204
  516   2HG   MET  64          HG2       MET  64  -0.718  -5.032   2.160
  517   1HE   MET  64          HE1       MET  64  -3.018  -5.121   0.830
  518   2HE   MET  64          HE2       MET  64  -4.177  -3.792   0.767
  519   3HE   MET  64          HE3       MET  64  -3.967  -4.708   2.260
  520    H    SER  65           HN       SER  65  -3.449  -5.109   6.740
  521    HA   SER  65           HA       SER  65  -4.988  -2.727   6.616
  522   1HB   SER  65          HB1       SER  65  -5.502  -4.771   8.728
  523   2HB   SER  65          HB2       SER  65  -6.641  -3.866   7.741
  524    HG   SER  65           HG       SER  65  -5.216  -6.196   7.152
  525    H    GLU  66           HN       GLU  66  -2.823  -4.009   9.108
  526    HA   GLU  66           HA       GLU  66  -3.362  -2.313  11.225
  527   1HB   GLU  66          HB1       GLU  66  -1.872  -3.943  11.825
  528   2HB   GLU  66          HB2       GLU  66  -1.038  -3.898  10.275
  529   1HG   GLU  66          HG1       GLU  66  -0.118  -1.625  11.052
  530   2HG   GLU  66          HG2       GLU  66  -0.653  -2.114  12.659
  531    H    TYR  67           HN       TYR  67  -1.174  -1.793   8.497
  532    HA   TYR  67           HA       TYR  67  -0.467   0.906   9.161
  533   1HB   TYR  67          HB1       TYR  67   1.193  -0.402   8.134
  534   2HB   TYR  67          HB2       TYR  67   0.101  -0.956   6.878
  535    HD1  TYR  67           HD1      TYR  67  -0.140   0.245   4.822
  536    HD2  TYR  67           HD2      TYR  67   2.056   1.938   8.102
  537    HE1  TYR  67           HE1      TYR  67   0.872   1.914   3.275
  538    HE2  TYR  67           HE2      TYR  67   3.119   3.579   6.567
  539    HH   TYR  67           HH       TYR  67   2.129   3.911   3.222
  540    H    LEU  68           HN       LEU  68  -2.677  -0.572   6.719
  541    HA   LEU  68           HA       LEU  68  -3.222   1.770   5.307
  542   1HB   LEU  68          HB1       LEU  68  -4.823  -0.710   5.801
  543   2HB   LEU  68          HB2       LEU  68  -5.485   0.617   4.864
  544    HG   LEU  68           HG       LEU  68  -3.116  -1.127   4.193
  545   1HD1  LEU  68          HD11      LEU  68  -5.251  -2.002   3.565
  546   2HD1  LEU  68          HD12      LEU  68  -4.523  -1.343   2.100
  547   3HD1  LEU  68          HD13      LEU  68  -5.781  -0.439   2.943
  548   1HD2  LEU  68          HD21      LEU  68  -2.334   1.070   3.576
  549   2HD2  LEU  68          HD22      LEU  68  -3.914   1.511   2.931
  550   3HD2  LEU  68          HD23      LEU  68  -2.934   0.299   2.107
  551    H    THR  69           HN       THR  69  -4.781   0.685   8.340
  552    HA   THR  69           HA       THR  69  -6.901   2.514   8.351
  553    HB   THR  69           HB       THR  69  -5.578   1.644  10.891
  554    HG1  THR  69           HG1      THR  69  -5.733  -0.271   9.920
  555   1HG2  THR  69          HG21      THR  69  -7.944   1.375  11.611
  556   2HG2  THR  69          HG22      THR  69  -8.462   2.022  10.054
  557   3HG2  THR  69          HG23      THR  69  -7.551   3.038  11.171
  558    H    ASN  70           HN       ASN  70  -3.538   2.985   9.338
  559    HA   ASN  70           HA       ASN  70  -3.771   5.802   9.113
  560   1HB   ASN  70          HB1       ASN  70  -4.785   5.308  11.411
  561   2HB   ASN  70          HB2       ASN  70  -3.151   4.900  11.925
  562   1HD2  ASN  70          HD21      ASN  70  -4.729   7.023  12.998
  563   2HD2  ASN  70          HD22      ASN  70  -3.691   8.379  12.734
  564    HA   PRO  71           HA       PRO  71   0.457   4.240   8.135
  565   1HB   PRO  71          HB1       PRO  71   0.946   6.309   6.385
  566   2HB   PRO  71          HB2       PRO  71   0.207   4.771   5.929
  567   1HG   PRO  71          HG1       PRO  71  -1.096   7.395   6.535
  568   2HG   PRO  71          HG2       PRO  71  -1.475   6.223   5.258
  569   1HD   PRO  71          HD1       PRO  71  -2.956   6.397   7.489
  570   2HD   PRO  71          HD2       PRO  71  -2.639   4.835   6.705
  571    H    LYS  72           HN       LYS  72  -0.519   7.617   8.673
  572    HA   LYS  72           HA       LYS  72   1.957   8.663   9.465
  573   1HB   LYS  72          HB1       LYS  72  -0.859   9.559  10.069
  574   2HB   LYS  72          HB2       LYS  72   0.559  10.467  10.567
  575   1HG   LYS  72          HG1       LYS  72   1.128  11.022   8.368
  576   2HG   LYS  72          HG2       LYS  72   0.120   9.750   7.688
  577   1HD   LYS  72          HD1       LYS  72  -1.892  10.999   8.426
  578   2HD   LYS  72          HD2       LYS  72  -0.844  12.289   9.018
  579   1HE   LYS  72          HE1       LYS  72  -0.135  12.856   6.843
  580   2HE   LYS  72          HE2       LYS  72  -0.737  11.353   6.163
  581   1HZ   LYS  72          HZ1       LYS  72  -2.242  13.762   6.942
  582   2HZ   LYS  72          HZ2       LYS  72  -3.017  12.264   6.844
  583   3HZ   LYS  72          HZ3       LYS  72  -2.265  12.906   5.475
  584    H    LYS  73           HN       LYS  73  -0.528   7.013  11.348
  585    HA   LYS  73           HA       LYS  73   0.720   7.618  13.863
  586   1HB   LYS  73          HB1       LYS  73  -1.672   7.283  13.800
  587   2HB   LYS  73          HB2       LYS  73  -1.467   5.651  13.180
  588   1HG   LYS  73          HG1       LYS  73  -2.022   5.569  15.533
  589   2HG   LYS  73          HG2       LYS  73  -0.379   4.992  15.292
  590   1HD   LYS  73          HD1       LYS  73   0.139   7.583  15.817
  591   2HD   LYS  73          HD2       LYS  73  -1.364   7.404  16.718
  592   1HE   LYS  73          HE1       LYS  73   0.341   6.921  18.270
  593   2HE   LYS  73          HE2       LYS  73  -0.297   5.351  17.793
  594   1HZ   LYS  73          HZ1       LYS  73   1.604   5.388  16.096
  595   2HZ   LYS  73          HZ2       LYS  73   1.974   5.059  17.711
  596   3HZ   LYS  73          HZ3       LYS  73   2.271   6.596  17.079
  597    H    TYR  74           HN       TYR  74   0.743   4.779  11.729
  598    HA   TYR  74           HA       TYR  74   2.379   3.173  13.416
  599   1HB   TYR  74          HB1       TYR  74   0.828   2.388  11.589
  600   2HB   TYR  74          HB2       TYR  74   2.047   2.915  10.432
  601    HD1  TYR  74           HD1      TYR  74   3.016   0.952   9.498
  602    HD2  TYR  74           HD2      TYR  74   2.385   1.287  13.737
  603    HE1  TYR  74           HE1      TYR  74   4.175  -1.233   9.842
  604    HE2  TYR  74           HE2      TYR  74   3.527  -0.884  14.095
  605    HH   TYR  74           HH       TYR  74   3.856  -3.055  12.516
  606    H    ILE  75           HN       ILE  75   3.112   5.141  10.580
  607    HA   ILE  75           HA       ILE  75   5.987   5.047  11.196
  608    HB   ILE  75           HB       ILE  75   4.786   5.320   8.430
  609   1HG1  ILE  75          HG11      ILE  75   6.024   2.898   9.790
  610   2HG1  ILE  75          HG12      ILE  75   4.369   3.040   9.216
  611   1HG2  ILE  75          HG21      ILE  75   7.626   4.963   9.429
  612   2HG2  ILE  75          HG22      ILE  75   6.947   6.403   8.672
  613   3HG2  ILE  75          HG23      ILE  75   7.150   4.926   7.731
  614   1HD1  ILE  75          HD11      ILE  75   5.510   1.685   7.647
  615   2HD1  ILE  75          HD12      ILE  75   6.885   2.787   7.575
  616   3HD1  ILE  75          HD13      ILE  75   5.337   3.262   6.878
  617    HA   PRO  76           HA       PRO  76   4.488   9.381  11.744
  618   1HB   PRO  76          HB1       PRO  76   6.160   9.935  13.815
  619   2HB   PRO  76          HB2       PRO  76   4.584   9.162  14.024
  620   1HG   PRO  76          HG1       PRO  76   7.307   7.928  13.950
  621   2HG   PRO  76          HG2       PRO  76   5.937   7.559  15.014
  622   1HD   PRO  76          HD1       PRO  76   6.579   6.043  12.856
  623   2HD   PRO  76          HD2       PRO  76   4.915   6.227  13.443
  624    H    GLY  77           HN       GLY  77   5.339  10.345   9.951
  625   1HA   GLY  77          HA1       GLY  77   6.950  12.081   9.375
  626   2HA   GLY  77          HA2       GLY  77   8.209  11.028   9.989
  627    H    THR  78           HN       THR  78   5.761   9.503   8.072
  628    HA   THR  78           HA       THR  78   7.653   8.907   5.951
  629    HB   THR  78           HB       THR  78   6.014   7.297   7.209
  630    HG1  THR  78           HG1      THR  78   7.222   7.226   4.822
  631   1HG2  THR  78          HG21      THR  78   4.045   6.669   5.960
  632   2HG2  THR  78          HG22      THR  78   4.308   7.985   4.817
  633   3HG2  THR  78          HG23      THR  78   3.896   8.344   6.494
  634    H    LYS  79           HN       LYS  79   7.204   9.076   3.727
  635    HA   LYS  79           HA       LYS  79   6.107  11.555   2.902
  636   1HB   LYS  79          HB1       LYS  79   6.996   9.122   1.358
  637   2HB   LYS  79          HB2       LYS  79   6.491  10.618   0.590
  638   1HG   LYS  79          HG1       LYS  79   8.343  11.784   1.817
  639   2HG   LYS  79          HG2       LYS  79   8.897  10.191   2.360
  640   1HD   LYS  79          HD1       LYS  79   8.377  10.190  -0.495
  641   2HD   LYS  79          HD2       LYS  79   9.541  11.451  -0.066
  642   1HE   LYS  79          HE1       LYS  79  11.012   9.718  -0.250
  643   2HE   LYS  79          HE2       LYS  79  10.520   9.448   1.422
  644   1HZ   LYS  79          HZ1       LYS  79   9.295   7.631   0.865
  645   2HZ   LYS  79          HZ2       LYS  79  10.472   7.531  -0.342
  646   3HZ   LYS  79          HZ3       LYS  79   8.958   8.183  -0.702
  647    H    MET  80           HN       MET  80   4.452   8.550   3.440
  648    HA   MET  80           HA       MET  80   2.401   9.083   1.487
  649   1HB   MET  80          HB1       MET  80   2.733   6.814   1.618
  650   2HB   MET  80          HB2       MET  80   2.956   6.835   3.371
  651   1HG   MET  80          HG1       MET  80   0.707   6.933   3.807
  652   2HG   MET  80          HG2       MET  80   0.323   7.650   2.254
  653   1HE   MET  80          HE1       MET  80  -1.752   4.285   2.587
  654   2HE   MET  80          HE2       MET  80  -1.871   6.033   2.386
  655   3HE   MET  80          HE3       MET  80  -1.246   5.360   3.891
  656    H    ALA  81           HN       ALA  81   1.655  11.055   2.081
  657    HA   ALA  81           HA       ALA  81   0.447  11.531   4.646
  658   1HB   ALA  81          HB1       ALA  81   1.929  13.153   3.481
  659   2HB   ALA  81          HB2       ALA  81   0.388  13.811   4.030
  660   3HB   ALA  81          HB3       ALA  81   0.623  13.425   2.326
  661    H    PHE  82           HN       PHE  82  -0.768   9.817   2.492
  662    HA   PHE  82           HA       PHE  82  -3.113  10.622   1.403
  663   1HB   PHE  82          HB1       PHE  82  -2.284   8.615   0.652
  664   2HB   PHE  82          HB2       PHE  82  -2.028   7.984   2.273
  665    HD1  PHE  82           HD1      PHE  82  -4.686   8.819  -0.219
  666    HD2  PHE  82           HD2      PHE  82  -3.619   6.591   3.304
  667    HE1  PHE  82           HE1      PHE  82  -6.892   7.669  -0.276
  668    HE2  PHE  82           HE2      PHE  82  -5.827   5.453   3.255
  669    HZ   PHE  82           HZ       PHE  82  -7.471   6.007   1.477
  670    H    GLY  83           HN       GLY  83  -2.764   9.570   4.807
  671   1HA   GLY  83          HA1       GLY  83  -4.362  10.614   6.368
  672   2HA   GLY  83          HA2       GLY  83  -5.605  10.320   5.173
  673    H    GLY  84           HN       GLY  84  -5.078   7.608   4.590
  674   1HA   GLY  84          HA1       GLY  84  -4.837   5.449   5.572
  675   2HA   GLY  84          HA2       GLY  84  -5.231   6.144   7.133
  676    H    LEU  85           HN       LEU  85  -6.355   4.006   5.097
  677    HA   LEU  85           HA       LEU  85  -9.086   4.716   4.660
  678   1HB   LEU  85          HB1       LEU  85  -7.720   2.025   4.509
  679   2HB   LEU  85          HB2       LEU  85  -9.341   2.370   3.944
  680    HG   LEU  85           HG       LEU  85  -6.961   3.828   2.802
  681   1HD1  LEU  85          HD11      LEU  85  -8.060   1.112   2.069
  682   2HD1  LEU  85          HD12      LEU  85  -6.400   1.530   2.494
  683   3HD1  LEU  85          HD13      LEU  85  -7.086   2.087   0.968
  684   1HD2  LEU  85          HD21      LEU  85  -9.625   3.082   1.570
  685   2HD2  LEU  85          HD22      LEU  85  -8.363   4.071   0.837
  686   3HD2  LEU  85          HD23      LEU  85  -9.246   4.668   2.241
  687    H    LYS  86           HN       LYS  86  -9.963   5.259   6.523
  688    HA   LYS  86           HA       LYS  86  -9.942   3.948   8.999
  689   1HB   LYS  86          HB1       LYS  86 -11.974   5.926   7.955
  690   2HB   LYS  86          HB2       LYS  86 -11.629   5.564   9.641
  691   1HG   LYS  86          HG1       LYS  86  -9.485   6.628   7.818
  692   2HG   LYS  86          HG2       LYS  86 -10.621   7.709   8.629
  693   1HD   LYS  86          HD1       LYS  86  -9.894   6.962  10.796
  694   2HD   LYS  86          HD2       LYS  86  -8.928   5.669  10.087
  695   1HE   LYS  86          HE1       LYS  86  -8.413   8.617   9.651
  696   2HE   LYS  86          HE2       LYS  86  -7.591   7.637  10.862
  697   1HZ   LYS  86          HZ1       LYS  86  -6.322   7.913   8.786
  698   2HZ   LYS  86          HZ2       LYS  86  -7.536   7.089   7.948
  699   3HZ   LYS  86          HZ3       LYS  86  -6.651   6.289   9.145
  700    H    LYS  87           HN       LYS  87 -12.054   3.515   6.244
  701    HA   LYS  87           HA       LYS  87 -14.104   2.038   7.653
  702   1HB   LYS  87          HB1       LYS  87 -13.760   2.005   4.696
  703   2HB   LYS  87          HB2       LYS  87 -15.228   1.954   5.633
  704   1HG   LYS  87          HG1       LYS  87 -15.272   4.333   5.868
  705   2HG   LYS  87          HG2       LYS  87 -13.589   4.482   5.275
  706   1HD   LYS  87          HD1       LYS  87 -14.366   3.092   3.301
  707   2HD   LYS  87          HD2       LYS  87 -15.988   3.408   3.817
  708   1HE   LYS  87          HE1       LYS  87 -15.931   5.575   2.957
  709   2HE   LYS  87          HE2       LYS  87 -14.154   5.594   2.891
  710   1HZ   LYS  87          HZ1       LYS  87 -15.869   3.699   1.366
  711   2HZ   LYS  87          HZ2       LYS  87 -14.190   3.825   1.265
  712   3HZ   LYS  87          HZ3       LYS  87 -15.165   5.093   0.700
  713    H    GLU  88           HN       GLU  88 -13.766  -0.026   8.221
  714    HA   GLU  88           HA       GLU  88 -11.758  -1.738   7.340
  715   1HB   GLU  88          HB1       GLU  88 -12.991  -1.880   9.484
  716   2HB   GLU  88          HB2       GLU  88 -14.383  -2.506   8.606
  717   1HG   GLU  88          HG1       GLU  88 -13.006  -4.426   7.839
  718   2HG   GLU  88          HG2       GLU  88 -11.664  -3.815   8.817
  719    H    LYS  89           HN       LYS  89 -15.234  -1.947   6.429
  720    HA   LYS  89           HA       LYS  89 -15.080  -4.160   4.781
  721   1HB   LYS  89          HB1       LYS  89 -16.920  -1.888   4.121
  722   2HB   LYS  89          HB2       LYS  89 -17.228  -3.623   4.082
  723   1HG   LYS  89          HG1       LYS  89 -16.633  -2.229   6.671
  724   2HG   LYS  89          HG2       LYS  89 -18.257  -2.219   5.997
  725   1HD   LYS  89          HD1       LYS  89 -18.646  -4.347   6.643
  726   2HD   LYS  89          HD2       LYS  89 -17.045  -4.892   6.114
  727   1HE   LYS  89          HE1       LYS  89 -16.306  -3.392   8.213
  728   2HE   LYS  89          HE2       LYS  89 -17.918  -3.847   8.762
  729   1HZ   LYS  89          HZ1       LYS  89 -16.077  -5.361   9.458
  730   2HZ   LYS  89          HZ2       LYS  89 -15.909  -5.817   7.841
  731   3HZ   LYS  89          HZ3       LYS  89 -17.359  -6.125   8.650
  732    H    ASP  90           HN       ASP  90 -14.596  -0.820   3.986
  733    HA   ASP  90           HA       ASP  90 -14.146  -0.826   1.292
  734   1HB   ASP  90          HB1       ASP  90 -14.192   0.952   3.355
  735   2HB   ASP  90          HB2       ASP  90 -12.487   0.967   2.943
  736    H    ARG  91           HN       ARG  91 -11.641  -1.292   3.883
  737    HA   ARG  91           HA       ARG  91  -9.553  -1.793   1.998
  738   1HB   ARG  91          HB1       ARG  91  -9.435  -2.754   4.855
  739   2HB   ARG  91          HB2       ARG  91  -8.099  -2.349   3.783
  740   1HG   ARG  91          HG1       ARG  91  -8.630  -0.013   3.897
  741   2HG   ARG  91          HG2       ARG  91 -10.111  -0.341   4.781
  742   1HD   ARG  91          HD1       ARG  91  -7.289  -0.740   5.786
  743   2HD   ARG  91          HD2       ARG  91  -8.383   0.554   6.248
  744    HE   ARG  91           HE       ARG  91  -8.440  -1.948   6.396
  745   1HH1  ARG  91          HH21      ARG  91  -9.263   1.029   7.987
  746   2HH1  ARG  91          HH22      ARG  91 -10.130   0.488   9.383
  747   1HH2  ARG  91          HH11      ARG  91  -9.788  -2.857   8.690
  748   2HH2  ARG  91          HH12      ARG  91 -10.424  -1.679   9.782
  749    H    ASN  92           HN       ASN  92 -11.795  -3.939   3.689
  750    HA   ASN  92           HA       ASN  92 -10.693  -6.394   3.348
  751   1HB   ASN  92          HB1       ASN  92 -13.565  -5.521   3.091
  752   2HB   ASN  92          HB2       ASN  92 -13.095  -7.213   3.036
  753   1HD2  ASN  92          HD21      ASN  92 -14.843  -6.319   4.921
  754   2HD2  ASN  92          HD22      ASN  92 -14.017  -6.633   6.408
  755    H    ASP  93           HN       ASP  93 -12.786  -4.910   0.824
  756    HA   ASP  93           HA       ASP  93 -12.172  -6.787  -1.188
  757   1HB   ASP  93          HB1       ASP  93 -14.020  -4.823  -0.951
  758   2HB   ASP  93          HB2       ASP  93 -12.897  -4.055  -2.061
  759    H    LEU  94           HN       LEU  94 -10.619  -3.614  -0.442
  760    HA   LEU  94           HA       LEU  94  -8.973  -3.359  -2.618
  761   1HB   LEU  94          HB1       LEU  94  -9.187  -2.268   0.086
  762   2HB   LEU  94          HB2       LEU  94  -7.574  -2.294  -0.525
  763    HG   LEU  94           HG       LEU  94  -9.808  -1.112  -2.145
  764   1HD1  LEU  94          HD11      LEU  94  -9.659  -0.098   0.152
  765   2HD1  LEU  94          HD12      LEU  94  -9.393   1.030  -1.182
  766   3HD1  LEU  94          HD13      LEU  94  -8.020   0.419  -0.259
  767   1HD2  LEU  94          HD21      LEU  94  -6.911  -0.274  -2.111
  768   2HD2  LEU  94          HD22      LEU  94  -8.156   0.154  -3.281
  769   3HD2  LEU  94          HD23      LEU  94  -7.532  -1.494  -3.223
  770    H    ILE  95           HN       ILE  95  -8.422  -5.292   0.301
  771    HA   ILE  95           HA       ILE  95  -5.733  -5.990  -0.157
  772    HB   ILE  95           HB       ILE  95  -7.900  -7.386   1.424
  773   1HG1  ILE  95          HG11      ILE  95  -5.566  -5.738   2.435
  774   2HG1  ILE  95          HG12      ILE  95  -7.138  -5.030   2.077
  775   1HG2  ILE  95          HG21      ILE  95  -4.929  -7.855   1.711
  776   2HG2  ILE  95          HG22      ILE  95  -5.974  -8.905   0.757
  777   3HG2  ILE  95          HG23      ILE  95  -6.248  -8.732   2.490
  778   1HD1  ILE  95          HD11      ILE  95  -6.944  -5.483   4.454
  779   2HD1  ILE  95          HD12      ILE  95  -6.577  -7.177   4.127
  780   3HD1  ILE  95          HD13      ILE  95  -8.172  -6.532   3.743
  781    H    THR  96           HN       THR  96  -8.753  -7.749  -0.962
  782    HA   THR  96           HA       THR  96  -7.641  -9.952  -2.247
  783    HB   THR  96           HB       THR  96 -10.181  -8.809  -3.333
  784    HG1  THR  96           HG1      THR  96  -9.681  -9.201  -0.701
  785   1HG2  THR  96          HG21      THR  96  -9.358 -11.017  -4.090
  786   2HG2  THR  96          HG22      THR  96 -10.889 -11.144  -3.221
  787   3HG2  THR  96          HG23      THR  96  -9.380 -11.581  -2.419
  788    H    TYR  97           HN       TYR  97  -8.413  -6.750  -3.659
  789    HA   TYR  97           HA       TYR  97  -7.750  -7.374  -6.310
  790   1HB   TYR  97          HB1       TYR  97  -8.942  -5.333  -5.694
  791   2HB   TYR  97          HB2       TYR  97  -7.495  -4.715  -4.907
  792    HD1  TYR  97           HD1      TYR  97  -6.556  -2.968  -6.066
  793    HD2  TYR  97           HD2      TYR  97  -8.172  -6.294  -8.260
  794    HE1  TYR  97           HE1      TYR  97  -5.793  -1.929  -8.193
  795    HE2  TYR  97           HE2      TYR  97  -7.523  -5.208 -10.402
  796    HH   TYR  97           HH       TYR  97  -5.425  -3.223 -10.905
  797    H    LEU  98           HN       LEU  98  -5.622  -5.711  -3.928
  798    HA   LEU  98           HA       LEU  98  -3.280  -5.763  -5.450
  799   1HB   LEU  98          HB1       LEU  98  -3.995  -4.711  -3.064
  800   2HB   LEU  98          HB2       LEU  98  -3.015  -6.067  -2.514
  801    HG   LEU  98           HG       LEU  98  -1.118  -5.286  -3.878
  802   1HD1  LEU  98          HD11      LEU  98  -1.213  -3.136  -5.028
  803   2HD1  LEU  98          HD12      LEU  98  -2.903  -2.941  -4.565
  804   3HD1  LEU  98          HD13      LEU  98  -2.437  -4.224  -5.684
  805   1HD2  LEU  98          HD21      LEU  98  -1.289  -4.430  -1.595
  806   2HD2  LEU  98          HD22      LEU  98  -2.317  -3.110  -2.154
  807   3HD2  LEU  98          HD23      LEU  98  -0.633  -3.194  -2.670
  808    H    LYS  99           HN       LYS  99  -4.385  -7.993  -2.960
  809    HA   LYS  99           HA       LYS  99  -2.363  -9.877  -3.002
  810   1HB   LYS  99          HB1       LYS  99  -3.664 -10.515  -1.301
  811   2HB   LYS  99          HB2       LYS  99  -5.061  -9.683  -1.961
  812   1HG   LYS  99          HG1       LYS  99  -5.581 -11.626  -3.348
  813   2HG   LYS  99          HG2       LYS  99  -4.157 -12.456  -2.752
  814   1HD   LYS  99          HD1       LYS  99  -5.985 -11.617  -0.620
  815   2HD   LYS  99          HD2       LYS  99  -6.718 -12.730  -1.778
  816   1HE   LYS  99          HE1       LYS  99  -5.525 -13.744   0.241
  817   2HE   LYS  99          HE2       LYS  99  -5.154 -14.406  -1.343
  818   1HZ   LYS  99          HZ1       LYS  99  -3.374 -13.498   0.518
  819   2HZ   LYS  99          HZ2       LYS  99  -3.385 -12.292  -0.671
  820   3HZ   LYS  99          HZ3       LYS  99  -3.054 -13.895  -1.107
  821    H    LYS 100           HN       LYS 100  -5.176  -9.626  -5.180
  822    HA   LYS 100           HA       LYS 100  -4.691 -12.052  -6.558
  823   1HB   LYS 100          HB1       LYS 100  -6.805 -10.403  -6.350
  824   2HB   LYS 100          HB2       LYS 100  -6.270 -10.033  -7.973
  825   1HG   LYS 100          HG1       LYS 100  -8.093 -11.886  -7.522
  826   2HG   LYS 100          HG2       LYS 100  -6.891 -12.101  -8.797
  827   1HD   LYS 100          HD1       LYS 100  -6.134 -13.021  -6.115
  828   2HD   LYS 100          HD2       LYS 100  -7.452 -13.891  -6.836
  829   1HE   LYS 100          HE1       LYS 100  -5.849 -15.286  -7.504
  830   2HE   LYS 100          HE2       LYS 100  -5.503 -14.082  -8.756
  831   1HZ   LYS 100          HZ1       LYS 100  -3.796 -13.124  -7.450
  832   2HZ   LYS 100          HZ2       LYS 100  -3.549 -14.792  -7.343
  833   3HZ   LYS 100          HZ3       LYS 100  -4.273 -13.965  -6.054
  834    H    ALA 101           HN       ALA 101  -3.558  -8.930  -7.097
  835    HA   ALA 101           HA       ALA 101  -2.422  -9.232  -9.696
  836   1HB   ALA 101          HB1       ALA 101  -3.352  -7.118  -8.996
  837   2HB   ALA 101          HB2       ALA 101  -1.620  -6.929  -9.265
  838   3HB   ALA 101          HB3       ALA 101  -2.250  -7.047  -7.621
  839    H    THR 102           HN       THR 102  -1.172  -9.337  -6.384
  840    HA   THR 102           HA       THR 102   1.598  -9.605  -7.083
  841    HB   THR 102           HB       THR 102   0.323 -10.191  -4.410
  842    HG1  THR 102           HG1      THR 102  -0.070  -8.013  -5.247
  843   1HG2  THR 102          HG21      THR 102   3.125  -9.303  -5.119
  844   2HG2  THR 102          HG22      THR 102   2.666 -10.945  -4.665
  845   3HG2  THR 102          HG23      THR 102   2.509  -9.631  -3.499
  846    H    GLU 103           HN       GLU 103  -0.996 -11.860  -6.116
  847    HA   GLU 103           HA       GLU 103   0.765 -14.079  -6.952
  848   1HB   GLU 103          HB1       GLU 103  -0.847 -15.383  -5.245
  849   2HB   GLU 103          HB2       GLU 103   0.683 -14.672  -4.760
  850   1HG   GLU 103          HG1       GLU 103  -0.422 -13.568  -3.199
  851   2HG   GLU 103          HG2       GLU 103  -1.159 -12.615  -4.482
  852    HHA  HEC 104           HA       HEC 104   5.242   3.453   1.272
  853    HHB  HEC 104           HB       HEC 104  -0.497   0.631   0.136
  854    HHC  HEC 104           HC       HEC 104  -2.975   6.409  -1.439
  855    HHD  HEC 104           HD       HEC 104   2.997   8.870  -1.492
  856   1HMA  HEC 104          HMA1      HEC 104   1.303  -0.789   1.934
  857   2HMA  HEC 104          HMA2      HEC 104   2.804  -1.184   1.093
  858   3HMA  HEC 104          HMA3      HEC 104   1.304  -1.000   0.183
  859   1HAA  HEC 104          HAA1      HEC 104   4.367  -0.194   1.979
  860   2HAA  HEC 104          HAA2      HEC 104   5.074   1.369   2.339
  861   1HBA  HEC 104          HBA1      HEC 104   5.908   1.498   0.004
  862   2HBA  HEC 104          HBA2      HEC 104   5.259  -0.108  -0.291
  863   1HMB  HEC 104          HMB1      HEC 104  -2.389   0.341  -0.462
  864   2HMB  HEC 104          HMB2      HEC 104  -3.321   0.945  -1.831
  865   3HMB  HEC 104          HMB3      HEC 104  -3.959   1.099  -0.195
  866    HAB  HEC 104           HAB      HEC 104  -4.398   5.100  -1.460
  867   1HBB  HEC 104          HBB1      HEC 104  -4.714   3.894   0.839
  868   2HBB  HEC 104          HBB2      HEC 104  -5.739   2.832  -0.126
  869   3HBB  HEC 104          HBB3      HEC 104  -6.069   4.565  -0.070
  870   1HMC  HEC 104          HMC1      HEC 104  -2.997   8.976  -1.613
  871   2HMC  HEC 104          HMC2      HEC 104  -2.691   8.237  -3.185
  872   3HMC  HEC 104          HMC3      HEC 104  -2.055   9.842  -2.826
  873    HAC  HEC 104           HAC      HEC 104   1.796   9.930  -2.758
  874   1HBC  HEC 104          HBC1      HEC 104   1.046  11.339  -1.082
  875   2HBC  HEC 104          HBC2      HEC 104  -0.623  11.289  -1.649
  876   3HBC  HEC 104          HBC3      HEC 104   0.606  12.128  -2.596
  877   1HMD  HEC 104          HMD1      HEC 104   5.149   9.244  -0.613
  878   2HMD  HEC 104          HMD2      HEC 104   5.567   8.245  -2.005
  879   3HMD  HEC 104          HMD3      HEC 104   6.608   8.254  -0.582
  880   1HAD  HEC 104          HAD1      HEC 104   7.398   6.374   0.196
  881   2HAD  HEC 104          HAD2      HEC 104   6.934   4.842   0.926
  882   1HBD  HEC 104          HBD1      HEC 104   6.459   5.808   2.978
  883   2HBD  HEC 104          HBD2      HEC 104   6.151   7.385   2.283
  884    H2   4NL 105           H2       4NL 105  -0.107 -12.943  -1.353
  885    H6   4NL 105           H6       4NL 105   1.984 -13.455   3.701
  886    H3   4NL 105           H3       4NL 105  -1.516 -10.604   2.025
  887    H5   4NL 105           H5       4NL 105  -2.458 -10.528  -0.010
  888    H4   4NL 105           H4       4NL 105   0.270 -11.613   3.470
  889    H1   4NL 105           H1       4NL 105   1.679 -13.952   0.091
  890    H7   4NL 105           H7       4NL 105   2.980 -13.744   2.254
  Start of MODEL    5
    1   1H    THR  -5          HT1       THR  -5 -12.408  -6.918  13.518
    2   2H    THR  -5          HT2       THR  -5 -11.870  -6.230  12.068
    3   3H    THR  -5          HT3       THR  -5 -10.832  -6.303  13.402
    4    HA   THR  -5           HA       THR  -5 -10.362  -7.990  11.672
    5    HB   THR  -5           HB       THR  -5 -11.245  -9.507  14.096
    6    HG1  THR  -5           HG1      THR  -5  -9.139  -8.477  14.967
    7   1HG2  THR  -5          HG21      THR  -5  -9.773 -10.522  12.403
    8   2HG2  THR  -5          HG22      THR  -5  -8.946 -10.354  13.952
    9   3HG2  THR  -5          HG23      THR  -5  -8.606  -9.221  12.643
   10    H    GLU  -4           HN       GLU  -4 -12.541  -7.556  10.421
   11    HA   GLU  -4           HA       GLU  -4 -14.070 -10.054  10.441
   12   1HB   GLU  -4          HB1       GLU  -4 -15.314  -8.065  11.607
   13   2HB   GLU  -4          HB2       GLU  -4 -15.473  -7.413   9.980
   14   1HG   GLU  -4          HG1       GLU  -4 -16.350 -10.217  10.583
   15   2HG   GLU  -4          HG2       GLU  -4 -17.392  -8.854  10.973
   16    H    PHE  -3           HN       PHE  -3 -12.243 -10.184   8.819
   17    HA   PHE  -3           HA       PHE  -3 -12.391  -8.634   6.434
   18   1HB   PHE  -3          HB1       PHE  -3 -10.223  -9.358   6.992
   19   2HB   PHE  -3          HB2       PHE  -3 -10.734 -11.031   7.178
   20    HD1  PHE  -3           HD1      PHE  -3 -10.365  -8.328   4.598
   21    HD2  PHE  -3           HD2      PHE  -3 -10.452 -12.550   5.413
   22    HE1  PHE  -3           HE1      PHE  -3  -9.810  -8.797   2.219
   23    HE2  PHE  -3           HE2      PHE  -3  -9.946 -13.022   3.024
   24    HZ   PHE  -3           HZ       PHE  -3  -9.656 -11.144   1.416
   25    H    LYS  -2           HN       LYS  -2 -13.794  -8.760   4.971
   26    HA   LYS  -2           HA       LYS  -2 -15.094 -11.277   4.212
   27   1HB   LYS  -2          HB1       LYS  -2 -16.049  -8.515   4.584
   28   2HB   LYS  -2          HB2       LYS  -2 -16.588  -9.255   3.081
   29   1HG   LYS  -2          HG1       LYS  -2 -17.435 -11.196   4.360
   30   2HG   LYS  -2          HG2       LYS  -2 -16.954 -10.397   5.854
   31   1HD   LYS  -2          HD1       LYS  -2 -18.501  -8.518   5.275
   32   2HD   LYS  -2          HD2       LYS  -2 -19.044  -9.450   3.881
   33   1HE   LYS  -2          HE1       LYS  -2 -20.663  -9.822   5.563
   34   2HE   LYS  -2          HE2       LYS  -2 -19.682 -11.282   5.524
   35   1HZ   LYS  -2          HZ1       LYS  -2 -19.418  -9.072   7.498
   36   2HZ   LYS  -2          HZ2       LYS  -2 -18.481 -10.475   7.468
   37   3HZ   LYS  -2          HZ3       LYS  -2 -20.136 -10.582   7.781
   38    H    ALA  -1           HN       ALA  -1 -14.379 -12.101   2.418
   39    HA   ALA  -1           HA       ALA  -1 -12.413 -11.093   0.763
   40   1HB   ALA  -1          HB1       ALA  -1 -13.003 -13.471   1.038
   41   2HB   ALA  -1          HB2       ALA  -1 -12.883 -13.000  -0.658
   42   3HB   ALA  -1          HB3       ALA  -1 -14.467 -13.202   0.091
   43    H    GLY   1           HN       GLY   1 -12.354 -10.131  -1.228
   44   1HA   GLY   1          HA1       GLY   1 -14.811  -8.834  -2.220
   45   2HA   GLY   1          HA2       GLY   1 -13.206  -8.124  -2.301
   46    H    SER   2           HN       SER   2 -13.092  -7.859  -4.450
   47    HA   SER   2           HA       SER   2 -12.510 -10.105  -6.150
   48   1HB   SER   2          HB1       SER   2 -14.683  -8.358  -7.228
   49   2HB   SER   2          HB2       SER   2 -14.292 -10.039  -7.616
   50    HG   SER   2           HG       SER   2 -14.997 -10.497  -5.386
   51    H    ALA   3           HN       ALA   3 -11.238  -9.500  -7.889
   52    HA   ALA   3           HA       ALA   3  -9.734  -7.226  -7.817
   53   1HB   ALA   3          HB1       ALA   3  -9.191  -9.273  -9.057
   54   2HB   ALA   3          HB2       ALA   3  -8.955  -7.818 -10.025
   55   3HB   ALA   3          HB3       ALA   3 -10.375  -8.829 -10.287
   56    H    LYS   4           HN       LYS   4 -12.778  -7.543  -9.721
   57    HA   LYS   4           HA       LYS   4 -12.490  -4.936 -10.844
   58   1HB   LYS   4          HB1       LYS   4 -13.580  -6.872 -11.990
   59   2HB   LYS   4          HB2       LYS   4 -14.980  -6.600 -10.953
   60   1HG   LYS   4          HG1       LYS   4 -14.247  -4.085 -12.033
   61   2HG   LYS   4          HG2       LYS   4 -14.244  -5.237 -13.362
   62   1HD   LYS   4          HD1       LYS   4 -16.508  -5.570 -13.254
   63   2HD   LYS   4          HD2       LYS   4 -16.575  -5.285 -11.511
   64   1HE   LYS   4          HE1       LYS   4 -16.017  -3.088 -13.511
   65   2HE   LYS   4          HE2       LYS   4 -17.646  -3.493 -12.968
   66   1HZ   LYS   4          HZ1       LYS   4 -15.574  -2.978 -10.961
   67   2HZ   LYS   4          HZ2       LYS   4 -17.241  -2.714 -10.879
   68   3HZ   LYS   4          HZ3       LYS   4 -16.268  -1.661 -11.773
   69    H    LYS   5           HN       LYS   5 -13.168  -5.539  -7.765
   70    HA   LYS   5           HA       LYS   5 -15.062  -3.291  -7.509
   71   1HB   LYS   5          HB1       LYS   5 -14.504  -5.562  -5.592
   72   2HB   LYS   5          HB2       LYS   5 -15.428  -4.132  -5.152
   73   1HG   LYS   5          HG1       LYS   5 -16.867  -4.763  -7.256
   74   2HG   LYS   5          HG2       LYS   5 -16.162  -6.362  -7.007
   75   1HD   LYS   5          HD1       LYS   5 -17.192  -5.112  -4.552
   76   2HD   LYS   5          HD2       LYS   5 -18.430  -5.426  -5.769
   77   1HE   LYS   5          HE1       LYS   5 -18.319  -7.356  -4.364
   78   2HE   LYS   5          HE2       LYS   5 -17.565  -7.791  -5.897
   79   1HZ   LYS   5          HZ1       LYS   5 -16.438  -8.270  -3.554
   80   2HZ   LYS   5          HZ2       LYS   5 -15.812  -6.718  -3.836
   81   3HZ   LYS   5          HZ3       LYS   5 -15.538  -7.958  -4.957
   82    H    GLY   6           HN       GLY   6 -12.312  -4.751  -5.724
   83   1HA   GLY   6          HA1       GLY   6 -11.631  -2.463  -4.250
   84   2HA   GLY   6          HA2       GLY   6 -10.534  -3.779  -4.637
   85    H    ALA   7           HN       ALA   7 -10.897  -3.274  -7.587
   86    HA   ALA   7           HA       ALA   7  -8.732  -1.573  -8.044
   87   1HB   ALA   7          HB1       ALA   7  -9.253  -1.791 -10.406
   88   2HB   ALA   7          HB2       ALA   7 -10.860  -2.406 -10.017
   89   3HB   ALA   7          HB3       ALA   7  -9.432  -3.348  -9.594
   90    H    THR   8           HN       THR   8 -12.266  -0.824  -8.410
   91    HA   THR   8           HA       THR   8 -11.939   1.752  -9.425
   92    HB   THR   8           HB       THR   8 -14.182   2.082  -7.907
   93    HG1  THR   8           HG1      THR   8 -13.968  -0.124  -7.195
   94   1HG2  THR   8          HG21      THR   8 -15.422   1.425  -9.934
   95   2HG2  THR   8          HG22      THR   8 -13.942   0.730 -10.598
   96   3HG2  THR   8          HG23      THR   8 -14.047   2.467 -10.305
   97    H    LEU   9           HN       LEU   9 -11.848   0.760  -6.031
   98    HA   LEU   9           HA       LEU   9 -11.732   3.345  -4.888
   99   1HB   LEU   9          HB1       LEU   9 -10.779   0.676  -3.799
  100   2HB   LEU   9          HB2       LEU   9 -10.935   2.156  -2.854
  101    HG   LEU   9           HG       LEU   9 -13.236   0.807  -4.289
  102   1HD1  LEU   9          HD11      LEU   9 -12.424  -0.573  -2.438
  103   2HD1  LEU   9          HD12      LEU   9 -13.977   0.158  -2.036
  104   3HD1  LEU   9          HD13      LEU   9 -12.490   0.820  -1.359
  105   1HD2  LEU   9          HD21      LEU   9 -14.563   2.280  -2.683
  106   2HD2  LEU   9          HD22      LEU   9 -13.783   3.105  -4.032
  107   3HD2  LEU   9          HD23      LEU   9 -13.063   3.175  -2.423
  108    H    PHE  10           HN       PHE  10  -9.143   0.917  -5.313
  109    HA   PHE  10           HA       PHE  10  -6.927   2.445  -4.715
  110   1HB   PHE  10          HB1       PHE  10  -7.003  -0.017  -5.057
  111   2HB   PHE  10          HB2       PHE  10  -7.114   0.253  -6.789
  112    HD1  PHE  10           HD1      PHE  10  -5.145   1.569  -7.907
  113    HD2  PHE  10           HD2      PHE  10  -4.939  -0.304  -4.041
  114    HE1  PHE  10           HE1      PHE  10  -2.658   1.511  -8.062
  115    HE2  PHE  10           HE2      PHE  10  -2.457  -0.244  -4.143
  116    HZ   PHE  10           HZ       PHE  10  -1.312   0.638  -6.161
  117    H    LYS  11           HN       LYS  11  -8.693   2.280  -7.769
  118    HA   LYS  11           HA       LYS  11  -6.819   3.573  -9.412
  119   1HB   LYS  11          HB1       LYS  11  -9.183   2.271  -9.815
  120   2HB   LYS  11          HB2       LYS  11  -9.619   3.936 -10.202
  121   1HG   LYS  11          HG1       LYS  11  -8.643   3.726 -12.189
  122   2HG   LYS  11          HG2       LYS  11  -7.097   3.459 -11.388
  123   1HD   LYS  11          HD1       LYS  11  -9.114   1.308 -12.069
  124   2HD   LYS  11          HD2       LYS  11  -7.646   1.658 -12.984
  125   1HE   LYS  11          HE1       LYS  11  -6.262   1.020 -11.100
  126   2HE   LYS  11          HE2       LYS  11  -7.680   0.827 -10.073
  127   1HZ   LYS  11          HZ1       LYS  11  -8.386  -1.029 -11.445
  128   2HZ   LYS  11          HZ2       LYS  11  -6.828  -1.302 -10.849
  129   3HZ   LYS  11          HZ3       LYS  11  -7.041  -0.828 -12.458
  130    H    THR  12           HN       THR  12  -8.942   4.995  -7.106
  131    HA   THR  12           HA       THR  12  -8.097   7.677  -7.863
  132    HB   THR  12           HB       THR  12 -10.235   7.353  -8.910
  133    HG1  THR  12           HG1      THR  12 -10.095   9.188  -6.786
  134   1HG2  THR  12          HG21      THR  12 -11.408   7.005  -6.154
  135   2HG2  THR  12          HG22      THR  12 -11.388   5.807  -7.449
  136   3HG2  THR  12          HG23      THR  12 -12.329   7.288  -7.631
  137    H    ARG  13           HN       ARG  13  -7.202   5.908  -5.837
  138    HA   ARG  13           HA       ARG  13  -7.344   7.644  -3.494
  139   1HB   ARG  13          HB1       ARG  13  -7.934   4.686  -3.453
  140   2HB   ARG  13          HB2       ARG  13  -7.495   5.589  -2.019
  141   1HG   ARG  13          HG1       ARG  13  -9.896   6.242  -3.706
  142   2HG   ARG  13          HG2       ARG  13  -9.942   5.121  -2.354
  143   1HD   ARG  13          HD1       ARG  13 -10.747   7.377  -1.752
  144   2HD   ARG  13          HD2       ARG  13  -9.321   6.905  -0.819
  145    HE   ARG  13           HE       ARG  13  -9.070   8.162  -3.278
  146   1HH1  ARG  13          HH11      ARG  13  -9.147   8.644   0.183
  147   2HH1  ARG  13          HH12      ARG  13  -7.992   9.920   0.318
  148   1HH2  ARG  13          HH21      ARG  13  -7.282  10.093  -3.024
  149   2HH2  ARG  13          HH22      ARG  13  -6.982  10.724  -1.443
  150    H    CYS  14           HN       CYS  14  -5.740   5.125  -5.287
  151    HA   CYS  14           HA       CYS  14  -3.246   5.581  -3.783
  152   1HB   CYS  14          HB1       CYS  14  -3.842   2.969  -5.105
  153   2HB   CYS  14          HB2       CYS  14  -2.728   3.315  -3.801
  154    H    LEU  15           HN       LEU  15  -4.698   4.797  -6.930
  155    HA   LEU  15           HA       LEU  15  -2.501   4.557  -8.545
  156   1HB   LEU  15          HB1       LEU  15  -5.047   4.361  -9.027
  157   2HB   LEU  15          HB2       LEU  15  -4.927   6.058  -9.474
  158    HG   LEU  15           HG       LEU  15  -3.094   5.425 -11.094
  159   1HD1  LEU  15          HD11      LEU  15  -2.463   3.273 -10.108
  160   2HD1  LEU  15          HD12      LEU  15  -2.931   3.094 -11.799
  161   3HD1  LEU  15          HD13      LEU  15  -4.049   2.620 -10.519
  162   1HD2  LEU  15          HD21      LEU  15  -5.269   5.834 -11.992
  163   2HD2  LEU  15          HD22      LEU  15  -5.848   4.253 -11.466
  164   3HD2  LEU  15          HD23      LEU  15  -4.651   4.370 -12.758
  165    H    GLN  16           HN       GLN  16  -3.976   7.604  -7.489
  166    HA   GLN  16           HA       GLN  16  -2.844   9.515  -8.996
  167   1HB   GLN  16          HB1       GLN  16  -2.747  10.826  -6.705
  168   2HB   GLN  16          HB2       GLN  16  -4.270  10.383  -7.459
  169   1HG   GLN  16          HG1       GLN  16  -4.337   8.357  -5.986
  170   2HG   GLN  16          HG2       GLN  16  -2.906   8.977  -5.159
  171   1HE2  GLN  16          HE21      GLN  16  -3.692  11.765  -5.268
  172   2HE2  GLN  16          HE22      GLN  16  -5.008  11.943  -4.168
  173    H    CYS  17           HN       CYS  17  -1.047   7.745  -6.498
  174    HA   CYS  17           HA       CYS  17   1.412   9.121  -7.342
  175   1HB   CYS  17          HB1       CYS  17   1.373   7.923  -4.644
  176   2HB   CYS  17          HB2       CYS  17   2.092   9.411  -5.233
  177    H    HIS  18           HN       HIS  18   0.029   6.004  -6.418
  178    HA   HIS  18           HA       HIS  18   2.565   4.596  -6.686
  179   1HB   HIS  18          HB1       HIS  18  -0.163   3.891  -5.669
  180   2HB   HIS  18          HB2       HIS  18   1.011   2.636  -6.012
  181    HD1  HIS  18           HD1      HIS  18   3.448   3.088  -4.579
  182    HD2  HIS  18           HD2      HIS  18  -0.154   4.737  -3.226
  183    HE1  HIS  18           HE1      HIS  18   3.762   3.526  -2.101
  184    H    THR  19           HN       THR  19   2.060   2.253  -7.509
  185    HA   THR  19           HA       THR  19   0.586   2.129 -10.012
  186    HB   THR  19           HB       THR  19   2.902   0.850 -10.703
  187    HG1  THR  19           HG1      THR  19   4.459   2.638 -10.291
  188   1HG2  THR  19          HG21      THR  19   3.376   2.803 -12.128
  189   2HG2  THR  19          HG22      THR  19   2.183   3.735 -11.225
  190   3HG2  THR  19          HG23      THR  19   1.675   2.342 -12.178
  191    H    VAL  20           HN       VAL  20  -0.591   0.275 -10.018
  192    HA   VAL  20           HA       VAL  20  -0.283  -1.715  -7.988
  193    HB   VAL  20           HB       VAL  20  -2.360  -0.717  -9.314
  194   1HG1  VAL  20          HG11      VAL  20  -1.912  -1.862 -11.404
  195   2HG1  VAL  20          HG12      VAL  20  -3.441  -2.384 -10.695
  196   3HG1  VAL  20          HG13      VAL  20  -2.020  -3.423 -10.584
  197   1HG2  VAL  20          HG21      VAL  20  -2.417  -3.447  -8.045
  198   2HG2  VAL  20          HG22      VAL  20  -3.778  -2.346  -8.254
  199   3HG2  VAL  20          HG23      VAL  20  -2.453  -1.914  -7.175
  200    H    GLU  21           HN       GLU  21   0.692  -1.567 -11.285
  201    HA   GLU  21           HA       GLU  21   1.521  -4.391 -11.328
  202   1HB   GLU  21          HB1       GLU  21   1.819  -3.666 -13.893
  203   2HB   GLU  21          HB2       GLU  21   0.287  -4.247 -13.271
  204   1HG   GLU  21          HG1       GLU  21   0.207  -2.197 -14.767
  205   2HG   GLU  21          HG2       GLU  21  -0.650  -2.081 -13.233
  206    H    LYS  22           HN       LYS  22   3.664  -4.451 -13.015
  207    HA   LYS  22           HA       LYS  22   5.486  -2.491 -11.842
  208   1HB   LYS  22          HB1       LYS  22   5.684  -5.282 -12.227
  209   2HB   LYS  22          HB2       LYS  22   6.961  -4.511 -13.184
  210   1HG   LYS  22          HG1       LYS  22   7.944  -3.516 -11.355
  211   2HG   LYS  22          HG2       LYS  22   6.438  -3.474 -10.437
  212   1HD   LYS  22          HD1       LYS  22   6.598  -5.765  -9.888
  213   2HD   LYS  22          HD2       LYS  22   7.873  -6.036 -11.077
  214   1HE   LYS  22          HE1       LYS  22   8.893  -6.013  -8.907
  215   2HE   LYS  22          HE2       LYS  22   9.366  -4.545  -9.742
  216   1HZ   LYS  22          HZ1       LYS  22   8.893  -3.977  -7.498
  217   2HZ   LYS  22          HZ2       LYS  22   7.418  -4.797  -7.511
  218   3HZ   LYS  22          HZ3       LYS  22   7.598  -3.383  -8.413
  219    H    GLY  23           HN       GLY  23   3.874  -1.782 -14.264
  220   1HA   GLY  23          HA1       GLY  23   6.069  -1.379 -16.207
  221   2HA   GLY  23          HA2       GLY  23   4.361  -1.370 -16.612
  222    H    GLY  24           HN       GLY  24   3.957   0.322 -14.067
  223   1HA   GLY  24          HA1       GLY  24   4.166   2.914 -15.313
  224   2HA   GLY  24          HA2       GLY  24   3.377   2.530 -13.793
  225    HA   PRO  25           HA       PRO  25   8.067   3.910 -13.301
  226   1HB   PRO  25          HB1       PRO  25   7.877   6.640 -13.655
  227   2HB   PRO  25          HB2       PRO  25   8.509   5.515 -14.861
  228   1HG   PRO  25          HG1       PRO  25   5.790   6.738 -14.649
  229   2HG   PRO  25          HG2       PRO  25   6.779   6.443 -16.091
  230   1HD   PRO  25          HD1       PRO  25   4.717   4.846 -15.437
  231   2HD   PRO  25          HD2       PRO  25   6.193   4.203 -16.186
  232    H    HIS  26           HN       HIS  26   8.680   4.680 -11.282
  233    HA   HIS  26           HA       HIS  26   6.775   4.866  -9.247
  234   1HB   HIS  26          HB1       HIS  26   9.651   5.809  -9.318
  235   2HB   HIS  26          HB2       HIS  26   8.699   5.609  -7.857
  236    HD2  HIS  26           HD2      HIS  26  10.740   3.645 -10.424
  237    HE1  HIS  26           HE1      HIS  26   9.604   0.869  -7.419
  238    HE2  HIS  26           HE2      HIS  26  11.072   1.243  -9.456
  239    H    LYS  27           HN       LYS  27   5.322   6.516  -9.041
  240    HA   LYS  27           HA       LYS  27   5.975   9.208  -9.909
  241   1HB   LYS  27          HB1       LYS  27   3.451   7.718  -9.300
  242   2HB   LYS  27          HB2       LYS  27   3.434   9.474  -9.303
  243   1HG   LYS  27          HG1       LYS  27   3.911   9.614 -11.580
  244   2HG   LYS  27          HG2       LYS  27   4.596   7.986 -11.633
  245   1HD   LYS  27          HD1       LYS  27   1.673   8.735 -11.363
  246   2HD   LYS  27          HD2       LYS  27   2.445   7.908 -12.722
  247   1HE   LYS  27          HE1       LYS  27   2.728   5.921 -11.514
  248   2HE   LYS  27          HE2       LYS  27   2.553   6.733  -9.958
  249   1HZ   LYS  27          HZ1       LYS  27   0.192   7.155 -10.601
  250   2HZ   LYS  27          HZ2       LYS  27   0.575   5.529 -10.348
  251   3HZ   LYS  27          HZ3       LYS  27   0.424   6.120 -11.924
  252    H    VAL  28           HN       VAL  28   3.855  10.014  -7.697
  253    HA   VAL  28           HA       VAL  28   5.666  11.093  -5.824
  254    HB   VAL  28           HB       VAL  28   2.721  10.663  -5.342
  255   1HG1  VAL  28          HG11      VAL  28   3.900  11.484  -3.403
  256   2HG1  VAL  28          HG12      VAL  28   2.950  12.804  -4.086
  257   3HG1  VAL  28          HG13      VAL  28   4.691  12.736  -4.362
  258   1HG2  VAL  28          HG21      VAL  28   2.945  11.734  -7.541
  259   2HG2  VAL  28          HG22      VAL  28   3.999  12.963  -6.843
  260   3HG2  VAL  28          HG23      VAL  28   2.309  12.869  -6.349
  261    H    GLY  29           HN       GLY  29   4.176   8.022  -6.090
  262   1HA   GLY  29          HA1       GLY  29   5.206   7.138  -3.472
  263   2HA   GLY  29          HA2       GLY  29   3.668   6.579  -4.108
  264    HA   PRO  30           HA       PRO  30   7.489   4.030  -5.646
  265   1HB   PRO  30          HB1       PRO  30   7.526   2.024  -3.827
  266   2HB   PRO  30          HB2       PRO  30   8.457   3.514  -3.638
  267   1HG   PRO  30          HG1       PRO  30   5.813   2.772  -2.436
  268   2HG   PRO  30          HG2       PRO  30   7.222   3.521  -1.659
  269   1HD   PRO  30          HD1       PRO  30   5.092   4.966  -2.452
  270   2HD   PRO  30          HD2       PRO  30   6.745   5.610  -2.523
  271    H    ASN  31           HN       ASN  31   7.455   1.639  -6.256
  272    HA   ASN  31           HA       ASN  31   4.876   0.980  -7.337
  273   1HB   ASN  31          HB1       ASN  31   6.962   0.728  -8.627
  274   2HB   ASN  31          HB2       ASN  31   7.550  -0.458  -7.471
  275   1HD2  ASN  31          HD21      ASN  31   5.259   0.090 -10.081
  276   2HD2  ASN  31          HD22      ASN  31   4.990  -1.593 -10.388
  277    H    LEU  32           HN       LEU  32   3.447  -0.516  -6.566
  278    HA   LEU  32           HA       LEU  32   3.849  -1.719  -3.950
  279   1HB   LEU  32          HB1       LEU  32   1.367  -1.237  -5.602
  280   2HB   LEU  32          HB2       LEU  32   1.373  -1.944  -3.999
  281    HG   LEU  32           HG       LEU  32   2.226   0.880  -4.699
  282   1HD1  LEU  32          HD11      LEU  32  -0.219   0.468  -4.754
  283   2HD1  LEU  32          HD12      LEU  32   0.256   1.560  -3.453
  284   3HD1  LEU  32          HD13      LEU  32  -0.133  -0.121  -3.092
  285   1HD2  LEU  32          HD21      LEU  32   2.457   1.270  -2.320
  286   2HD2  LEU  32          HD22      LEU  32   3.524  -0.051  -2.796
  287   3HD2  LEU  32          HD23      LEU  32   2.007  -0.398  -1.967
  288    H    HIS  33           HN       HIS  33   3.720  -2.737  -7.219
  289    HA   HIS  33           HA       HIS  33   2.634  -5.311  -7.101
  290   1HB   HIS  33          HB1       HIS  33   3.101  -3.793  -9.117
  291   2HB   HIS  33          HB2       HIS  33   4.758  -4.381  -9.030
  292    HD2  HIS  33           HD2      HIS  33   1.536  -6.529  -8.601
  293    HE1  HIS  33           HE1      HIS  33   3.578  -7.933 -12.053
  294    HE2  HIS  33           HE2      HIS  33   1.639  -8.361 -10.466
  295    H    GLY  34           HN       GLY  34   3.457  -6.555  -5.462
  296   1HA   GLY  34          HA1       GLY  34   4.912  -8.478  -5.186
  297   2HA   GLY  34          HA2       GLY  34   6.248  -7.472  -5.705
  298    H    ILE  35           HN       ILE  35   4.292  -5.694  -3.518
  299    HA   ILE  35           HA       ILE  35   6.328  -5.781  -1.553
  300    HB   ILE  35           HB       ILE  35   4.945  -4.444  -0.104
  301   1HG1  ILE  35          HG11      ILE  35   2.726  -5.086  -2.009
  302   2HG1  ILE  35          HG12      ILE  35   2.687  -4.904  -0.257
  303   1HG2  ILE  35          HG21      ILE  35   5.183  -3.595  -2.975
  304   2HG2  ILE  35          HG22      ILE  35   6.325  -3.344  -1.656
  305   3HG2  ILE  35          HG23      ILE  35   4.785  -2.486  -1.662
  306   1HD1  ILE  35          HD11      ILE  35   1.471  -3.077  -1.210
  307   2HD1  ILE  35          HD12      ILE  35   2.789  -2.703  -2.322
  308   3HD1  ILE  35          HD13      ILE  35   2.993  -2.431  -0.592
  309    H    PHE  36           HN       PHE  36   3.298  -7.599  -1.757
  310    HA   PHE  36           HA       PHE  36   3.088  -8.516   0.834
  311   1HB   PHE  36          HB1       PHE  36   2.291  -9.776  -1.781
  312   2HB   PHE  36          HB2       PHE  36   1.951 -10.543  -0.231
  313    HD1  PHE  36           HD1      PHE  36   1.198  -8.383   1.516
  314    HD2  PHE  36           HD2      PHE  36   0.282  -8.952  -2.648
  315    HE1  PHE  36           HE1      PHE  36  -0.818  -6.947   1.771
  316    HE2  PHE  36           HE2      PHE  36  -1.735  -7.517  -2.398
  317    HZ   PHE  36           HZ       PHE  36  -2.280  -6.505  -0.192
  318    H    GLY  37           HN       GLY  37   4.435  -9.490   2.058
  319   1HA   GLY  37          HA1       GLY  37   5.668 -11.327   2.842
  320   2HA   GLY  37          HA2       GLY  37   6.071 -11.752   1.189
  321    H    ARG  38           HN       ARG  38   6.592  -8.464   1.497
  322    HA   ARG  38           HA       ARG  38   9.470  -8.801   2.045
  323   1HB   ARG  38          HB1       ARG  38   7.932  -7.005   0.172
  324   2HB   ARG  38          HB2       ARG  38   9.543  -6.552   0.710
  325   1HG   ARG  38          HG1       ARG  38  10.555  -8.341  -0.403
  326   2HG   ARG  38          HG2       ARG  38   9.038  -9.233  -0.540
  327   1HD   ARG  38          HD1       ARG  38   9.264  -8.432  -2.698
  328   2HD   ARG  38          HD2       ARG  38   8.300  -7.147  -1.968
  329    HE   ARG  38           HE       ARG  38  10.289  -6.616  -1.325
  330   1HH1  ARG  38          HH21      ARG  38   9.564  -7.566  -4.558
  331   2HH1  ARG  38          HH22      ARG  38  10.327  -6.241  -5.277
  332   1HH2  ARG  38          HH11      ARG  38  12.084  -4.981  -2.812
  333   2HH2  ARG  38          HH12      ARG  38  12.149  -5.559  -4.420
  334    H    HIS  39           HN       HIS  39  10.463  -6.681   2.826
  335    HA   HIS  39           HA       HIS  39   8.950  -5.799   5.158
  336   1HB   HIS  39          HB1       HIS  39  11.838  -5.179   4.488
  337   2HB   HIS  39          HB2       HIS  39  11.058  -5.115   6.071
  338    HD2  HIS  39           HD2      HIS  39  10.446  -7.498   7.258
  339    HE1  HIS  39           HE1      HIS  39  12.804  -9.933   4.686
  340    HE2  HIS  39           HE2      HIS  39  11.420  -9.886   6.815
  341    H    SER  40           HN       SER  40   8.824  -3.503   5.712
  342    HA   SER  40           HA       SER  40   8.032  -1.827   3.646
  343   1HB   SER  40          HB1       SER  40   9.089  -0.544   6.123
  344   2HB   SER  40          HB2       SER  40   7.649  -0.161   5.190
  345    HG   SER  40           HG       SER  40   6.909  -2.318   6.036
  346    H    GLY  41           HN       GLY  41   8.984  -0.372   2.366
  347   1HA   GLY  41          HA1       GLY  41  10.626   1.086   1.590
  348   2HA   GLY  41          HA2       GLY  41  11.679   0.574   2.887
  349    H    GLN  42           HN       GLN  42  10.251  -1.431   0.203
  350    HA   GLN  42           HA       GLN  42  13.013  -1.922  -0.657
  351   1HB   GLN  42          HB1       GLN  42  10.862  -4.016  -0.473
  352   2HB   GLN  42          HB2       GLN  42  12.480  -4.272  -1.117
  353   1HG   GLN  42          HG1       GLN  42  13.431  -3.637   1.079
  354   2HG   GLN  42          HG2       GLN  42  11.798  -3.466   1.716
  355   1HE2  GLN  42          HE21      GLN  42  13.863  -5.285   2.671
  356   2HE2  GLN  42          HE22      GLN  42  13.243  -6.881   2.463
  357    H    ALA  43           HN       ALA  43  10.687  -0.241  -1.986
  358    HA   ALA  43           HA       ALA  43  10.113  -1.357  -4.474
  359   1HB   ALA  43          HB1       ALA  43   9.443   0.820  -5.148
  360   2HB   ALA  43          HB2       ALA  43  10.476   1.579  -3.938
  361   3HB   ALA  43          HB3       ALA  43   9.065   0.651  -3.434
  362    H    GLU  44           HN       GLU  44  11.166  -1.683  -6.320
  363    HA   GLU  44           HA       GLU  44  13.964  -1.212  -6.548
  364   1HB   GLU  44          HB1       GLU  44  12.261  -2.383  -8.749
  365   2HB   GLU  44          HB2       GLU  44  13.949  -2.708  -8.369
  366   1HG   GLU  44          HG1       GLU  44  12.986  -4.606  -7.518
  367   2HG   GLU  44          HG2       GLU  44  12.973  -3.586  -6.093
  368    H    GLY  45           HN       GLY  45  13.997   1.101  -6.484
  369   1HA   GLY  45          HA1       GLY  45  14.984   2.649  -8.179
  370   2HA   GLY  45          HA2       GLY  45  13.498   2.432  -9.076
  371    H    TYR  46           HN       TYR  46  13.136   2.728  -5.648
  372    HA   TYR  46           HA       TYR  46  12.766   5.603  -5.682
  373   1HB   TYR  46          HB1       TYR  46  10.638   4.696  -6.427
  374   2HB   TYR  46          HB2       TYR  46  10.534   3.707  -4.977
  375    HD1  TYR  46           HD1      TYR  46  10.029   7.020  -6.418
  376    HD2  TYR  46           HD2      TYR  46  10.244   4.790  -2.753
  377    HE1  TYR  46           HE1      TYR  46   8.763   8.826  -5.261
  378    HE2  TYR  46           HE2      TYR  46   8.882   6.531  -1.603
  379    HH   TYR  46           HH       TYR  46   7.200   8.970  -3.315
  380    H    SER  47           HN       SER  47  13.152   6.629  -3.801
  381    HA   SER  47           HA       SER  47  14.259   5.123  -1.586
  382   1HB   SER  47          HB1       SER  47  14.287   7.949  -1.111
  383   2HB   SER  47          HB2       SER  47  15.644   6.861  -1.411
  384    HG   SER  47           HG       SER  47  15.729   7.527  -3.406
  385    H    TYR  48           HN       TYR  48  13.601   5.147   0.466
  386    HA   TYR  48           HA       TYR  48  10.949   6.114   1.233
  387   1HB   TYR  48          HB1       TYR  48  12.651   3.770   2.068
  388   2HB   TYR  48          HB2       TYR  48  11.203   4.243   2.950
  389    HD1  TYR  48           HD1      TYR  48   9.000   3.953   2.018
  390    HD2  TYR  48           HD2      TYR  48  12.492   2.829  -0.223
  391    HE1  TYR  48           HE1      TYR  48   7.584   2.551   0.532
  392    HE2  TYR  48           HE2      TYR  48  11.087   1.424  -1.717
  393    HH   TYR  48           HH       TYR  48   8.166   0.293  -0.863
  394    H    THR  49           HN       THR  49  10.685   6.784   3.590
  395    HA   THR  49           HA       THR  49  12.612   8.719   4.421
  396    HB   THR  49           HB       THR  49  11.113   8.713   6.560
  397    HG1  THR  49           HG1      THR  49   9.193   7.695   4.801
  398   1HG2  THR  49          HG21      THR  49   9.971   9.605   3.924
  399   2HG2  THR  49          HG22      THR  49  11.192  10.479   4.850
  400   3HG2  THR  49          HG23      THR  49   9.578  10.242   5.522
  401    H    ASP  50           HN       ASP  50  13.535   8.902   6.578
  402    HA   ASP  50           HA       ASP  50  15.219   6.864   7.339
  403   1HB   ASP  50          HB1       ASP  50  15.594   9.191   7.893
  404   2HB   ASP  50          HB2       ASP  50  14.163   9.218   8.920
  405    H    ALA  51           HN       ALA  51  11.964   7.524   8.526
  406    HA   ALA  51           HA       ALA  51  12.067   5.600  10.657
  407   1HB   ALA  51          HB1       ALA  51  10.882   7.781  10.800
  408   2HB   ALA  51          HB2       ALA  51   9.872   6.393  11.205
  409   3HB   ALA  51          HB3       ALA  51   9.707   7.172   9.632
  410    H    ASN  52           HN       ASN  52  10.699   5.594   7.344
  411    HA   ASN  52           HA       ASN  52   9.091   3.277   7.744
  412   1HB   ASN  52          HB1       ASN  52   8.327   4.547   5.986
  413   2HB   ASN  52          HB2       ASN  52   9.945   4.925   5.408
  414   1HD2  ASN  52          HD21      ASN  52   7.224   2.876   4.966
  415   2HD2  ASN  52          HD22      ASN  52   7.935   1.977   3.675
  416    H    ILE  53           HN       ILE  53  12.409   3.730   6.600
  417    HA   ILE  53           HA       ILE  53  12.898   1.049   5.860
  418    HB   ILE  53           HB       ILE  53  14.746   3.291   6.614
  419   1HG1  ILE  53          HG11      ILE  53  14.146   2.084   3.893
  420   2HG1  ILE  53          HG12      ILE  53  13.333   3.512   4.527
  421   1HG2  ILE  53          HG21      ILE  53  15.853   1.093   7.001
  422   2HG2  ILE  53          HG22      ILE  53  16.602   2.017   5.699
  423   3HG2  ILE  53          HG23      ILE  53  15.532   0.669   5.318
  424   1HD1  ILE  53          HD11      ILE  53  15.059   4.248   3.047
  425   2HD1  ILE  53          HD12      ILE  53  16.258   3.228   3.840
  426   3HD1  ILE  53          HD13      ILE  53  15.582   4.616   4.691
  427    H    LYS  54           HN       LYS  54  14.367   2.661   8.740
  428    HA   LYS  54           HA       LYS  54  14.982   0.611  10.342
  429   1HB   LYS  54          HB1       LYS  54  13.576   3.158  11.138
  430   2HB   LYS  54          HB2       LYS  54  14.387   2.073  12.271
  431   1HG   LYS  54          HG1       LYS  54  16.512   2.416  11.194
  432   2HG   LYS  54          HG2       LYS  54  15.755   3.336   9.891
  433   1HD   LYS  54          HD1       LYS  54  15.017   5.014  11.612
  434   2HD   LYS  54          HD2       LYS  54  15.999   4.137  12.796
  435   1HE   LYS  54          HE1       LYS  54  18.012   4.604  11.622
  436   2HE   LYS  54          HE2       LYS  54  17.133   5.150  10.190
  437   1HZ   LYS  54          HZ1       LYS  54  16.215   6.942  11.720
  438   2HZ   LYS  54          HZ2       LYS  54  17.825   7.085  11.214
  439   3HZ   LYS  54          HZ3       LYS  54  17.478   6.520  12.772
  440    H    LYS  55           HN       LYS  55  11.781   1.147   9.290
  441    HA   LYS  55           HA       LYS  55  10.440  -0.156  11.501
  442   1HB   LYS  55          HB1       LYS  55   9.398   1.733  10.464
  443   2HB   LYS  55          HB2       LYS  55   9.484   0.989   8.885
  444   1HG   LYS  55          HG1       LYS  55   7.279   0.743   9.365
  445   2HG   LYS  55          HG2       LYS  55   7.906  -0.792   9.937
  446   1HD   LYS  55          HD1       LYS  55   7.332   1.589  11.709
  447   2HD   LYS  55          HD2       LYS  55   6.212   0.256  11.435
  448   1HE   LYS  55          HE1       LYS  55   8.965   0.036  12.673
  449   2HE   LYS  55          HE2       LYS  55   7.431  -0.026  13.544
  450   1HZ   LYS  55          HZ1       LYS  55   8.517  -2.005  11.620
  451   2HZ   LYS  55          HZ2       LYS  55   6.890  -1.988  12.072
  452   3HZ   LYS  55          HZ3       LYS  55   8.081  -2.243  13.242
  453    H    ASN  56           HN       ASN  56  11.347  -1.039   8.233
  454    HA   ASN  56           HA       ASN  56  10.859  -2.795   6.872
  455   1HB   ASN  56          HB1       ASN  56  12.804  -3.406   8.967
  456   2HB   ASN  56          HB2       ASN  56  12.179  -4.829   8.165
  457   1HD2  ASN  56          HD21      ASN  56  12.626  -1.803   6.353
  458   2HD2  ASN  56          HD22      ASN  56  13.724  -2.682   5.382
  459    H    VAL  57           HN       VAL  57   8.442  -2.567   8.058
  460    HA   VAL  57           HA       VAL  57   7.621  -4.873   9.508
  461    HB   VAL  57           HB       VAL  57   6.503  -2.409   8.954
  462   1HG1  VAL  57          HG11      VAL  57   4.587  -4.482   7.890
  463   2HG1  VAL  57          HG12      VAL  57   5.368  -3.239   6.913
  464   3HG1  VAL  57          HG13      VAL  57   4.244  -2.778   8.192
  465   1HG2  VAL  57          HG21      VAL  57   5.280  -4.821  10.272
  466   2HG2  VAL  57          HG22      VAL  57   4.841  -3.138  10.563
  467   3HG2  VAL  57          HG23      VAL  57   6.446  -3.719  11.005
  468    H    LEU  58           HN       LEU  58   6.783  -6.800   8.815
  469    HA   LEU  58           HA       LEU  58   7.219  -7.444   6.040
  470   1HB   LEU  58          HB1       LEU  58   7.917  -8.993   7.835
  471   2HB   LEU  58          HB2       LEU  58   6.233  -9.206   8.294
  472    HG   LEU  58           HG       LEU  58   5.906  -9.947   5.796
  473   1HD1  LEU  58          HD11      LEU  58   8.161  -9.276   5.072
  474   2HD1  LEU  58          HD12      LEU  58   7.886 -11.001   4.826
  475   3HD1  LEU  58          HD13      LEU  58   8.864 -10.451   6.187
  476   1HD2  LEU  58          HD21      LEU  58   6.486 -12.277   6.323
  477   2HD2  LEU  58          HD22      LEU  58   5.637 -11.513   7.666
  478   3HD2  LEU  58          HD23      LEU  58   7.385 -11.734   7.741
  479    H    TRP  59           HN       TRP  59   5.760  -6.556   4.735
  480    HA   TRP  59           HA       TRP  59   3.065  -6.055   5.239
  481   1HB   TRP  59          HB1       TRP  59   4.495  -6.510   2.621
  482   2HB   TRP  59          HB2       TRP  59   2.877  -5.850   2.768
  483    HD1  TRP  59           HD1      TRP  59   6.097  -4.692   1.987
  484    HE1  TRP  59           HE1      TRP  59   6.459  -2.223   2.637
  485    HE3  TRP  59           HE3      TRP  59   2.107  -4.012   5.114
  486    HZ2  TRP  59           HZ2      TRP  59   5.317  -0.267   4.383
  487    HZ3  TRP  59           HZ3      TRP  59   1.756  -1.839   6.222
  488    HH2  TRP  59           HH2      TRP  59   3.328   0.032   5.874
  489    H    ASP  60           HN       ASP  60   1.723  -7.548   5.835
  490    HA   ASP  60           HA       ASP  60   1.367 -10.079   4.408
  491   1HB   ASP  60          HB1       ASP  60   1.763 -11.041   6.388
  492   2HB   ASP  60          HB2       ASP  60   1.856  -9.476   7.174
  493    H    GLU  61           HN       GLU  61  -1.066 -10.832   5.322
  494    HA   GLU  61           HA       GLU  61  -2.842  -9.266   3.738
  495   1HB   GLU  61          HB1       GLU  61  -2.836 -11.872   4.395
  496   2HB   GLU  61          HB2       GLU  61  -3.959 -11.291   5.621
  497   1HG   GLU  61          HG1       GLU  61  -5.500 -11.658   4.005
  498   2HG   GLU  61          HG2       GLU  61  -4.980 -10.070   3.434
  499    H    ASN  62           HN       ASN  62  -2.768  -9.938   7.258
  500    HA   ASN  62           HA       ASN  62  -4.711  -7.918   7.851
  501   1HB   ASN  62          HB1       ASN  62  -4.609  -9.933   9.164
  502   2HB   ASN  62          HB2       ASN  62  -2.931  -9.640   9.584
  503   1HD2  ASN  62          HD21      ASN  62  -2.459  -8.142  11.186
  504   2HD2  ASN  62          HD22      ASN  62  -3.677  -7.485  12.220
  505    H    ASN  63           HN       ASN  63  -1.138  -8.099   8.310
  506    HA   ASN  63           HA       ASN  63  -0.710  -5.665   9.523
  507   1HB   ASN  63          HB1       ASN  63   1.041  -7.236   9.360
  508   2HB   ASN  63          HB2       ASN  63   0.962  -7.274   7.610
  509   1HD2  ASN  63          HD21      ASN  63   2.034  -5.319  10.379
  510   2HD2  ASN  63          HD22      ASN  63   2.908  -4.268   9.320
  511    H    MET  64           HN       MET  64  -1.080  -6.088   5.943
  512    HA   MET  64           HA       MET  64  -0.363  -3.510   5.197
  513   1HB   MET  64          HB1       MET  64  -0.681  -5.186   3.540
  514   2HB   MET  64          HB2       MET  64  -2.366  -5.409   3.992
  515   1HG   MET  64          HG1       MET  64  -1.862  -2.675   3.254
  516   2HG   MET  64          HG2       MET  64  -1.321  -3.760   1.988
  517   1HE   MET  64          HE1       MET  64  -4.725  -5.734   1.320
  518   2HE   MET  64          HE2       MET  64  -3.500  -6.136   2.525
  519   3HE   MET  64          HE3       MET  64  -3.013  -5.651   0.901
  520    H    SER  65           HN       SER  65  -3.570  -4.570   6.367
  521    HA   SER  65           HA       SER  65  -4.811  -2.026   6.125
  522   1HB   SER  65          HB1       SER  65  -5.578  -4.401   7.825
  523   2HB   SER  65          HB2       SER  65  -6.584  -2.982   7.565
  524    HG   SER  65           HG       SER  65  -5.841  -4.996   5.752
  525    H    GLU  66           HN       GLU  66  -3.124  -3.582   8.829
  526    HA   GLU  66           HA       GLU  66  -3.642  -1.915  10.930
  527   1HB   GLU  66          HB1       GLU  66  -2.224  -3.964  10.966
  528   2HB   GLU  66          HB2       GLU  66  -0.936  -3.056  10.182
  529   1HG   GLU  66          HG1       GLU  66  -0.709  -1.603  12.083
  530   2HG   GLU  66          HG2       GLU  66  -2.128  -2.314  12.852
  531    H    TYR  67           HN       TYR  67  -1.186  -1.419   8.427
  532    HA   TYR  67           HA       TYR  67  -0.361   1.182   9.241
  533   1HB   TYR  67          HB1       TYR  67   1.282  -0.046   8.187
  534   2HB   TYR  67          HB2       TYR  67   0.187  -0.668   6.967
  535    HD1  TYR  67           HD1      TYR  67  -0.037   0.403   4.846
  536    HD2  TYR  67           HD2      TYR  67   2.102   2.317   8.041
  537    HE1  TYR  67           HE1      TYR  67   0.961   1.998   3.213
  538    HE2  TYR  67           HE2      TYR  67   3.152   3.885   6.422
  539    HH   TYR  67           HH       TYR  67   2.216   3.946   3.021
  540    H    LEU  68           HN       LEU  68  -2.540   0.046   6.588
  541    HA   LEU  68           HA       LEU  68  -2.876   2.512   5.346
  542   1HB   LEU  68          HB1       LEU  68  -4.763   0.191   5.633
  543   2HB   LEU  68          HB2       LEU  68  -5.132   1.597   4.650
  544    HG   LEU  68           HG       LEU  68  -2.908  -0.406   4.220
  545   1HD1  LEU  68          HD11      LEU  68  -4.138  -0.708   2.092
  546   2HD1  LEU  68          HD12      LEU  68  -5.328   0.478   2.628
  547   3HD1  LEU  68          HD13      LEU  68  -5.149  -1.046   3.496
  548   1HD2  LEU  68          HD21      LEU  68  -3.412   2.222   2.789
  549   2HD2  LEU  68          HD22      LEU  68  -2.414   0.922   2.141
  550   3HD2  LEU  68          HD23      LEU  68  -1.938   1.740   3.628
  551    H    THR  69           HN       THR  69  -4.619   1.341   8.241
  552    HA   THR  69           HA       THR  69  -6.616   3.280   8.347
  553    HB   THR  69           HB       THR  69  -5.358   2.301  10.873
  554    HG1  THR  69           HG1      THR  69  -5.462   0.455   9.669
  555   1HG2  THR  69          HG21      THR  69  -7.404   3.753  10.936
  556   2HG2  THR  69          HG22      THR  69  -7.638   2.156  11.646
  557   3HG2  THR  69          HG23      THR  69  -8.256   2.502  10.031
  558    H    ASN  70           HN       ASN  70  -3.275   3.506   9.565
  559    HA   ASN  70           HA       ASN  70  -3.404   6.374   9.427
  560   1HB   ASN  70          HB1       ASN  70  -4.335   5.820  11.704
  561   2HB   ASN  70          HB2       ASN  70  -2.755   5.169  12.124
  562   1HD2  ASN  70          HD21      ASN  70  -4.055   7.359  13.433
  563   2HD2  ASN  70          HD22      ASN  70  -2.845   8.583  13.288
  564    HA   PRO  71           HA       PRO  71   0.706   4.729   8.125
  565   1HB   PRO  71          HB1       PRO  71   1.204   6.895   6.496
  566   2HB   PRO  71          HB2       PRO  71   0.390   5.417   5.977
  567   1HG   PRO  71          HG1       PRO  71  -0.785   8.041   6.797
  568   2HG   PRO  71          HG2       PRO  71  -1.268   6.959   5.478
  569   1HD   PRO  71          HD1       PRO  71  -2.632   7.064   7.791
  570   2HD   PRO  71          HD2       PRO  71  -2.427   5.542   6.898
  571    H    LYS  72           HN       LYS  72  -0.184   7.967   9.226
  572    HA   LYS  72           HA       LYS  72   2.428   8.887   9.834
  573   1HB   LYS  72          HB1       LYS  72  -0.312   9.872  10.172
  574   2HB   LYS  72          HB2       LYS  72   0.780  10.371  11.454
  575   1HG   LYS  72          HG1       LYS  72   0.559  11.988   9.563
  576   2HG   LYS  72          HG2       LYS  72   2.210  11.494   9.925
  577   1HD   LYS  72          HD1       LYS  72   2.215   9.992   8.017
  578   2HD   LYS  72          HD2       LYS  72   0.518  10.351   7.695
  579   1HE   LYS  72          HE1       LYS  72   1.025  12.601   7.092
  580   2HE   LYS  72          HE2       LYS  72   2.671  12.460   7.688
  581   1HZ   LYS  72          HZ1       LYS  72   2.248  12.358   5.180
  582   2HZ   LYS  72          HZ2       LYS  72   1.735  10.773   5.462
  583   3HZ   LYS  72          HZ3       LYS  72   3.312  11.225   5.863
  584    H    LYS  73           HN       LYS  73  -0.018   7.210  11.753
  585    HA   LYS  73           HA       LYS  73   1.463   7.470  14.197
  586   1HB   LYS  73          HB1       LYS  73  -0.920   7.280  14.359
  587   2HB   LYS  73          HB2       LYS  73  -0.914   5.756  13.484
  588   1HG   LYS  73          HG1       LYS  73  -1.253   5.263  15.794
  589   2HG   LYS  73          HG2       LYS  73   0.373   4.743  15.373
  590   1HD   LYS  73          HD1       LYS  73   0.897   7.243  16.270
  591   2HD   LYS  73          HD2       LYS  73  -0.528   6.865  17.236
  592   1HE   LYS  73          HE1       LYS  73   1.250   6.156  18.576
  593   2HE   LYS  73          HE2       LYS  73   0.691   4.670  17.814
  594   1HZ   LYS  73          HZ1       LYS  73   3.133   6.221  17.269
  595   2HZ   LYS  73          HZ2       LYS  73   2.496   5.194  16.089
  596   3HZ   LYS  73          HZ3       LYS  73   2.966   4.565  17.585
  597    H    TYR  74           HN       TYR  74   1.207   4.931  11.745
  598    HA   TYR  74           HA       TYR  74   2.757   3.008  13.174
  599   1HB   TYR  74          HB1       TYR  74   1.035   2.764  11.201
  600   2HB   TYR  74          HB2       TYR  74   2.479   2.943  10.204
  601    HD1  TYR  74           HD1      TYR  74   3.617   0.960   9.595
  602    HD2  TYR  74           HD2      TYR  74   1.364   1.139  13.252
  603    HE1  TYR  74           HE1      TYR  74   4.092  -1.457  10.005
  604    HE2  TYR  74           HE2      TYR  74   1.821  -1.262  13.670
  605    HH   TYR  74           HH       TYR  74   2.347  -3.285  12.290
  606    H    ILE  75           HN       ILE  75   3.531   5.314  10.632
  607    HA   ILE  75           HA       ILE  75   6.404   4.945  11.108
  608    HB   ILE  75           HB       ILE  75   5.121   5.495   8.419
  609   1HG1  ILE  75          HG11      ILE  75   6.597   3.011   9.368
  610   2HG1  ILE  75          HG12      ILE  75   4.852   3.118   9.194
  611   1HG2  ILE  75          HG21      ILE  75   7.253   6.610   8.621
  612   2HG2  ILE  75          HG22      ILE  75   7.477   5.189   7.603
  613   3HG2  ILE  75          HG23      ILE  75   8.004   5.159   9.285
  614   1HD1  ILE  75          HD11      ILE  75   5.997   1.940   7.322
  615   2HD1  ILE  75          HD12      ILE  75   6.800   3.455   6.909
  616   3HD1  ILE  75          HD13      ILE  75   5.045   3.331   6.802
  617    HA   PRO  76           HA       PRO  76   5.349   9.249  12.248
  618   1HB   PRO  76          HB1       PRO  76   7.518   9.546  13.877
  619   2HB   PRO  76          HB2       PRO  76   5.996   8.820  14.402
  620   1HG   PRO  76          HG1       PRO  76   8.535   7.491  13.547
  621   2HG   PRO  76          HG2       PRO  76   7.446   7.074  14.883
  622   1HD   PRO  76          HD1       PRO  76   7.439   5.739  12.529
  623   2HD   PRO  76          HD2       PRO  76   5.970   5.968  13.500
  624    H    GLY  77           HN       GLY  77   5.777  10.340  10.361
  625   1HA   GLY  77          HA1       GLY  77   7.230  12.098   9.526
  626   2HA   GLY  77          HA2       GLY  77   8.590  11.029   9.801
  627    H    THR  78           HN       THR  78   6.130   9.183   8.489
  628    HA   THR  78           HA       THR  78   7.408   8.693   6.032
  629    HB   THR  78           HB       THR  78   5.557   7.411   7.532
  630    HG1  THR  78           HG1      THR  78   6.933   6.931   5.341
  631   1HG2  THR  78          HG21      THR  78   4.084   8.143   5.000
  632   2HG2  THR  78          HG22      THR  78   3.626   8.628   6.633
  633   3HG2  THR  78          HG23      THR  78   3.597   6.924   6.179
  634    H    LYS  79           HN       LYS  79   6.910   9.166   3.927
  635    HA   LYS  79           HA       LYS  79   5.815  11.741   3.377
  636   1HB   LYS  79          HB1       LYS  79   6.416   9.586   1.359
  637   2HB   LYS  79          HB2       LYS  79   6.412  11.324   1.108
  638   1HG   LYS  79          HG1       LYS  79   8.392  11.477   2.636
  639   2HG   LYS  79          HG2       LYS  79   8.435   9.706   2.655
  640   1HD   LYS  79          HD1       LYS  79   8.214  10.359  -0.051
  641   2HD   LYS  79          HD2       LYS  79   9.352  11.551   0.593
  642   1HE   LYS  79          HE1       LYS  79  10.803   9.829   0.103
  643   2HE   LYS  79          HE2       LYS  79  10.394   9.432   1.772
  644   1HZ   LYS  79          HZ1       LYS  79   8.731   8.316  -0.362
  645   2HZ   LYS  79          HZ2       LYS  79   9.134   7.663   1.143
  646   3HZ   LYS  79          HZ3       LYS  79  10.266   7.645  -0.109
  647    H    MET  80           HN       MET  80   4.321   8.532   3.328
  648    HA   MET  80           HA       MET  80   2.249   9.166   1.521
  649   1HB   MET  80          HB1       MET  80   2.515   6.903   1.652
  650   2HB   MET  80          HB2       MET  80   2.789   6.921   3.397
  651   1HG   MET  80          HG1       MET  80   0.602   6.814   3.893
  652   2HG   MET  80          HG2       MET  80   0.137   7.847   2.554
  653   1HE   MET  80          HE1       MET  80  -2.074   4.582   2.322
  654   2HE   MET  80          HE2       MET  80  -2.038   6.291   2.757
  655   3HE   MET  80          HE3       MET  80  -1.324   5.092   3.834
  656    H    ALA  81           HN       ALA  81   0.991  10.790   1.798
  657    HA   ALA  81           HA       ALA  81  -0.276  11.338   4.373
  658   1HB   ALA  81          HB1       ALA  81   0.105  13.302   2.139
  659   2HB   ALA  81          HB2       ALA  81   1.290  13.025   3.414
  660   3HB   ALA  81          HB3       ALA  81  -0.317  13.626   3.821
  661    H    PHE  82           HN       PHE  82  -1.218   9.583   2.183
  662    HA   PHE  82           HA       PHE  82  -3.381  10.253   0.744
  663   1HB   PHE  82          HB1       PHE  82  -2.644   8.169   0.278
  664   2HB   PHE  82          HB2       PHE  82  -2.362   7.762   1.966
  665    HD1  PHE  82           HD1      PHE  82  -5.008   8.105  -0.639
  666    HD2  PHE  82           HD2      PHE  82  -3.948   6.535   3.224
  667    HE1  PHE  82           HE1      PHE  82  -7.176   6.888  -0.537
  668    HE2  PHE  82           HE2      PHE  82  -6.118   5.330   3.332
  669    HZ   PHE  82           HZ       PHE  82  -7.741   5.524   1.460
  670    H    GLY  83           HN       GLY  83  -3.489   9.851   4.263
  671   1HA   GLY  83          HA1       GLY  83  -5.363  11.029   5.359
  672   2HA   GLY  83          HA2       GLY  83  -6.403  10.362   4.120
  673    H    GLY  84           HN       GLY  84  -5.037   7.676   4.425
  674   1HA   GLY  84          HA1       GLY  84  -5.021   5.782   5.734
  675   2HA   GLY  84          HA2       GLY  84  -5.507   6.754   7.111
  676    H    LEU  85           HN       LEU  85  -6.442   4.270   5.223
  677    HA   LEU  85           HA       LEU  85  -9.285   4.785   5.034
  678   1HB   LEU  85          HB1       LEU  85  -7.487   2.549   4.154
  679   2HB   LEU  85          HB2       LEU  85  -9.222   2.322   4.205
  680    HG   LEU  85           HG       LEU  85  -7.805   4.431   2.553
  681   1HD1  LEU  85          HD11      LEU  85  -9.000   1.745   1.843
  682   2HD1  LEU  85          HD12      LEU  85  -7.314   2.239   1.684
  683   3HD1  LEU  85          HD13      LEU  85  -8.547   2.970   0.656
  684   1HD2  LEU  85          HD21      LEU  85  -9.916   4.798   1.458
  685   2HD2  LEU  85          HD22      LEU  85 -10.177   4.992   3.191
  686   3HD2  LEU  85          HD23      LEU  85 -10.683   3.508   2.385
  687    H    LYS  86           HN       LYS  86  -9.918   4.979   7.073
  688    HA   LYS  86           HA       LYS  86  -9.492   3.241   9.253
  689   1HB   LYS  86          HB1       LYS  86 -11.823   5.112   9.122
  690   2HB   LYS  86          HB2       LYS  86 -10.762   4.742  10.474
  691   1HG   LYS  86          HG1       LYS  86  -9.457   6.050   8.167
  692   2HG   LYS  86          HG2       LYS  86 -10.634   7.034   9.039
  693   1HD   LYS  86          HD1       LYS  86  -9.435   6.493  11.162
  694   2HD   LYS  86          HD2       LYS  86  -8.214   5.643  10.215
  695   1HE   LYS  86          HE1       LYS  86  -8.904   8.557   9.813
  696   2HE   LYS  86          HE2       LYS  86  -7.617   8.005  10.883
  697   1HZ   LYS  86          HZ1       LYS  86  -7.765   7.426   7.974
  698   2HZ   LYS  86          HZ2       LYS  86  -6.496   7.022   9.017
  699   3HZ   LYS  86          HZ3       LYS  86  -6.818   8.645   8.674
  700    H    LYS  87           HN       LYS  87 -11.860   3.167   6.714
  701    HA   LYS  87           HA       LYS  87 -13.814   1.536   8.064
  702   1HB   LYS  87          HB1       LYS  87 -13.493   1.973   5.110
  703   2HB   LYS  87          HB2       LYS  87 -14.931   1.464   5.953
  704   1HG   LYS  87          HG1       LYS  87 -15.105   3.801   6.911
  705   2HG   LYS  87          HG2       LYS  87 -13.770   4.257   5.808
  706   1HD   LYS  87          HD1       LYS  87 -15.239   2.679   4.213
  707   2HD   LYS  87          HD2       LYS  87 -16.511   3.311   5.202
  708   1HE   LYS  87          HE1       LYS  87 -16.411   5.386   4.169
  709   2HE   LYS  87          HE2       LYS  87 -14.761   5.110   3.567
  710   1HZ   LYS  87          HZ1       LYS  87 -16.977   3.300   2.817
  711   2HZ   LYS  87          HZ2       LYS  87 -15.491   3.509   2.045
  712   3HZ   LYS  87          HZ3       LYS  87 -16.679   4.715   1.928
  713    H    GLU  88           HN       GLU  88 -13.299  -0.535   8.514
  714    HA   GLU  88           HA       GLU  88 -11.440  -2.185   7.274
  715   1HB   GLU  88          HB1       GLU  88 -12.524  -2.411   9.547
  716   2HB   GLU  88          HB2       GLU  88 -13.891  -3.153   8.721
  717   1HG   GLU  88          HG1       GLU  88 -12.174  -4.789   7.721
  718   2HG   GLU  88          HG2       GLU  88 -11.075  -4.186   8.969
  719    H    LYS  89           HN       LYS  89 -14.971  -2.126   6.651
  720    HA   LYS  89           HA       LYS  89 -15.098  -4.336   4.967
  721   1HB   LYS  89          HB1       LYS  89 -16.884  -1.968   4.539
  722   2HB   LYS  89          HB2       LYS  89 -17.277  -3.686   4.516
  723   1HG   LYS  89          HG1       LYS  89 -16.316  -2.443   7.057
  724   2HG   LYS  89          HG2       LYS  89 -17.981  -2.189   6.552
  725   1HD   LYS  89          HD1       LYS  89 -18.108  -4.053   7.969
  726   2HD   LYS  89          HD2       LYS  89 -18.071  -4.778   6.354
  727   1HE   LYS  89          HE1       LYS  89 -15.950  -5.595   6.612
  728   2HE   LYS  89          HE2       LYS  89 -15.446  -4.256   7.643
  729   1HZ   LYS  89          HZ1       LYS  89 -16.825  -6.746   8.374
  730   2HZ   LYS  89          HZ2       LYS  89 -17.054  -5.367   9.323
  731   3HZ   LYS  89          HZ3       LYS  89 -15.498  -5.990   9.113
  732    H    ASP  90           HN       ASP  90 -14.445  -1.019   4.246
  733    HA   ASP  90           HA       ASP  90 -14.264  -1.027   1.485
  734   1HB   ASP  90          HB1       ASP  90 -13.541   0.673   3.779
  735   2HB   ASP  90          HB2       ASP  90 -12.606   0.972   2.326
  736    H    ARG  91           HN       ARG  91 -11.634  -1.530   3.933
  737    HA   ARG  91           HA       ARG  91  -9.633  -1.956   1.934
  738   1HB   ARG  91          HB1       ARG  91  -9.430  -2.890   4.803
  739   2HB   ARG  91          HB2       ARG  91  -8.111  -2.648   3.665
  740   1HG   ARG  91          HG1       ARG  91  -8.454  -0.272   3.676
  741   2HG   ARG  91          HG2       ARG  91  -9.916  -0.438   4.636
  742   1HD   ARG  91          HD1       ARG  91  -7.063  -0.886   5.508
  743   2HD   ARG  91          HD2       ARG  91  -8.167   0.364   6.056
  744    HE   ARG  91           HE       ARG  91  -8.171  -2.144   6.147
  745   1HH1  ARG  91          HH21      ARG  91  -8.897   0.783   7.873
  746   2HH1  ARG  91          HH22      ARG  91  -9.600   0.196   9.340
  747   1HH2  ARG  91          HH11      ARG  91  -9.329  -3.125   8.513
  748   2HH2  ARG  91          HH12      ARG  91  -9.871  -1.982   9.690
  749    H    ASN  92           HN       ASN  92 -11.712  -4.181   3.753
  750    HA   ASN  92           HA       ASN  92 -10.621  -6.607   3.277
  751   1HB   ASN  92          HB1       ASN  92 -13.508  -5.754   3.224
  752   2HB   ASN  92          HB2       ASN  92 -13.040  -7.441   3.070
  753   1HD2  ASN  92          HD21      ASN  92 -14.659  -6.466   5.111
  754   2HD2  ASN  92          HD22      ASN  92 -13.762  -6.886   6.529
  755    H    ASP  93           HN       ASP  93 -12.889  -5.120   0.910
  756    HA   ASP  93           HA       ASP  93 -12.393  -6.895  -1.196
  757   1HB   ASP  93          HB1       ASP  93 -14.169  -4.927  -0.843
  758   2HB   ASP  93          HB2       ASP  93 -13.028  -4.067  -1.864
  759    H    LEU  94           HN       LEU  94 -10.691  -3.799  -0.436
  760    HA   LEU  94           HA       LEU  94  -9.063  -3.621  -2.642
  761   1HB   LEU  94          HB1       LEU  94  -9.206  -2.487   0.055
  762   2HB   LEU  94          HB2       LEU  94  -7.610  -2.561  -0.593
  763    HG   LEU  94           HG       LEU  94  -9.845  -1.349  -2.186
  764   1HD1  LEU  94          HD11      LEU  94  -9.630  -0.315   0.106
  765   2HD1  LEU  94          HD12      LEU  94  -9.389   0.791  -1.249
  766   3HD1  LEU  94          HD13      LEU  94  -7.999   0.179  -0.355
  767   1HD2  LEU  94          HD21      LEU  94  -8.187  -0.129  -3.362
  768   2HD2  LEU  94          HD22      LEU  94  -7.591  -1.787  -3.289
  769   3HD2  LEU  94          HD23      LEU  94  -6.931  -0.565  -2.202
  770    H    ILE  95           HN       ILE  95  -8.580  -5.550   0.287
  771    HA   ILE  95           HA       ILE  95  -5.929  -6.364  -0.132
  772    HB   ILE  95           HB       ILE  95  -8.154  -7.833   1.302
  773   1HG1  ILE  95          HG11      ILE  95  -6.049  -5.994   2.479
  774   2HG1  ILE  95          HG12      ILE  95  -7.668  -5.449   2.050
  775   1HG2  ILE  95          HG21      ILE  95  -6.319  -8.865   2.624
  776   2HG2  ILE  95          HG22      ILE  95  -5.149  -8.123   1.533
  777   3HG2  ILE  95          HG23      ILE  95  -6.277  -9.333   0.922
  778   1HD1  ILE  95          HD11      ILE  95  -7.522  -5.930   4.433
  779   2HD1  ILE  95          HD12      ILE  95  -7.000  -7.579   4.087
  780   3HD1  ILE  95          HD13      ILE  95  -8.626  -7.059   3.646
  781    H    THR  96           HN       THR  96  -8.990  -7.994  -1.056
  782    HA   THR  96           HA       THR  96  -7.912 -10.171  -2.419
  783    HB   THR  96           HB       THR  96 -10.464  -8.802  -3.266
  784    HG1  THR  96           HG1      THR  96  -9.896  -9.716  -0.855
  785   1HG2  THR  96          HG21      THR  96  -9.686 -10.715  -4.641
  786   2HG2  THR  96          HG22      THR  96 -11.188 -11.069  -3.787
  787   3HG2  THR  96          HG23      THR  96  -9.660 -11.718  -3.190
  788    H    TYR  97           HN       TYR  97  -8.565  -6.886  -3.680
  789    HA   TYR  97           HA       TYR  97  -7.874  -7.439  -6.355
  790   1HB   TYR  97          HB1       TYR  97  -9.092  -5.440  -5.831
  791   2HB   TYR  97          HB2       TYR  97  -7.784  -4.851  -4.814
  792    HD1  TYR  97           HD1      TYR  97  -6.609  -3.086  -5.694
  793    HD2  TYR  97           HD2      TYR  97  -8.091  -6.128  -8.347
  794    HE1  TYR  97           HE1      TYR  97  -5.594  -1.891  -7.624
  795    HE2  TYR  97           HE2      TYR  97  -7.186  -4.879 -10.299
  796    HH   TYR  97           HH       TYR  97  -4.897  -2.720 -10.208
  797    H    LEU  98           HN       LEU  98  -5.820  -5.859  -3.856
  798    HA   LEU  98           HA       LEU  98  -3.443  -5.814  -5.328
  799   1HB   LEU  98          HB1       LEU  98  -4.251  -4.935  -2.869
  800   2HB   LEU  98          HB2       LEU  98  -3.167  -6.250  -2.426
  801    HG   LEU  98           HG       LEU  98  -1.361  -5.244  -3.777
  802   1HD1  LEU  98          HD11      LEU  98  -2.847  -4.137  -5.446
  803   2HD1  LEU  98          HD12      LEU  98  -1.622  -3.055  -4.784
  804   3HD1  LEU  98          HD13      LEU  98  -3.289  -2.954  -4.214
  805   1HD2  LEU  98          HD21      LEU  98  -1.551  -4.584  -1.421
  806   2HD2  LEU  98          HD22      LEU  98  -2.648  -3.279  -1.872
  807   3HD2  LEU  98          HD23      LEU  98  -0.969  -3.244  -2.410
  808    H    LYS  99           HN       LYS  99  -4.673  -8.206  -3.072
  809    HA   LYS  99           HA       LYS  99  -2.552 -10.018  -3.091
  810   1HB   LYS  99          HB1       LYS  99  -3.902 -10.595  -1.381
  811   2HB   LYS  99          HB2       LYS  99  -5.346 -10.001  -2.183
  812   1HG   LYS  99          HG1       LYS  99  -5.664 -12.041  -3.342
  813   2HG   LYS  99          HG2       LYS  99  -4.054 -12.611  -2.948
  814   1HD   LYS  99          HD1       LYS  99  -5.726 -12.124  -0.588
  815   2HD   LYS  99          HD2       LYS  99  -6.382 -13.347  -1.681
  816   1HE   LYS  99          HE1       LYS  99  -4.959 -14.415  -0.055
  817   2HE   LYS  99          HE2       LYS  99  -4.209 -14.511  -1.642
  818   1HZ   LYS  99          HZ1       LYS  99  -2.415 -13.746  -0.630
  819   2HZ   LYS  99          HZ2       LYS  99  -3.267 -13.284   0.762
  820   3HZ   LYS  99          HZ3       LYS  99  -3.202 -12.239  -0.568
  821    H    LYS 100           HN       LYS 100  -5.292  -9.700  -5.331
  822    HA   LYS 100           HA       LYS 100  -4.776 -12.045  -6.819
  823   1HB   LYS 100          HB1       LYS 100  -6.940 -10.782  -6.644
  824   2HB   LYS 100          HB2       LYS 100  -6.298  -9.680  -7.840
  825   1HG   LYS 100          HG1       LYS 100  -7.866 -11.382  -8.767
  826   2HG   LYS 100          HG2       LYS 100  -6.270 -11.424  -9.521
  827   1HD   LYS 100          HD1       LYS 100  -6.168 -13.125  -7.301
  828   2HD   LYS 100          HD2       LYS 100  -7.692 -13.458  -8.063
  829   1HE   LYS 100          HE1       LYS 100  -6.230 -15.117  -8.790
  830   2HE   LYS 100          HE2       LYS 100  -6.306 -13.991 -10.154
  831   1HZ   LYS 100          HZ1       LYS 100  -4.165 -14.079  -8.072
  832   2HZ   LYS 100          HZ2       LYS 100  -4.277 -12.917  -9.294
  833   3HZ   LYS 100          HZ3       LYS 100  -4.008 -14.539  -9.697
  834    H    ALA 101           HN       ALA 101  -3.628  -8.880  -7.196
  835    HA   ALA 101           HA       ALA 101  -2.341  -9.031  -9.706
  836   1HB   ALA 101          HB1       ALA 101  -1.474  -6.833  -9.077
  837   2HB   ALA 101          HB2       ALA 101  -2.027  -7.080  -7.421
  838   3HB   ALA 101          HB3       ALA 101  -3.200  -6.961  -8.734
  839    H    THR 102           HN       THR 102  -1.224  -9.591  -6.396
  840    HA   THR 102           HA       THR 102   1.520 -10.144  -7.182
  841    HB   THR 102           HB       THR 102   0.480 -10.593  -4.410
  842    HG1  THR 102           HG1      THR 102  -0.098  -8.415  -5.393
  843   1HG2  THR 102          HG21      THR 102   2.703  -9.821  -3.770
  844   2HG2  THR 102          HG22      THR 102   3.092  -9.484  -5.457
  845   3HG2  THR 102          HG23      THR 102   2.832 -11.146  -4.927
  846    H    GLU 103           HN       GLU 103  -1.331 -11.909  -6.011
  847    HA   GLU 103           HA       GLU 103   0.021 -14.438  -6.722
  848   1HB   GLU 103          HB1       GLU 103  -2.111 -14.087  -4.604
  849   2HB   GLU 103          HB2       GLU 103  -1.239 -15.564  -4.981
  850   1HG   GLU 103          HG1       GLU 103   0.831 -14.563  -4.187
  851   2HG   GLU 103          HG2       GLU 103  -0.020 -13.057  -3.845
  852    HHA  HEC 104           HA       HEC 104   5.087   3.373   1.427
  853    HHB  HEC 104           HB       HEC 104  -0.540   0.411   0.101
  854    HHC  HEC 104           HC       HEC 104  -3.093   6.121  -1.598
  855    HHD  HEC 104           HD       HEC 104   2.819   8.721  -1.449
  856   1HMA  HEC 104          HMA1      HEC 104   1.225  -0.957   1.971
  857   2HMA  HEC 104          HMA2      HEC 104   2.764  -1.321   1.188
  858   3HMA  HEC 104          HMA3      HEC 104   1.295  -1.178   0.223
  859   1HAA  HEC 104          HAA1      HEC 104   4.271  -0.291   2.124
  860   2HAA  HEC 104          HAA2      HEC 104   4.928   1.291   2.500
  861   1HBA  HEC 104          HBA1      HEC 104   5.843   1.427   0.196
  862   2HBA  HEC 104          HBA2      HEC 104   5.243  -0.195  -0.113
  863   1HMB  HEC 104          HMB1      HEC 104  -2.402   0.073  -0.563
  864   2HMB  HEC 104          HMB2      HEC 104  -3.298   0.648  -1.969
  865   3HMB  HEC 104          HMB3      HEC 104  -3.998   0.796  -0.358
  866    HAB  HEC 104           HAB      HEC 104  -4.484   4.779  -1.662
  867   1HBB  HEC 104          HBB1      HEC 104  -4.855   3.578   0.630
  868   2HBB  HEC 104          HBB2      HEC 104  -5.820   2.488  -0.364
  869   3HBB  HEC 104          HBB3      HEC 104  -6.191   4.212  -0.331
  870   1HMC  HEC 104          HMC1      HEC 104  -3.168   8.686  -1.788
  871   2HMC  HEC 104          HMC2      HEC 104  -2.788   7.947  -3.343
  872   3HMC  HEC 104          HMC3      HEC 104  -2.203   9.568  -2.971
  873    HAC  HEC 104           HAC      HEC 104   1.640   9.746  -2.764
  874   1HBC  HEC 104          HBC1      HEC 104   0.797  11.145  -1.125
  875   2HBC  HEC 104          HBC2      HEC 104  -0.849  11.053  -1.751
  876   3HBC  HEC 104          HBC3      HEC 104   0.394  11.916  -2.659
  877   1HMD  HEC 104          HMD1      HEC 104   4.928   9.150  -0.495
  878   2HMD  HEC 104          HMD2      HEC 104   5.419   8.154  -1.865
  879   3HMD  HEC 104          HMD3      HEC 104   6.407   8.194  -0.405
  880   1HAD  HEC 104          HAD1      HEC 104   7.212   6.338   0.412
  881   2HAD  HEC 104          HAD2      HEC 104   6.758   4.798   1.134
  882   1HBD  HEC 104          HBD1      HEC 104   6.186   5.764   3.162
  883   2HBD  HEC 104          HBD2      HEC 104   5.866   7.329   2.447
  884    H2   4NL 105           H2       4NL 105   0.065 -12.280  -1.252
  885    H6   4NL 105           H6       4NL 105   3.056 -12.751   2.708
  886    H3   4NL 105           H3       4NL 105  -1.721 -10.429   2.247
  887    H5   4NL 105           H5       4NL 105  -2.531 -10.184   0.169
  888    H4   4NL 105           H4       4NL 105   0.051 -11.456   3.696
  889    H1   4NL 105           H1       4NL 105   1.837 -13.308   0.195
  890    H7   4NL 105           H7       4NL 105   1.821 -13.690   3.582
  Start of MODEL    6
    1   1H    THR  -5          HT1       THR  -5 -13.164  -5.986  13.472
    2   2H    THR  -5          HT2       THR  -5 -12.389  -5.455  12.064
    3   3H    THR  -5          HT3       THR  -5 -11.552  -5.463  13.534
    4    HA   THR  -5           HA       THR  -5 -10.968  -7.317  12.007
    5    HB   THR  -5           HB       THR  -5 -12.178  -8.628  14.390
    6    HG1  THR  -5           HG1      THR  -5 -10.545  -7.556  15.707
    7   1HG2  THR  -5          HG21      THR  -5 -10.418  -9.661  12.965
    8   2HG2  THR  -5          HG22      THR  -5  -9.919  -9.479  14.646
    9   3HG2  THR  -5          HG23      THR  -5  -9.325  -8.354  13.424
   10    H    GLU  -4           HN       GLU  -4 -13.086  -6.800  10.567
   11    HA   GLU  -4           HA       GLU  -4 -14.665  -9.269  10.547
   12   1HB   GLU  -4          HB1       GLU  -4 -15.930  -7.193  11.549
   13   2HB   GLU  -4          HB2       GLU  -4 -15.976  -6.627   9.884
   14   1HG   GLU  -4          HG1       GLU  -4 -16.929  -9.388  10.536
   15   2HG   GLU  -4          HG2       GLU  -4 -17.969  -8.007  10.863
   16    H    PHE  -3           HN       PHE  -3 -12.729  -9.492   9.068
   17    HA   PHE  -3           HA       PHE  -3 -12.691  -8.031   6.618
   18   1HB   PHE  -3          HB1       PHE  -3 -10.573  -8.744   7.359
   19   2HB   PHE  -3          HB2       PHE  -3 -11.109 -10.406   7.568
   20    HD1  PHE  -3           HD1      PHE  -3 -10.386  -7.804   4.980
   21    HD2  PHE  -3           HD2      PHE  -3 -10.867 -11.992   5.830
   22    HE1  PHE  -3           HE1      PHE  -3  -9.669  -8.354   2.663
   23    HE2  PHE  -3           HE2      PHE  -3 -10.198 -12.542   3.499
   24    HZ   PHE  -3           HZ       PHE  -3  -9.628 -10.720   1.903
   25    H    LYS  -2           HN       LYS  -2 -14.081  -8.188   5.146
   26    HA   LYS  -2           HA       LYS  -2 -15.406 -10.701   4.440
   27   1HB   LYS  -2          HB1       LYS  -2 -16.211  -7.860   4.517
   28   2HB   LYS  -2          HB2       LYS  -2 -16.730  -8.722   3.071
   29   1HG   LYS  -2          HG1       LYS  -2 -17.698 -10.495   4.540
   30   2HG   LYS  -2          HG2       LYS  -2 -17.301  -9.495   5.935
   31   1HD   LYS  -2          HD1       LYS  -2 -18.763  -7.707   5.038
   32   2HD   LYS  -2          HD2       LYS  -2 -19.183  -8.752   3.682
   33   1HE   LYS  -2          HE1       LYS  -2 -20.973  -8.912   5.238
   34   2HE   LYS  -2          HE2       LYS  -2 -20.062 -10.412   5.370
   35   1HZ   LYS  -2          HZ1       LYS  -2 -19.898  -8.099   7.232
   36   2HZ   LYS  -2          HZ2       LYS  -2 -18.979  -9.509   7.356
   37   3HZ   LYS  -2          HZ3       LYS  -2 -20.656  -9.586   7.536
   38    H    ALA  -1           HN       ALA  -1 -14.638 -11.703   2.761
   39    HA   ALA  -1           HA       ALA  -1 -12.528 -10.937   1.156
   40   1HB   ALA  -1          HB1       ALA  -1 -13.173 -13.245   1.522
   41   2HB   ALA  -1          HB2       ALA  -1 -13.126 -12.900  -0.208
   42   3HB   ALA  -1          HB3       ALA  -1 -14.675 -12.993   0.632
   43    H    GLY   1           HN       GLY   1 -12.299 -10.123  -0.884
   44   1HA   GLY   1          HA1       GLY   1 -14.611  -8.765  -2.112
   45   2HA   GLY   1          HA2       GLY   1 -12.957  -8.174  -2.166
   46    H    SER   2           HN       SER   2 -12.716  -8.097  -4.317
   47    HA   SER   2           HA       SER   2 -12.070 -10.478  -5.760
   48   1HB   SER   2          HB1       SER   2 -14.018  -9.062  -7.396
   49   2HB   SER   2          HB2       SER   2 -13.893 -10.790  -7.042
   50    HG   SER   2           HG       SER   2 -14.972 -10.426  -5.090
   51    H    ALA   3           HN       ALA   3 -10.692 -10.026  -7.458
   52    HA   ALA   3           HA       ALA   3  -9.247  -7.719  -7.561
   53   1HB   ALA   3          HB1       ALA   3  -8.695  -9.943  -8.565
   54   2HB   ALA   3          HB2       ALA   3  -8.263  -8.548  -9.554
   55   3HB   ALA   3          HB3       ALA   3  -9.696  -9.496  -9.947
   56    H    LYS   4           HN       LYS   4 -12.120  -8.344  -9.664
   57    HA   LYS   4           HA       LYS   4 -11.844  -5.886 -11.047
   58   1HB   LYS   4          HB1       LYS   4 -12.917  -8.004 -11.911
   59   2HB   LYS   4          HB2       LYS   4 -14.357  -7.510 -11.022
   60   1HG   LYS   4          HG1       LYS   4 -13.432  -5.250 -12.477
   61   2HG   LYS   4          HG2       LYS   4 -13.451  -6.620 -13.581
   62   1HD   LYS   4          HD1       LYS   4 -15.726  -6.768 -13.563
   63   2HD   LYS   4          HD2       LYS   4 -15.850  -6.265 -11.873
   64   1HE   LYS   4          HE1       LYS   4 -14.980  -4.302 -13.976
   65   2HE   LYS   4          HE2       LYS   4 -16.694  -4.651 -13.746
   66   1HZ   LYS   4          HZ1       LYS   4 -16.686  -3.751 -11.650
   67   2HZ   LYS   4          HZ2       LYS   4 -15.600  -2.731 -12.447
   68   3HZ   LYS   4          HZ3       LYS   4 -15.017  -3.954 -11.436
   69    H    LYS   5           HN       LYS   5 -12.610  -6.078  -7.937
   70    HA   LYS   5           HA       LYS   5 -14.515  -3.826  -8.041
   71   1HB   LYS   5          HB1       LYS   5 -14.044  -5.822  -5.816
   72   2HB   LYS   5          HB2       LYS   5 -15.016  -4.368  -5.635
   73   1HG   LYS   5          HG1       LYS   5 -16.221  -5.406  -7.798
   74   2HG   LYS   5          HG2       LYS   5 -15.635  -6.896  -7.055
   75   1HD   LYS   5          HD1       LYS   5 -16.917  -5.000  -5.192
   76   2HD   LYS   5          HD2       LYS   5 -17.993  -5.676  -6.415
   77   1HE   LYS   5          HE1       LYS   5 -17.988  -7.022  -4.349
   78   2HE   LYS   5          HE2       LYS   5 -17.387  -7.939  -5.730
   79   1HZ   LYS   5          HZ1       LYS   5 -15.455  -6.519  -4.040
   80   2HZ   LYS   5          HZ2       LYS   5 -15.272  -7.950  -4.935
   81   3HZ   LYS   5          HZ3       LYS   5 -16.128  -7.971  -3.475
   82    H    GLY   6           HN       GLY   6 -11.808  -5.062  -6.038
   83   1HA   GLY   6          HA1       GLY   6 -11.180  -2.676  -4.736
   84   2HA   GLY   6          HA2       GLY   6 -10.034  -3.966  -5.066
   85    H    ALA   7           HN       ALA   7 -10.243  -3.739  -7.985
   86    HA   ALA   7           HA       ALA   7  -8.224  -1.915  -8.531
   87   1HB   ALA   7          HB1       ALA   7 -10.214  -3.024 -10.512
   88   2HB   ALA   7          HB2       ALA   7  -8.780  -3.873  -9.935
   89   3HB   ALA   7          HB3       ALA   7  -8.607  -2.386 -10.865
   90    H    THR   8           HN       THR   8 -11.787  -1.439  -9.013
   91    HA   THR   8           HA       THR   8 -11.479   1.136 -10.164
   92    HB   THR   8           HB       THR   8 -13.959   1.340  -9.126
   93    HG1  THR   8           HG1      THR   8 -13.713  -0.785  -8.176
   94   1HG2  THR   8          HG21      THR   8 -13.206  -0.256 -11.578
   95   2HG2  THR   8          HG22      THR   8 -13.370   1.499 -11.502
   96   3HG2  THR   8          HG23      THR   8 -14.782   0.470 -11.257
   97    H    LEU   9           HN       LEU   9 -11.807   0.160  -6.790
   98    HA   LEU   9           HA       LEU   9 -12.213   2.721  -5.670
   99   1HB   LEU   9          HB1       LEU   9 -10.974   0.289  -4.344
  100   2HB   LEU   9          HB2       LEU   9 -11.716   1.667  -3.534
  101    HG   LEU   9           HG       LEU   9 -13.225  -0.170  -5.407
  102   1HD1  LEU   9          HD11      LEU   9 -13.301  -0.140  -2.389
  103   2HD1  LEU   9          HD12      LEU   9 -12.377  -1.309  -3.332
  104   3HD1  LEU   9          HD13      LEU   9 -14.134  -1.253  -3.474
  105   1HD2  LEU   9          HD21      LEU   9 -14.279   1.757  -3.327
  106   2HD2  LEU   9          HD22      LEU   9 -15.208   0.847  -4.518
  107   3HD2  LEU   9          HD23      LEU   9 -14.143   2.152  -5.042
  108    H    PHE  10           HN       PHE  10  -9.274   0.690  -5.728
  109    HA   PHE  10           HA       PHE  10  -7.414   2.522  -4.804
  110   1HB   PHE  10          HB1       PHE  10  -6.357   0.550  -4.902
  111   2HB   PHE  10          HB2       PHE  10  -7.421  -0.050  -6.164
  112    HD1  PHE  10           HD1      PHE  10  -6.751  -0.037  -8.489
  113    HD2  PHE  10           HD2      PHE  10  -4.278   1.747  -5.457
  114    HE1  PHE  10           HE1      PHE  10  -4.849   0.071 -10.097
  115    HE2  PHE  10           HE2      PHE  10  -2.425   1.970  -7.098
  116    HZ   PHE  10           HZ       PHE  10  -2.696   1.111  -9.411
  117    H    LYS  11           HN       LYS  11  -8.693   2.139  -8.066
  118    HA   LYS  11           HA       LYS  11  -6.791   3.661  -9.460
  119   1HB   LYS  11          HB1       LYS  11  -8.911   2.077 -10.153
  120   2HB   LYS  11          HB2       LYS  11  -9.471   3.679 -10.637
  121   1HG   LYS  11          HG1       LYS  11  -7.484   4.027 -11.976
  122   2HG   LYS  11          HG2       LYS  11  -6.801   2.502 -11.419
  123   1HD   LYS  11          HD1       LYS  11  -9.277   2.843 -13.125
  124   2HD   LYS  11          HD2       LYS  11  -7.703   2.263 -13.673
  125   1HE   LYS  11          HE1       LYS  11  -9.662   0.893 -11.831
  126   2HE   LYS  11          HE2       LYS  11  -9.054   0.328 -13.384
  127   1HZ   LYS  11          HZ1       LYS  11  -7.835  -0.921 -11.918
  128   2HZ   LYS  11          HZ2       LYS  11  -7.743   0.301 -10.755
  129   3HZ   LYS  11          HZ3       LYS  11  -6.784   0.391 -12.143
  130    H    THR  12           HN       THR  12  -9.018   4.847  -7.258
  131    HA   THR  12           HA       THR  12  -8.559   7.593  -8.084
  132    HB   THR  12           HB       THR  12 -10.821   6.561  -8.884
  133    HG1  THR  12           HG1      THR  12 -10.065   8.696  -9.181
  134   1HG2  THR  12          HG21      THR  12 -11.856   5.929  -6.833
  135   2HG2  THR  12          HG22      THR  12 -12.699   7.355  -7.442
  136   3HG2  THR  12          HG23      THR  12 -11.543   7.511  -6.118
  137    H    ARG  13           HN       ARG  13  -7.817   5.623  -5.915
  138    HA   ARG  13           HA       ARG  13  -8.146   7.364  -3.562
  139   1HB   ARG  13          HB1       ARG  13  -8.403   4.370  -3.736
  140   2HB   ARG  13          HB2       ARG  13  -8.033   5.172  -2.225
  141   1HG   ARG  13          HG1       ARG  13 -10.527   5.553  -3.870
  142   2HG   ARG  13          HG2       ARG  13 -10.389   4.597  -2.402
  143   1HD   ARG  13          HD1       ARG  13 -11.237   6.496  -1.480
  144   2HD   ARG  13          HD2       ARG  13  -9.531   6.961  -1.459
  145    HE   ARG  13           HE       ARG  13 -10.102   7.525  -3.769
  146   1HH1  ARG  13          HH11      ARG  13 -12.076   8.193  -0.963
  147   2HH1  ARG  13          HH12      ARG  13 -12.519   9.825  -1.310
  148   1HH2  ARG  13          HH21      ARG  13 -10.780  10.033  -4.249
  149   2HH2  ARG  13          HH22      ARG  13 -11.792  10.840  -3.103
  150    H    CYS  14           HN       CYS  14  -6.123   5.132  -5.328
  151    HA   CYS  14           HA       CYS  14  -3.784   5.912  -3.720
  152   1HB   CYS  14          HB1       CYS  14  -4.038   3.169  -4.883
  153   2HB   CYS  14          HB2       CYS  14  -2.999   3.721  -3.588
  154    H    LEU  15           HN       LEU  15  -5.040   5.078  -6.902
  155    HA   LEU  15           HA       LEU  15  -2.796   4.825  -8.432
  156   1HB   LEU  15          HB1       LEU  15  -5.257   4.693  -9.092
  157   2HB   LEU  15          HB2       LEU  15  -5.184   6.436  -9.313
  158    HG   LEU  15           HG       LEU  15  -3.280   6.073 -10.935
  159   1HD1  LEU  15          HD11      LEU  15  -4.087   3.198 -10.555
  160   2HD1  LEU  15          HD12      LEU  15  -2.482   3.908 -10.373
  161   3HD1  LEU  15          HD13      LEU  15  -3.212   3.775 -11.974
  162   1HD2  LEU  15          HD21      LEU  15  -4.875   4.918 -12.685
  163   2HD2  LEU  15          HD22      LEU  15  -5.215   6.540 -12.082
  164   3HD2  LEU  15          HD23      LEU  15  -6.074   5.151 -11.413
  165    H    GLN  16           HN       GLN  16  -4.162   7.888  -7.288
  166    HA   GLN  16           HA       GLN  16  -2.953   9.821  -8.677
  167   1HB   GLN  16          HB1       GLN  16  -2.812  11.057  -6.388
  168   2HB   GLN  16          HB2       GLN  16  -4.370  10.586  -7.048
  169   1HG   GLN  16          HG1       GLN  16  -3.596   8.393  -5.514
  170   2HG   GLN  16          HG2       GLN  16  -3.101   9.792  -4.563
  171   1HE2  GLN  16          HE21      GLN  16  -4.750  11.240  -3.814
  172   2HE2  GLN  16          HE22      GLN  16  -6.410  10.776  -3.822
  173    H    CYS  17           HN       CYS  17  -1.195   7.828  -6.331
  174    HA   CYS  17           HA       CYS  17   1.303   9.180  -7.087
  175   1HB   CYS  17          HB1       CYS  17   1.148   7.917  -4.411
  176   2HB   CYS  17          HB2       CYS  17   2.003   9.348  -4.959
  177    H    HIS  18           HN       HIS  18  -0.169   6.082  -6.235
  178    HA   HIS  18           HA       HIS  18   2.343   4.622  -6.521
  179   1HB   HIS  18          HB1       HIS  18  -0.386   3.962  -5.474
  180   2HB   HIS  18          HB2       HIS  18   0.772   2.691  -5.819
  181    HD1  HIS  18           HD1      HIS  18   3.226   3.130  -4.409
  182    HD2  HIS  18           HD2      HIS  18  -0.353   4.810  -3.032
  183    HE1  HIS  18           HE1      HIS  18   3.563   3.572  -1.934
  184    H    THR  19           HN       THR  19   1.887   2.330  -7.381
  185    HA   THR  19           HA       THR  19   0.330   2.182  -9.830
  186    HB   THR  19           HB       THR  19   2.656   1.033 -10.660
  187    HG1  THR  19           HG1      THR  19   4.226   2.736 -10.235
  188   1HG2  THR  19          HG21      THR  19   2.987   3.002 -12.059
  189   2HG2  THR  19          HG22      THR  19   1.899   3.933 -11.030
  190   3HG2  THR  19          HG23      THR  19   1.277   2.582 -11.976
  191    H    VAL  20           HN       VAL  20  -0.764   0.280  -9.810
  192    HA   VAL  20           HA       VAL  20  -0.249  -1.750  -7.860
  193    HB   VAL  20           HB       VAL  20  -2.444  -0.819  -9.034
  194   1HG1  VAL  20          HG11      VAL  20  -2.083  -1.859 -11.184
  195   2HG1  VAL  20          HG12      VAL  20  -3.520  -2.516 -10.399
  196   3HG1  VAL  20          HG13      VAL  20  -2.025  -3.452 -10.426
  197   1HG2  VAL  20          HG21      VAL  20  -2.205  -3.548  -7.786
  198   2HG2  VAL  20          HG22      VAL  20  -3.707  -2.656  -8.017
  199   3HG2  VAL  20          HG23      VAL  20  -2.461  -2.018  -6.948
  200    H    GLU  21           HN       GLU  21   0.398  -1.512 -11.256
  201    HA   GLU  21           HA       GLU  21   1.405  -4.266 -11.416
  202   1HB   GLU  21          HB1       GLU  21   1.555  -3.441 -13.961
  203   2HB   GLU  21          HB2       GLU  21   0.073  -4.098 -13.293
  204   1HG   GLU  21          HG1       GLU  21  -0.249  -2.054 -14.684
  205   2HG   GLU  21          HG2       GLU  21  -0.879  -1.909 -13.046
  206    H    LYS  22           HN       LYS  22   3.464  -4.163 -13.215
  207    HA   LYS  22           HA       LYS  22   5.262  -2.186 -12.033
  208   1HB   LYS  22          HB1       LYS  22   5.544  -4.953 -12.531
  209   2HB   LYS  22          HB2       LYS  22   6.757  -4.099 -13.498
  210   1HG   LYS  22          HG1       LYS  22   7.795  -3.185 -11.672
  211   2HG   LYS  22          HG2       LYS  22   6.311  -3.141 -10.720
  212   1HD   LYS  22          HD1       LYS  22   6.460  -5.453 -10.221
  213   2HD   LYS  22          HD2       LYS  22   7.736  -5.696 -11.414
  214   1HE   LYS  22          HE1       LYS  22   8.758  -5.706  -9.246
  215   2HE   LYS  22          HE2       LYS  22   9.220  -4.219 -10.052
  216   1HZ   LYS  22          HZ1       LYS  22   7.381  -3.134  -8.698
  217   2HZ   LYS  22          HZ2       LYS  22   8.742  -3.639  -7.836
  218   3HZ   LYS  22          HZ3       LYS  22   7.328  -4.560  -7.788
  219    H    GLY  23           HN       GLY  23   3.499  -1.636 -14.484
  220   1HA   GLY  23          HA1       GLY  23   5.594  -1.012 -16.456
  221   2HA   GLY  23          HA2       GLY  23   3.863  -0.958 -16.746
  222    H    GLY  24           HN       GLY  24   3.532   0.582 -14.151
  223   1HA   GLY  24          HA1       GLY  24   3.821   3.247 -15.217
  224   2HA   GLY  24          HA2       GLY  24   3.009   2.783 -13.731
  225    HA   PRO  25           HA       PRO  25   7.750   3.925 -13.109
  226   1HB   PRO  25          HB1       PRO  25   7.738   6.668 -13.415
  227   2HB   PRO  25          HB2       PRO  25   8.332   5.528 -14.626
  228   1HG   PRO  25          HG1       PRO  25   5.688   6.912 -14.459
  229   2HG   PRO  25          HG2       PRO  25   6.695   6.584 -15.881
  230   1HD   PRO  25          HD1       PRO  25   4.523   5.105 -15.313
  231   2HD   PRO  25          HD2       PRO  25   5.977   4.387 -16.038
  232    H    HIS  26           HN       HIS  26   8.384   4.709 -11.081
  233    HA   HIS  26           HA       HIS  26   6.456   4.913  -9.068
  234   1HB   HIS  26          HB1       HIS  26   9.339   5.839  -9.073
  235   2HB   HIS  26          HB2       HIS  26   8.361   5.577  -7.640
  236    HD2  HIS  26           HD2      HIS  26  10.452   3.722 -10.249
  237    HE1  HIS  26           HE1      HIS  26   9.279   0.827  -7.372
  238    HE2  HIS  26           HE2      HIS  26  10.777   1.285  -9.370
  239    H    LYS  27           HN       LYS  27   5.076   6.597  -8.738
  240    HA   LYS  27           HA       LYS  27   5.741   9.270  -9.677
  241   1HB   LYS  27          HB1       LYS  27   3.219   7.801  -9.042
  242   2HB   LYS  27          HB2       LYS  27   3.204   9.558  -8.987
  243   1HG   LYS  27          HG1       LYS  27   3.620   9.772 -11.265
  244   2HG   LYS  27          HG2       LYS  27   4.328   8.157 -11.388
  245   1HD   LYS  27          HD1       LYS  27   1.399   8.850 -11.031
  246   2HD   LYS  27          HD2       LYS  27   2.155   8.088 -12.437
  247   1HE   LYS  27          HE1       LYS  27   2.433   6.053 -11.354
  248   2HE   LYS  27          HE2       LYS  27   2.407   6.788  -9.750
  249   1HZ   LYS  27          HZ1       LYS  27   0.388   5.562 -10.132
  250   2HZ   LYS  27          HZ2       LYS  27   0.078   6.424 -11.551
  251   3HZ   LYS  27          HZ3       LYS  27   0.028   7.218 -10.060
  252    H    VAL  28           HN       VAL  28   3.687  10.158  -7.448
  253    HA   VAL  28           HA       VAL  28   5.522  11.249  -5.627
  254    HB   VAL  28           HB       VAL  28   2.612  10.766  -5.013
  255   1HG1  VAL  28          HG11      VAL  28   4.421  13.071  -4.274
  256   2HG1  VAL  28          HG12      VAL  28   4.082  11.696  -3.224
  257   3HG1  VAL  28          HG13      VAL  28   2.777  12.782  -3.703
  258   1HG2  VAL  28          HG21      VAL  28   2.032  12.847  -6.104
  259   2HG2  VAL  28          HG22      VAL  28   2.794  11.780  -7.283
  260   3HG2  VAL  28          HG23      VAL  28   3.710  13.112  -6.579
  261    H    GLY  29           HN       GLY  29   4.058   8.152  -5.804
  262   1HA   GLY  29          HA1       GLY  29   5.235   7.302  -3.238
  263   2HA   GLY  29          HA2       GLY  29   3.655   6.743  -3.764
  264    HA   PRO  30           HA       PRO  30   7.311   4.073  -5.432
  265   1HB   PRO  30          HB1       PRO  30   7.196   1.999  -3.691
  266   2HB   PRO  30          HB2       PRO  30   8.212   3.422  -3.432
  267   1HG   PRO  30          HG1       PRO  30   5.510   2.796  -2.296
  268   2HG   PRO  30          HG2       PRO  30   6.947   3.432  -1.473
  269   1HD   PRO  30          HD1       PRO  30   4.917   5.027  -2.242
  270   2HD   PRO  30          HD2       PRO  30   6.605   5.576  -2.265
  271    H    ASN  31           HN       ASN  31   7.148   1.650  -6.038
  272    HA   ASN  31           HA       ASN  31   4.556   1.201  -7.223
  273   1HB   ASN  31          HB1       ASN  31   6.670   0.877  -8.471
  274   2HB   ASN  31          HB2       ASN  31   7.133  -0.404  -7.360
  275   1HD2  ASN  31          HD21      ASN  31   4.728   0.458  -9.828
  276   2HD2  ASN  31          HD22      ASN  31   4.393  -1.185 -10.269
  277    H    LEU  32           HN       LEU  32   3.132  -0.477  -6.709
  278    HA   LEU  32           HA       LEU  32   3.265  -1.643  -4.055
  279   1HB   LEU  32          HB1       LEU  32   0.999  -1.501  -6.048
  280   2HB   LEU  32          HB2       LEU  32   0.870  -2.046  -4.387
  281    HG   LEU  32           HG       LEU  32   1.815   0.748  -5.014
  282   1HD1  LEU  32          HD11      LEU  32  -0.504   1.518  -4.779
  283   2HD1  LEU  32          HD12      LEU  32  -1.055  -0.155  -4.704
  284   3HD1  LEU  32          HD13      LEU  32  -0.319   0.463  -6.182
  285   1HD2  LEU  32          HD21      LEU  32   2.033  -0.142  -2.688
  286   2HD2  LEU  32          HD22      LEU  32   0.281  -0.339  -2.647
  287   3HD2  LEU  32          HD23      LEU  32   0.983   1.270  -2.815
  288    H    HIS  33           HN       HIS  33   3.339  -2.717  -7.384
  289    HA   HIS  33           HA       HIS  33   2.602  -5.384  -7.240
  290   1HB   HIS  33          HB1       HIS  33   3.069  -3.795  -9.248
  291   2HB   HIS  33          HB2       HIS  33   4.729  -4.364  -9.103
  292    HD2  HIS  33           HD2      HIS  33   1.822  -6.806  -8.496
  293    HE1  HIS  33           HE1      HIS  33   3.478  -7.794 -12.283
  294    HE2  HIS  33           HE2      HIS  33   1.874  -8.537 -10.457
  295    H    GLY  34           HN       GLY  34   3.487  -6.425  -5.463
  296   1HA   GLY  34          HA1       GLY  34   5.153  -8.215  -5.161
  297   2HA   GLY  34          HA2       GLY  34   6.377  -7.023  -5.545
  298    H    ILE  35           HN       ILE  35   4.096  -5.491  -3.544
  299    HA   ILE  35           HA       ILE  35   5.922  -5.449  -1.384
  300    HB   ILE  35           HB       ILE  35   4.286  -4.257  -0.068
  301   1HG1  ILE  35          HG11      ILE  35   2.348  -5.056  -2.196
  302   2HG1  ILE  35          HG12      ILE  35   2.098  -4.838  -0.466
  303   1HG2  ILE  35          HG21      ILE  35   5.799  -3.142  -1.596
  304   2HG2  ILE  35          HG22      ILE  35   4.281  -2.258  -1.447
  305   3HG2  ILE  35          HG23      ILE  35   4.596  -3.232  -2.883
  306   1HD1  ILE  35          HD11      ILE  35   0.874  -3.134  -1.647
  307   2HD1  ILE  35          HD12      ILE  35   2.315  -2.661  -2.550
  308   3HD1  ILE  35          HD13      ILE  35   2.229  -2.369  -0.814
  309    H    PHE  36           HN       PHE  36   2.966  -7.392  -1.814
  310    HA   PHE  36           HA       PHE  36   2.800  -8.452   0.750
  311   1HB   PHE  36          HB1       PHE  36   1.835  -9.360  -1.929
  312   2HB   PHE  36          HB2       PHE  36   1.715 -10.458  -0.555
  313    HD1  PHE  36           HD1      PHE  36   1.142  -8.585   1.653
  314    HD2  PHE  36           HD2      PHE  36  -0.394  -8.718  -2.363
  315    HE1  PHE  36           HE1      PHE  36  -0.906  -7.391   2.406
  316    HE2  PHE  36           HE2      PHE  36  -2.444  -7.523  -1.614
  317    HZ   PHE  36           HZ       PHE  36  -2.696  -6.849   0.767
  318    H    GLY  37           HN       GLY  37   4.281  -9.409   1.836
  319   1HA   GLY  37          HA1       GLY  37   5.513 -11.333   2.448
  320   2HA   GLY  37          HA2       GLY  37   5.863 -11.628   0.756
  321    H    ARG  38           HN       ARG  38   6.408  -8.410   1.063
  322    HA   ARG  38           HA       ARG  38   9.296  -8.735   1.491
  323   1HB   ARG  38          HB1       ARG  38   7.574  -6.887  -0.107
  324   2HB   ARG  38          HB2       ARG  38   9.084  -6.239   0.517
  325   1HG   ARG  38          HG1       ARG  38  10.324  -8.025  -0.626
  326   2HG   ARG  38          HG2       ARG  38   8.805  -8.666  -1.257
  327   1HD   ARG  38          HD1       ARG  38   8.491  -6.864  -2.702
  328   2HD   ARG  38          HD2       ARG  38   9.538  -5.801  -1.760
  329    HE   ARG  38           HE       ARG  38  10.850  -7.470  -2.154
  330   1HH1  ARG  38          HH21      ARG  38   8.851  -6.052  -4.578
  331   2HH1  ARG  38          HH22      ARG  38  10.099  -5.851  -5.697
  332   1HH2  ARG  38          HH11      ARG  38  12.503  -7.705  -4.459
  333   2HH2  ARG  38          HH12      ARG  38  11.545  -7.420  -5.846
  334    H    HIS  39           HN       HIS  39  10.323  -6.696   2.451
  335    HA   HIS  39           HA       HIS  39   8.928  -6.014   4.929
  336   1HB   HIS  39          HB1       HIS  39  11.812  -5.496   4.138
  337   2HB   HIS  39          HB2       HIS  39  11.117  -5.325   5.752
  338    HD2  HIS  39           HD2      HIS  39  10.315  -7.650   7.000
  339    HE1  HIS  39           HE1      HIS  39  12.529 -10.278   4.490
  340    HE2  HIS  39           HE2      HIS  39  11.149 -10.100   6.615
  341    H    SER  40           HN       SER  40   8.924  -3.752   5.673
  342    HA   SER  40           HA       SER  40   7.970  -1.938   3.821
  343   1HB   SER  40          HB1       SER  40   9.339  -0.926   6.293
  344   2HB   SER  40          HB2       SER  40   7.915  -0.293   5.481
  345    HG   SER  40           HG       SER  40   7.021  -2.491   6.167
  346    H    GLY  41           HN       GLY  41   8.837  -0.665   2.355
  347   1HA   GLY  41          HA1       GLY  41  10.395   0.820   1.436
  348   2HA   GLY  41          HA2       GLY  41  11.559   0.335   2.644
  349    H    GLN  42           HN       GLN  42   9.893  -1.631   0.060
  350    HA   GLN  42           HA       GLN  42  12.584  -2.260  -0.926
  351   1HB   GLN  42          HB1       GLN  42  10.287  -4.141  -0.540
  352   2HB   GLN  42          HB2       GLN  42  11.658  -4.538  -1.570
  353   1HG   GLN  42          HG1       GLN  42  13.115  -3.965   0.475
  354   2HG   GLN  42          HG2       GLN  42  11.621  -4.077   1.401
  355   1HE2  GLN  42          HE21      GLN  42  12.557  -5.897   2.553
  356   2HE2  GLN  42          HE22      GLN  42  12.643  -7.449   1.807
  357    H    ALA  43           HN       ALA  43  10.609  -0.247  -2.149
  358    HA   ALA  43           HA       ALA  43   9.855  -1.321  -4.678
  359   1HB   ALA  43          HB1       ALA  43  10.111   1.550  -3.808
  360   2HB   ALA  43          HB2       ALA  43   8.679   0.534  -3.651
  361   3HB   ALA  43          HB3       ALA  43   9.275   0.976  -5.250
  362    H    GLU  44           HN       GLU  44  11.097  -1.815  -6.339
  363    HA   GLU  44           HA       GLU  44  13.811  -1.086  -6.599
  364   1HB   GLU  44          HB1       GLU  44  12.291  -2.406  -8.837
  365   2HB   GLU  44          HB2       GLU  44  13.950  -2.668  -8.309
  366   1HG   GLU  44          HG1       GLU  44  13.067  -4.546  -7.399
  367   2HG   GLU  44          HG2       GLU  44  12.696  -3.457  -6.077
  368    H    GLY  45           HN       GLY  45  13.916   1.155  -6.696
  369   1HA   GLY  45          HA1       GLY  45  14.715   2.636  -8.572
  370   2HA   GLY  45          HA2       GLY  45  13.101   2.456  -9.221
  371    H    TYR  46           HN       TYR  46  12.532   2.667  -6.012
  372    HA   TYR  46           HA       TYR  46  12.608   5.580  -5.831
  373   1HB   TYR  46          HB1       TYR  46  10.445   5.024  -6.713
  374   2HB   TYR  46          HB2       TYR  46  10.166   3.870  -5.417
  375    HD1  TYR  46           HD1      TYR  46   9.866   7.308  -6.476
  376    HD2  TYR  46           HD2      TYR  46  10.039   4.750  -3.030
  377    HE1  TYR  46           HE1      TYR  46   8.708   9.059  -5.136
  378    HE2  TYR  46           HE2      TYR  46   8.782   6.442  -1.700
  379    HH   TYR  46           HH       TYR  46   7.201   9.114  -3.158
  380    H    SER  47           HN       SER  47  13.110   6.428  -3.910
  381    HA   SER  47           HA       SER  47  13.796   4.671  -1.699
  382   1HB   SER  47          HB1       SER  47  14.390   7.438  -1.178
  383   2HB   SER  47          HB2       SER  47  15.496   6.077  -1.370
  384    HG   SER  47           HG       SER  47  15.923   6.739  -3.314
  385    H    TYR  48           HN       TYR  48  13.140   4.911   0.371
  386    HA   TYR  48           HA       TYR  48  10.570   6.143   0.962
  387   1HB   TYR  48          HB1       TYR  48  12.165   3.887   2.183
  388   2HB   TYR  48          HB2       TYR  48  10.647   4.474   2.856
  389    HD1  TYR  48           HD1      TYR  48   8.558   3.888   1.929
  390    HD2  TYR  48           HD2      TYR  48  12.182   2.859  -0.142
  391    HE1  TYR  48           HE1      TYR  48   7.281   2.307   0.496
  392    HE2  TYR  48           HE2      TYR  48  10.917   1.275  -1.580
  393    HH   TYR  48           HH       TYR  48   7.984   0.049  -0.730
  394    H    THR  49           HN       THR  49  11.406   5.697   3.959
  395    HA   THR  49           HA       THR  49  12.970   8.165   4.404
  396    HB   THR  49           HB       THR  49  11.468   8.445   6.484
  397    HG1  THR  49           HG1      THR  49   9.398   7.438   4.957
  398   1HG2  THR  49          HG21      THR  49  10.442   9.098   3.733
  399   2HG2  THR  49          HG22      THR  49  11.544  10.070   4.709
  400   3HG2  THR  49          HG23      THR  49   9.877   9.832   5.235
  401    H    ASP  50           HN       ASP  50  13.628   8.412   6.745
  402    HA   ASP  50           HA       ASP  50  15.245   6.337   7.625
  403   1HB   ASP  50          HB1       ASP  50  15.866   8.468   8.307
  404   2HB   ASP  50          HB2       ASP  50  14.231   8.899   8.803
  405    H    ALA  51           HN       ALA  51  11.933   7.112   8.553
  406    HA   ALA  51           HA       ALA  51  11.835   5.243  10.736
  407   1HB   ALA  51          HB1       ALA  51  10.723   7.496  10.694
  408   2HB   ALA  51          HB2       ALA  51   9.686   6.152  11.175
  409   3HB   ALA  51          HB3       ALA  51   9.561   6.822   9.549
  410    H    ASN  52           HN       ASN  52  10.672   5.209   7.345
  411    HA   ASN  52           HA       ASN  52   9.030   2.890   7.732
  412   1HB   ASN  52          HB1       ASN  52   8.232   4.156   5.993
  413   2HB   ASN  52          HB2       ASN  52   9.839   4.600   5.429
  414   1HD2  ASN  52          HD21      ASN  52   7.226   2.343   5.055
  415   2HD2  ASN  52          HD22      ASN  52   7.934   1.560   3.690
  416    H    ILE  53           HN       ILE  53  12.332   3.407   6.571
  417    HA   ILE  53           HA       ILE  53  12.848   0.746   5.780
  418    HB   ILE  53           HB       ILE  53  14.731   2.946   6.588
  419   1HG1  ILE  53          HG11      ILE  53  13.934   1.998   3.815
  420   2HG1  ILE  53          HG12      ILE  53  13.228   3.398   4.616
  421   1HG2  ILE  53          HG21      ILE  53  15.866   0.772   6.738
  422   2HG2  ILE  53          HG22      ILE  53  16.481   1.709   5.377
  423   3HG2  ILE  53          HG23      ILE  53  15.353   0.384   5.094
  424   1HD1  ILE  53          HD11      ILE  53  16.120   3.067   3.803
  425   2HD1  ILE  53          HD12      ILE  53  15.474   4.447   4.690
  426   3HD1  ILE  53          HD13      ILE  53  14.924   4.120   3.047
  427    H    LYS  54           HN       LYS  54  14.345   2.331   8.656
  428    HA   LYS  54           HA       LYS  54  15.045   0.264  10.197
  429   1HB   LYS  54          HB1       LYS  54  13.629   2.782  11.053
  430   2HB   LYS  54          HB2       LYS  54  14.423   1.677  12.177
  431   1HG   LYS  54          HG1       LYS  54  16.523   1.948  10.780
  432   2HG   LYS  54          HG2       LYS  54  15.696   3.271   9.953
  433   1HD   LYS  54          HD1       LYS  54  16.405   3.093  12.887
  434   2HD   LYS  54          HD2       LYS  54  17.012   4.254  11.695
  435   1HE   LYS  54          HE1       LYS  54  14.335   4.643  11.454
  436   2HE   LYS  54          HE2       LYS  54  14.446   4.214  13.164
  437   1HZ   LYS  54          HZ1       LYS  54  14.668   6.620  12.717
  438   2HZ   LYS  54          HZ2       LYS  54  16.087   6.302  11.846
  439   3HZ   LYS  54          HZ3       LYS  54  16.017   5.958  13.503
  440    H    LYS  55           HN       LYS  55  11.804   0.747   9.244
  441    HA   LYS  55           HA       LYS  55  10.551  -0.620  11.465
  442   1HB   LYS  55          HB1       LYS  55   9.544   1.317  10.320
  443   2HB   LYS  55          HB2       LYS  55   9.396   0.368   8.860
  444   1HG   LYS  55          HG1       LYS  55   7.262   0.420   9.758
  445   2HG   LYS  55          HG2       LYS  55   7.876  -1.169  10.181
  446   1HD   LYS  55          HD1       LYS  55   8.111   1.059  12.164
  447   2HD   LYS  55          HD2       LYS  55   6.544   0.290  11.917
  448   1HE   LYS  55          HE1       LYS  55   9.115  -1.039  12.795
  449   2HE   LYS  55          HE2       LYS  55   7.658  -0.796  13.761
  450   1HZ   LYS  55          HZ1       LYS  55   7.966  -2.579  11.404
  451   2HZ   LYS  55          HZ2       LYS  55   6.479  -2.229  12.126
  452   3HZ   LYS  55          HZ3       LYS  55   7.672  -3.035  13.010
  453    H    ASN  56           HN       ASN  56  11.393  -1.441   8.163
  454    HA   ASN  56           HA       ASN  56  11.062  -3.220   6.815
  455   1HB   ASN  56          HB1       ASN  56  12.919  -3.785   8.995
  456   2HB   ASN  56          HB2       ASN  56  12.351  -5.229   8.187
  457   1HD2  ASN  56          HD21      ASN  56  14.106  -2.145   7.626
  458   2HD2  ASN  56          HD22      ASN  56  14.580  -2.739   6.094
  459    H    VAL  57           HN       VAL  57   8.608  -2.994   8.125
  460    HA   VAL  57           HA       VAL  57   7.790  -5.452   9.305
  461    HB   VAL  57           HB       VAL  57   6.685  -2.930   9.070
  462   1HG1  VAL  57          HG11      VAL  57   4.744  -4.852   7.789
  463   2HG1  VAL  57          HG12      VAL  57   5.508  -3.491   6.968
  464   3HG1  VAL  57          HG13      VAL  57   4.406  -3.202   8.314
  465   1HG2  VAL  57          HG21      VAL  57   6.610  -4.354  10.984
  466   2HG2  VAL  57          HG22      VAL  57   5.586  -5.515  10.140
  467   3HG2  VAL  57          HG23      VAL  57   4.959  -3.918  10.543
  468    H    LEU  58           HN       LEU  58   7.088  -7.309   8.383
  469    HA   LEU  58           HA       LEU  58   7.307  -7.538   5.517
  470   1HB   LEU  58          HB1       LEU  58   8.223  -9.271   7.050
  471   2HB   LEU  58          HB2       LEU  58   6.582  -9.666   7.542
  472    HG   LEU  58           HG       LEU  58   7.098  -9.728   4.615
  473   1HD1  LEU  58          HD11      LEU  58   8.175 -11.898   4.677
  474   2HD1  LEU  58          HD12      LEU  58   8.153 -11.894   6.441
  475   3HD1  LEU  58          HD13      LEU  58   9.158 -10.735   5.571
  476   1HD2  LEU  58          HD21      LEU  58   5.740 -11.777   4.748
  477   2HD2  LEU  58          HD22      LEU  58   4.916 -10.409   5.494
  478   3HD2  LEU  58          HD23      LEU  58   5.690 -11.627   6.505
  479    H    TRP  59           HN       TRP  59   5.699  -6.601   4.455
  480    HA   TRP  59           HA       TRP  59   3.070  -6.226   5.263
  481   1HB   TRP  59          HB1       TRP  59   4.172  -6.445   2.462
  482   2HB   TRP  59          HB2       TRP  59   2.612  -5.766   2.882
  483    HD1  TRP  59           HD1      TRP  59   5.835  -4.666   1.885
  484    HE1  TRP  59           HE1      TRP  59   6.327  -2.256   2.662
  485    HE3  TRP  59           HE3      TRP  59   2.093  -4.067   5.319
  486    HZ2  TRP  59           HZ2      TRP  59   5.376  -0.383   4.602
  487    HZ3  TRP  59           HZ3      TRP  59   1.894  -1.960   6.583
  488    HH2  TRP  59           HH2      TRP  59   3.504  -0.120   6.244
  489    H    ASP  60           HN       ASP  60   1.752  -7.747   5.812
  490    HA   ASP  60           HA       ASP  60   1.356 -10.211   4.284
  491   1HB   ASP  60          HB1       ASP  60   1.818 -11.199   6.240
  492   2HB   ASP  60          HB2       ASP  60   1.824  -9.660   7.078
  493    H    GLU  61           HN       GLU  61  -1.057 -11.012   5.155
  494    HA   GLU  61           HA       GLU  61  -2.867  -9.446   3.640
  495   1HB   GLU  61          HB1       GLU  61  -2.835 -12.059   4.509
  496   2HB   GLU  61          HB2       GLU  61  -4.099 -11.356   5.513
  497   1HG   GLU  61          HG1       GLU  61  -5.331 -12.035   3.691
  498   2HG   GLU  61          HG2       GLU  61  -4.951 -10.376   3.223
  499    H    ASN  62           HN       ASN  62  -2.549  -9.956   7.161
  500    HA   ASN  62           HA       ASN  62  -4.556  -7.938   7.717
  501   1HB   ASN  62          HB1       ASN  62  -4.595  -9.999   8.980
  502   2HB   ASN  62          HB2       ASN  62  -2.934  -9.762   9.502
  503   1HD2  ASN  62          HD21      ASN  62  -2.515  -8.320  11.165
  504   2HD2  ASN  62          HD22      ASN  62  -3.770  -7.622  12.125
  505    H    ASN  63           HN       ASN  63  -1.019  -8.308   8.333
  506    HA   ASN  63           HA       ASN  63  -0.482  -5.992   9.667
  507   1HB   ASN  63          HB1       ASN  63   1.266  -7.486   9.435
  508   2HB   ASN  63          HB2       ASN  63   1.064  -7.626   7.700
  509   1HD2  ASN  63          HD21      ASN  63   2.152  -5.293  10.203
  510   2HD2  ASN  63          HD22      ASN  63   3.098  -4.475   9.009
  511    H    MET  64           HN       MET  64  -0.757  -6.101   6.044
  512    HA   MET  64           HA       MET  64  -0.052  -3.459   5.565
  513   1HB   MET  64          HB1       MET  64  -0.444  -5.246   3.865
  514   2HB   MET  64          HB2       MET  64  -2.172  -4.990   4.062
  515   1HG   MET  64          HG1       MET  64  -1.851  -2.632   3.373
  516   2HG   MET  64          HG2       MET  64  -0.160  -2.982   3.071
  517   1HE   MET  64          HE1       MET  64  -3.755  -4.475   0.597
  518   2HE   MET  64          HE2       MET  64  -3.829  -3.579   2.116
  519   3HE   MET  64          HE3       MET  64  -3.350  -5.276   2.117
  520    H    SER  65           HN       SER  65  -3.234  -4.655   6.632
  521    HA   SER  65           HA       SER  65  -4.587  -2.175   6.502
  522   1HB   SER  65          HB1       SER  65  -5.253  -4.443   8.373
  523   2HB   SER  65          HB2       SER  65  -6.338  -3.205   7.756
  524    HG   SER  65           HG       SER  65  -5.520  -5.555   6.625
  525    H    GLU  66           HN       GLU  66  -2.707  -3.660   9.112
  526    HA   GLU  66           HA       GLU  66  -3.313  -2.015  11.243
  527   1HB   GLU  66          HB1       GLU  66  -1.688  -3.224  12.232
  528   2HB   GLU  66          HB2       GLU  66  -1.500  -4.039  10.683
  529   1HG   GLU  66          HG1       GLU  66   0.154  -2.216  10.067
  530   2HG   GLU  66          HG2       GLU  66   0.102  -1.729  11.761
  531    H    TYR  67           HN       TYR  67  -1.109  -1.439   8.571
  532    HA   TYR  67           HA       TYR  67  -0.291   1.196   9.443
  533   1HB   TYR  67          HB1       TYR  67   1.446  -0.022   8.507
  534   2HB   TYR  67          HB2       TYR  67   0.438  -0.674   7.229
  535    HD1  TYR  67           HD1      TYR  67   0.162   0.493   5.128
  536    HD2  TYR  67           HD2      TYR  67   2.344   2.265   8.376
  537    HE1  TYR  67           HE1      TYR  67   1.197   2.110   3.542
  538    HE2  TYR  67           HE2      TYR  67   3.430   3.854   6.802
  539    HH   TYR  67           HH       TYR  67   2.473   4.083   3.434
  540    H    LEU  68           HN       LEU  68  -2.285  -0.143   6.739
  541    HA   LEU  68           HA       LEU  68  -2.677   2.251   5.384
  542   1HB   LEU  68          HB1       LEU  68  -4.425  -0.169   5.677
  543   2HB   LEU  68          HB2       LEU  68  -4.888   1.191   4.671
  544    HG   LEU  68           HG       LEU  68  -2.503  -0.630   4.297
  545   1HD1  LEU  68          HD11      LEU  68  -4.980   0.011   2.679
  546   2HD1  LEU  68          HD12      LEU  68  -4.666  -1.481   3.564
  547   3HD1  LEU  68          HD13      LEU  68  -3.684  -1.066   2.159
  548   1HD2  LEU  68          HD21      LEU  68  -1.888   1.745   3.736
  549   2HD2  LEU  68          HD22      LEU  68  -3.243   1.778   2.609
  550   3HD2  LEU  68          HD23      LEU  68  -1.900   0.668   2.339
  551    H    THR  69           HN       THR  69  -4.488   1.127   8.254
  552    HA   THR  69           HA       THR  69  -6.544   3.038   8.151
  553    HB   THR  69           HB       THR  69  -5.487   1.989  10.750
  554    HG1  THR  69           HG1      THR  69  -5.638   0.150   9.608
  555   1HG2  THR  69          HG21      THR  69  -7.402   3.469  10.949
  556   2HG2  THR  69          HG22      THR  69  -7.922   1.812  11.251
  557   3HG2  THR  69          HG23      THR  69  -8.264   2.573   9.698
  558    H    ASN  70           HN       ASN  70  -3.232   3.368   9.244
  559    HA   ASN  70           HA       ASN  70  -3.410   6.193   9.223
  560   1HB   ASN  70          HB1       ASN  70  -4.444   5.564  11.481
  561   2HB   ASN  70          HB2       ASN  70  -2.820   5.095  11.971
  562   1HD2  ASN  70          HD21      ASN  70  -4.562   7.257  12.984
  563   2HD2  ASN  70          HD22      ASN  70  -3.445   8.574  12.920
  564    HA   PRO  71           HA       PRO  71   0.759   4.498   8.168
  565   1HB   PRO  71          HB1       PRO  71   1.310   6.555   6.430
  566   2HB   PRO  71          HB2       PRO  71   0.503   5.052   5.975
  567   1HG   PRO  71          HG1       PRO  71  -0.686   7.722   6.620
  568   2HG   PRO  71          HG2       PRO  71  -1.122   6.583   5.331
  569   1HD   PRO  71          HD1       PRO  71  -2.577   6.785   7.576
  570   2HD   PRO  71          HD2       PRO  71  -2.326   5.221   6.771
  571    H    LYS  72           HN       LYS  72  -0.045   7.914   8.758
  572    HA   LYS  72           HA       LYS  72   2.525   8.794   9.478
  573   1HB   LYS  72          HB1       LYS  72  -0.193   9.932  10.132
  574   2HB   LYS  72          HB2       LYS  72   1.317  10.745  10.505
  575   1HG   LYS  72          HG1       LYS  72   1.574  10.196   7.821
  576   2HG   LYS  72          HG2       LYS  72  -0.141  10.555   7.985
  577   1HD   LYS  72          HD1       LYS  72   0.390  12.720   7.877
  578   2HD   LYS  72          HD2       LYS  72   1.161  12.549   9.455
  579   1HE   LYS  72          HE1       LYS  72   2.666  13.562   7.795
  580   2HE   LYS  72          HE2       LYS  72   3.283  12.034   8.406
  581   1HZ   LYS  72          HZ1       LYS  72   3.651  11.789   6.189
  582   2HZ   LYS  72          HZ2       LYS  72   2.313  12.715   5.733
  583   3HZ   LYS  72          HZ3       LYS  72   2.087  11.133   6.276
  584    H    LYS  73           HN       LYS  73  -0.068   7.413  11.435
  585    HA   LYS  73           HA       LYS  73   1.245   7.962  13.921
  586   1HB   LYS  73          HB1       LYS  73  -1.171   7.755  13.860
  587   2HB   LYS  73          HB2       LYS  73  -1.046   6.093  13.301
  588   1HG   LYS  73          HG1       LYS  73  -1.604   6.285  15.710
  589   2HG   LYS  73          HG2       LYS  73  -0.127   5.380  15.405
  590   1HD   LYS  73          HD1       LYS  73   0.967   7.787  15.799
  591   2HD   LYS  73          HD2       LYS  73  -0.508   8.021  16.734
  592   1HE   LYS  73          HE1       LYS  73   1.328   7.233  18.150
  593   2HE   LYS  73          HE2       LYS  73   0.020   6.055  18.089
  594   1HZ   LYS  73          HZ1       LYS  73   2.470   5.302  17.829
  595   2HZ   LYS  73          HZ2       LYS  73   2.273   5.798  16.225
  596   3HZ   LYS  73          HZ3       LYS  73   1.267   4.601  16.864
  597    H    TYR  74           HN       TYR  74   1.140   5.130  11.796
  598    HA   TYR  74           HA       TYR  74   2.652   3.426  13.504
  599   1HB   TYR  74          HB1       TYR  74   1.110   2.680  11.692
  600   2HB   TYR  74          HB2       TYR  74   2.299   3.236  10.514
  601    HD1  TYR  74           HD1      TYR  74   3.642   1.529   9.591
  602    HD2  TYR  74           HD2      TYR  74   2.305   1.273  13.669
  603    HE1  TYR  74           HE1      TYR  74   4.780  -0.681   9.824
  604    HE2  TYR  74           HE2      TYR  74   3.425  -0.926  13.914
  605    HH   TYR  74           HH       TYR  74   4.065  -2.863  12.089
  606    H    ILE  75           HN       ILE  75   3.558   5.240  10.603
  607    HA   ILE  75           HA       ILE  75   6.411   4.974  11.260
  608    HB   ILE  75           HB       ILE  75   5.123   5.479   8.565
  609   1HG1  ILE  75          HG11      ILE  75   6.630   3.052   9.610
  610   2HG1  ILE  75          HG12      ILE  75   4.897   3.122   9.326
  611   1HG2  ILE  75          HG21      ILE  75   8.013   5.293   9.443
  612   2HG2  ILE  75          HG22      ILE  75   7.208   6.653   8.663
  613   3HG2  ILE  75          HG23      ILE  75   7.507   5.171   7.758
  614   1HD1  ILE  75          HD11      ILE  75   7.120   3.114   7.294
  615   2HD1  ILE  75          HD12      ILE  75   5.470   3.576   6.881
  616   3HD1  ILE  75          HD13      ILE  75   5.805   1.955   7.489
  617    HA   PRO  76           HA       PRO  76   5.554   9.310  12.368
  618   1HB   PRO  76          HB1       PRO  76   7.833   9.589  13.842
  619   2HB   PRO  76          HB2       PRO  76   6.339   8.889  14.475
  620   1HG   PRO  76          HG1       PRO  76   8.795   7.516  13.460
  621   2HG   PRO  76          HG2       PRO  76   7.795   7.126  14.871
  622   1HD   PRO  76          HD1       PRO  76   7.606   5.772  12.538
  623   2HD   PRO  76          HD2       PRO  76   6.211   6.032  13.604
  624    H    GLY  77           HN       GLY  77   5.882  10.531  10.574
  625   1HA   GLY  77          HA1       GLY  77   7.254  12.215   9.581
  626   2HA   GLY  77          HA2       GLY  77   8.649  11.182   9.823
  627    H    THR  78           HN       THR  78   6.165   9.278   8.621
  628    HA   THR  78           HA       THR  78   7.367   8.674   6.179
  629    HB   THR  78           HB       THR  78   5.695   7.342   7.583
  630    HG1  THR  78           HG1      THR  78   6.468   7.097   5.160
  631   1HG2  THR  78          HG21      THR  78   3.724   8.698   7.594
  632   2HG2  THR  78          HG22      THR  78   3.393   7.257   6.633
  633   3HG2  THR  78          HG23      THR  78   3.717   8.795   5.833
  634    H    LYS  79           HN       LYS  79   6.931   9.123   4.059
  635    HA   LYS  79           HA       LYS  79   5.986  11.734   3.409
  636   1HB   LYS  79          HB1       LYS  79   6.577   9.424   1.556
  637   2HB   LYS  79          HB2       LYS  79   6.480  11.119   1.110
  638   1HG   LYS  79          HG1       LYS  79   8.453  11.510   2.659
  639   2HG   LYS  79          HG2       LYS  79   8.613   9.748   2.734
  640   1HD   LYS  79          HD1       LYS  79   8.287  10.398   0.001
  641   2HD   LYS  79          HD2       LYS  79   9.465  11.547   0.647
  642   1HE   LYS  79          HE1       LYS  79  10.799   9.736   0.012
  643   2HE   LYS  79          HE2       LYS  79  10.557   9.468   1.738
  644   1HZ   LYS  79          HZ1       LYS  79  10.202   7.549   0.035
  645   2HZ   LYS  79          HZ2       LYS  79   8.682   8.257  -0.164
  646   3HZ   LYS  79          HZ3       LYS  79   9.161   7.717   1.362
  647    H    MET  80           HN       MET  80   4.323   8.603   3.435
  648    HA   MET  80           HA       MET  80   2.258   9.388   1.648
  649   1HB   MET  80          HB1       MET  80   2.458   7.110   1.661
  650   2HB   MET  80          HB2       MET  80   2.738   7.030   3.404
  651   1HG   MET  80          HG1       MET  80   0.513   7.178   3.922
  652   2HG   MET  80          HG2       MET  80   0.107   8.016   2.436
  653   1HE   MET  80          HE1       MET  80  -2.100   4.722   2.626
  654   2HE   MET  80          HE2       MET  80  -2.116   6.484   2.709
  655   3HE   MET  80          HE3       MET  80  -1.430   5.546   4.034
  656    H    ALA  81           HN       ALA  81   1.206  11.142   2.100
  657    HA   ALA  81           HA       ALA  81   0.144  11.693   4.743
  658   1HB   ALA  81          HB1       ALA  81  -0.068  13.976   4.002
  659   2HB   ALA  81          HB2       ALA  81   0.377  13.510   2.361
  660   3HB   ALA  81          HB3       ALA  81   1.552  13.361   3.667
  661    H    PHE  82           HN       PHE  82  -1.087   9.884   2.726
  662    HA   PHE  82           HA       PHE  82  -3.524  10.713   1.730
  663   1HB   PHE  82          HB1       PHE  82  -2.438   8.817   0.826
  664   2HB   PHE  82          HB2       PHE  82  -2.413   7.997   2.382
  665    HD1  PHE  82           HD1      PHE  82  -4.731   9.256  -0.275
  666    HD2  PHE  82           HD2      PHE  82  -4.129   6.521   2.991
  667    HE1  PHE  82           HE1      PHE  82  -6.938   8.207  -0.744
  668    HE2  PHE  82           HE2      PHE  82  -6.338   5.482   2.531
  669    HZ   PHE  82           HZ       PHE  82  -7.752   6.339   0.677
  670    H    GLY  83           HN       GLY  83  -2.866  10.286   5.051
  671   1HA   GLY  83          HA1       GLY  83  -4.341  10.643   6.815
  672   2HA   GLY  83          HA2       GLY  83  -5.668  10.633   5.675
  673    H    GLY  84           HN       GLY  84  -5.166   7.978   4.627
  674   1HA   GLY  84          HA1       GLY  84  -5.169   5.703   5.158
  675   2HA   GLY  84          HA2       GLY  84  -5.257   6.110   6.861
  676    H    LEU  85           HN       LEU  85  -6.907   4.664   4.477
  677    HA   LEU  85           HA       LEU  85  -9.582   5.570   4.784
  678   1HB   LEU  85          HB1       LEU  85  -8.331   3.117   3.580
  679   2HB   LEU  85          HB2       LEU  85 -10.070   3.266   3.722
  680    HG   LEU  85           HG       LEU  85  -8.315   5.204   2.192
  681   1HD1  LEU  85          HD11      LEU  85  -8.338   2.941   1.204
  682   2HD1  LEU  85          HD12      LEU  85  -9.195   4.107   0.195
  683   3HD1  LEU  85          HD13      LEU  85 -10.102   2.973   1.197
  684   1HD2  LEU  85          HD21      LEU  85 -10.410   5.963   1.175
  685   2HD2  LEU  85          HD22      LEU  85 -10.456   6.204   2.921
  686   3HD2  LEU  85          HD23      LEU  85 -11.325   4.852   2.195
  687    H    LYS  86           HN       LYS  86 -10.283   5.607   6.751
  688    HA   LYS  86           HA       LYS  86  -9.959   3.829   8.874
  689   1HB   LYS  86          HB1       LYS  86 -12.245   5.765   8.515
  690   2HB   LYS  86          HB2       LYS  86 -11.551   5.188  10.024
  691   1HG   LYS  86          HG1       LYS  86  -9.802   6.677   8.107
  692   2HG   LYS  86          HG2       LYS  86 -10.948   7.575   9.106
  693   1HD   LYS  86          HD1       LYS  86  -9.952   6.721  11.129
  694   2HD   LYS  86          HD2       LYS  86  -8.929   5.612  10.217
  695   1HE   LYS  86          HE1       LYS  86  -8.764   8.612   9.921
  696   2HE   LYS  86          HE2       LYS  86  -7.804   7.716  11.096
  697   1HZ   LYS  86          HZ1       LYS  86  -7.761   7.252   8.163
  698   2HZ   LYS  86          HZ2       LYS  86  -6.783   6.491   9.313
  699   3HZ   LYS  86          HZ3       LYS  86  -6.607   8.146   9.024
  700    H    LYS  87           HN       LYS  87 -12.273   3.742   6.274
  701    HA   LYS  87           HA       LYS  87 -14.254   2.086   7.491
  702   1HB   LYS  87          HB1       LYS  87 -13.636   2.412   4.567
  703   2HB   LYS  87          HB2       LYS  87 -15.128   1.836   5.260
  704   1HG   LYS  87          HG1       LYS  87 -15.446   4.228   6.172
  705   2HG   LYS  87          HG2       LYS  87 -14.135   4.675   5.036
  706   1HD   LYS  87          HD1       LYS  87 -15.529   2.896   3.576
  707   2HD   LYS  87          HD2       LYS  87 -16.826   3.566   4.507
  708   1HE   LYS  87          HE1       LYS  87 -16.871   5.483   3.254
  709   2HE   LYS  87          HE2       LYS  87 -15.158   5.351   2.794
  710   1HZ   LYS  87          HZ1       LYS  87 -15.658   3.392   1.497
  711   2HZ   LYS  87          HZ2       LYS  87 -16.631   4.664   0.967
  712   3HZ   LYS  87          HZ3       LYS  87 -17.293   3.453   1.949
  713    H    GLU  88           HN       GLU  88 -13.712   0.068   8.135
  714    HA   GLU  88           HA       GLU  88 -11.721  -1.606   7.184
  715   1HB   GLU  88          HB1       GLU  88 -13.057  -1.709   9.345
  716   2HB   GLU  88          HB2       GLU  88 -14.276  -2.586   8.426
  717   1HG   GLU  88          HG1       GLU  88 -12.355  -4.173   7.753
  718   2HG   GLU  88          HG2       GLU  88 -11.467  -3.431   9.093
  719    H    LYS  89           HN       LYS  89 -15.156  -1.633   6.171
  720    HA   LYS  89           HA       LYS  89 -15.078  -3.954   4.628
  721   1HB   LYS  89          HB1       LYS  89 -16.832  -1.635   3.893
  722   2HB   LYS  89          HB2       LYS  89 -17.197  -3.358   3.886
  723   1HG   LYS  89          HG1       LYS  89 -16.562  -1.989   6.467
  724   2HG   LYS  89          HG2       LYS  89 -18.167  -1.834   5.769
  725   1HD   LYS  89          HD1       LYS  89 -18.400  -3.644   7.229
  726   2HD   LYS  89          HD2       LYS  89 -18.099  -4.442   5.676
  727   1HE   LYS  89          HE1       LYS  89 -16.063  -5.205   6.314
  728   2HE   LYS  89          HE2       LYS  89 -15.667  -3.716   7.171
  729   1HZ   LYS  89          HZ1       LYS  89 -17.361  -4.583   8.881
  730   2HZ   LYS  89          HZ2       LYS  89 -15.814  -5.260   8.854
  731   3HZ   LYS  89          HZ3       LYS  89 -17.108  -6.090   8.147
  732    H    ASP  90           HN       ASP  90 -14.414  -0.667   3.778
  733    HA   ASP  90           HA       ASP  90 -13.918  -0.812   1.069
  734   1HB   ASP  90          HB1       ASP  90 -13.277   0.988   3.348
  735   2HB   ASP  90          HB2       ASP  90 -12.408   1.251   1.847
  736    H    ARG  91           HN       ARG  91 -11.546  -1.168   3.795
  737    HA   ARG  91           HA       ARG  91  -9.362  -1.726   2.035
  738   1HB   ARG  91          HB1       ARG  91  -9.428  -2.542   4.944
  739   2HB   ARG  91          HB2       ARG  91  -8.015  -2.275   3.929
  740   1HG   ARG  91          HG1       ARG  91  -8.522   0.101   3.811
  741   2HG   ARG  91          HG2       ARG  91  -9.978  -0.142   4.760
  742   1HD   ARG  91          HD1       ARG  91  -7.139  -0.549   5.711
  743   2HD   ARG  91          HD2       ARG  91  -8.166   0.824   6.092
  744    HE   ARG  91           HE       ARG  91  -8.176  -1.632   6.522
  745   1HH1  ARG  91          HH21      ARG  91  -9.363   1.442   7.624
  746   2HH1  ARG  91          HH22      ARG  91 -10.256   1.018   9.045
  747   1HH2  ARG  91          HH11      ARG  91  -9.573  -2.341   8.856
  748   2HH2  ARG  91          HH12      ARG  91 -10.411  -1.097   9.712
  749    H    ASN  92           HN       ASN  92 -11.649  -3.830   3.739
  750    HA   ASN  92           HA       ASN  92 -10.501  -6.282   3.498
  751   1HB   ASN  92          HB1       ASN  92 -13.387  -5.466   3.200
  752   2HB   ASN  92          HB2       ASN  92 -12.887  -7.150   3.218
  753   1HD2  ASN  92          HD21      ASN  92 -14.657  -6.053   5.056
  754   2HD2  ASN  92          HD22      ASN  92 -13.853  -6.340   6.561
  755    H    ASP  93           HN       ASP  93 -12.568  -4.873   0.912
  756    HA   ASP  93           HA       ASP  93 -11.985  -6.823  -1.033
  757   1HB   ASP  93          HB1       ASP  93 -13.833  -4.935  -0.925
  758   2HB   ASP  93          HB2       ASP  93 -12.653  -4.031  -1.861
  759    H    LEU  94           HN       LEU  94 -10.326  -3.694  -0.358
  760    HA   LEU  94           HA       LEU  94  -8.692  -3.507  -2.540
  761   1HB   LEU  94          HB1       LEU  94  -8.830  -2.407   0.165
  762   2HB   LEU  94          HB2       LEU  94  -7.228  -2.490  -0.468
  763    HG   LEU  94           HG       LEU  94  -9.440  -1.232  -2.060
  764   1HD1  LEU  94          HD11      LEU  94  -9.246  -0.210   0.220
  765   2HD1  LEU  94          HD12      LEU  94  -8.911   0.902  -1.111
  766   3HD1  LEU  94          HD13      LEU  94  -7.580   0.220  -0.178
  767   1HD2  LEU  94          HD21      LEU  94  -7.770  -0.041  -3.234
  768   2HD2  LEU  94          HD22      LEU  94  -7.178  -1.699  -3.152
  769   3HD2  LEU  94          HD23      LEU  94  -6.521  -0.476  -2.066
  770    H    ILE  95           HN       ILE  95  -8.136  -5.424   0.397
  771    HA   ILE  95           HA       ILE  95  -5.494  -6.231  -0.127
  772    HB   ILE  95           HB       ILE  95  -7.596  -7.703   1.477
  773   1HG1  ILE  95          HG11      ILE  95  -5.606  -5.620   2.436
  774   2HG1  ILE  95          HG12      ILE  95  -7.304  -5.282   2.116
  775   1HG2  ILE  95          HG21      ILE  95  -5.777  -8.694   2.704
  776   2HG2  ILE  95          HG22      ILE  95  -4.592  -7.722   1.833
  777   3HG2  ILE  95          HG23      ILE  95  -5.489  -8.982   0.987
  778   1HD1  ILE  95          HD11      ILE  95  -6.421  -7.379   4.092
  779   2HD1  ILE  95          HD12      ILE  95  -8.017  -6.648   3.916
  780   3HD1  ILE  95          HD13      ILE  95  -6.674  -5.690   4.538
  781    H    THR  96           HN       THR  96  -8.601  -7.885  -0.818
  782    HA   THR  96           HA       THR  96  -7.636 -10.177  -2.039
  783    HB   THR  96           HB       THR  96 -10.066  -9.046  -3.287
  784    HG1  THR  96           HG1      THR  96 -10.506  -8.283  -1.266
  785   1HG2  THR  96          HG21      THR  96  -9.466 -11.622  -1.816
  786   2HG2  THR  96          HG22      THR  96  -9.441 -11.403  -3.567
  787   3HG2  THR  96          HG23      THR  96 -10.960 -11.258  -2.682
  788    H    TYR  97           HN       TYR  97  -8.218  -6.994  -3.580
  789    HA   TYR  97           HA       TYR  97  -7.548  -7.845  -6.195
  790   1HB   TYR  97          HB1       TYR  97  -8.819  -5.840  -5.929
  791   2HB   TYR  97          HB2       TYR  97  -7.556  -5.101  -4.953
  792    HD1  TYR  97           HD1      TYR  97  -6.501  -3.357  -6.011
  793    HD2  TYR  97           HD2      TYR  97  -7.652  -6.799  -8.316
  794    HE1  TYR  97           HE1      TYR  97  -5.478  -2.337  -8.034
  795    HE2  TYR  97           HE2      TYR  97  -6.741  -5.737 -10.373
  796    HH   TYR  97           HH       TYR  97  -4.612  -3.466 -10.490
  797    H    LEU  98           HN       LEU  98  -5.540  -6.006  -3.844
  798    HA   LEU  98           HA       LEU  98  -3.167  -5.989  -5.318
  799   1HB   LEU  98          HB1       LEU  98  -3.985  -4.950  -2.943
  800   2HB   LEU  98          HB2       LEU  98  -2.916  -6.234  -2.383
  801    HG   LEU  98           HG       LEU  98  -1.083  -5.333  -3.781
  802   1HD1  LEU  98          HD11      LEU  98  -1.362  -3.109  -4.828
  803   2HD1  LEU  98          HD12      LEU  98  -3.080  -3.154  -4.431
  804   3HD1  LEU  98          HD13      LEU  98  -2.407  -4.323  -5.568
  805   1HD2  LEU  98          HD21      LEU  98  -2.325  -3.157  -2.092
  806   2HD2  LEU  98          HD22      LEU  98  -0.617  -3.356  -2.484
  807   3HD2  LEU  98          HD23      LEU  98  -1.423  -4.525  -1.438
  808    H    LYS  99           HN       LYS  99  -4.250  -8.232  -2.833
  809    HA   LYS  99           HA       LYS  99  -2.161 -10.028  -2.762
  810   1HB   LYS  99          HB1       LYS  99  -3.528 -10.728  -1.139
  811   2HB   LYS  99          HB2       LYS  99  -4.918  -9.949  -1.876
  812   1HG   LYS  99          HG1       LYS  99  -5.348 -11.893  -3.241
  813   2HG   LYS  99          HG2       LYS  99  -3.869 -12.661  -2.696
  814   1HD   LYS  99          HD1       LYS  99  -5.681 -12.005  -0.496
  815   2HD   LYS  99          HD2       LYS  99  -6.405 -13.090  -1.687
  816   1HE   LYS  99          HE1       LYS  99  -5.131 -14.165   0.238
  817   2HE   LYS  99          HE2       LYS  99  -4.750 -14.716  -1.386
  818   1HZ   LYS  99          HZ1       LYS  99  -2.663 -14.058  -1.164
  819   2HZ   LYS  99          HZ2       LYS  99  -2.977 -13.903   0.496
  820   3HZ   LYS  99          HZ3       LYS  99  -3.110 -12.551  -0.513
  821    H    LYS 100           HN       LYS 100  -4.875  -9.948  -5.081
  822    HA   LYS 100           HA       LYS 100  -4.152 -12.343  -6.418
  823   1HB   LYS 100          HB1       LYS 100  -6.408 -10.913  -6.283
  824   2HB   LYS 100          HB2       LYS 100  -5.852 -10.444  -7.873
  825   1HG   LYS 100          HG1       LYS 100  -7.513 -12.437  -7.613
  826   2HG   LYS 100          HG2       LYS 100  -6.179 -12.573  -8.762
  827   1HD   LYS 100          HD1       LYS 100  -5.520 -13.420  -6.060
  828   2HD   LYS 100          HD2       LYS 100  -6.825 -14.338  -6.744
  829   1HE   LYS 100          HE1       LYS 100  -5.090 -15.714  -7.196
  830   2HE   LYS 100          HE2       LYS 100  -5.002 -14.720  -8.659
  831   1HZ   LYS 100          HZ1       LYS 100  -3.462 -14.176  -6.158
  832   2HZ   LYS 100          HZ2       LYS 100  -3.353 -13.322  -7.615
  833   3HZ   LYS 100          HZ3       LYS 100  -2.827 -14.930  -7.539
  834    H    ALA 101           HN       ALA 101  -3.237  -9.151  -6.914
  835    HA   ALA 101           HA       ALA 101  -2.015  -9.345  -9.484
  836   1HB   ALA 101          HB1       ALA 101  -3.172  -7.328  -8.575
  837   2HB   ALA 101          HB2       ALA 101  -1.543  -7.017  -9.174
  838   3HB   ALA 101          HB3       ALA 101  -1.837  -7.134  -7.438
  839    H    THR 102           HN       THR 102  -0.847  -9.390  -6.139
  840    HA   THR 102           HA       THR 102   1.952  -9.453  -6.760
  841    HB   THR 102           HB       THR 102   0.744 -10.252  -4.121
  842    HG1  THR 102           HG1      THR 102  -0.110  -8.206  -4.761
  843   1HG2  THR 102          HG21      THR 102   2.795  -9.261  -3.212
  844   2HG2  THR 102          HG22      THR 102   3.334  -8.867  -4.844
  845   3HG2  THR 102          HG23      THR 102   3.170 -10.553  -4.353
  846    H    GLU 103           HN       GLU 103  -0.501 -11.904  -5.915
  847    HA   GLU 103           HA       GLU 103   1.443 -13.979  -6.709
  848   1HB   GLU 103          HB1       GLU 103  -0.161 -15.431  -5.122
  849   2HB   GLU 103          HB2       GLU 103   1.283 -14.624  -4.535
  850   1HG   GLU 103          HG1       GLU 103  -0.009 -13.687  -3.003
  851   2HG   GLU 103          HG2       GLU 103  -0.674 -12.696  -4.296
  852    HHA  HEC 104           HA       HEC 104   4.888   3.345   1.590
  853    HHB  HEC 104           HB       HEC 104  -0.812   0.518   0.280
  854    HHC  HEC 104           HC       HEC 104  -3.240   6.292  -1.389
  855    HHD  HEC 104           HD       HEC 104   2.731   8.754  -1.260
  856   1HMA  HEC 104          HMA1      HEC 104   0.929  -0.896   2.138
  857   2HMA  HEC 104          HMA2      HEC 104   2.456  -1.293   1.347
  858   3HMA  HEC 104          HMA3      HEC 104   0.986  -1.112   0.388
  859   1HAA  HEC 104          HAA1      HEC 104   3.990  -0.301   2.279
  860   2HAA  HEC 104          HAA2      HEC 104   4.686   1.264   2.657
  861   1HBA  HEC 104          HBA1      HEC 104   5.593   1.386   0.349
  862   2HBA  HEC 104          HBA2      HEC 104   4.954  -0.221   0.038
  863   1HMB  HEC 104          HMB1      HEC 104  -2.684   0.226  -0.377
  864   2HMB  HEC 104          HMB2      HEC 104  -3.573   0.826  -1.777
  865   3HMB  HEC 104          HMB3      HEC 104  -4.262   0.985  -0.163
  866    HAB  HEC 104           HAB      HEC 104  -4.661   4.983  -1.452
  867   1HBB  HEC 104          HBB1      HEC 104  -5.050   3.783   0.839
  868   2HBB  HEC 104          HBB2      HEC 104  -6.044   2.718  -0.155
  869   3HBB  HEC 104          HBB3      HEC 104  -6.375   4.451  -0.115
  870   1HMC  HEC 104          HMC1      HEC 104  -3.256   8.858  -1.571
  871   2HMC  HEC 104          HMC2      HEC 104  -2.900   8.116  -3.131
  872   3HMC  HEC 104          HMC3      HEC 104  -2.276   9.722  -2.756
  873    HAC  HEC 104           HAC      HEC 104   1.571   9.810  -2.566
  874   1HBC  HEC 104          HBC1      HEC 104   0.767  11.223  -0.919
  875   2HBC  HEC 104          HBC2      HEC 104  -0.883  11.171  -1.538
  876   3HBC  HEC 104          HBC3      HEC 104   0.376  12.008  -2.448
  877   1HMD  HEC 104          HMD1      HEC 104   4.854   9.131  -0.314
  878   2HMD  HEC 104          HMD2      HEC 104   5.316   8.128  -1.689
  879   3HMD  HEC 104          HMD3      HEC 104   6.311   8.141  -0.233
  880   1HAD  HEC 104          HAD1      HEC 104   7.076   6.264   0.574
  881   2HAD  HEC 104          HAD2      HEC 104   6.590   4.733   1.294
  882   1HBD  HEC 104          HBD1      HEC 104   6.050   5.704   3.327
  883   2HBD  HEC 104          HBD2      HEC 104   5.763   7.279   2.619
  884    H2   4NL 105           H2       4NL 105   0.883 -12.856  -1.140
  885    H6   4NL 105           H6       4NL 105   3.454 -12.962   2.999
  886    H3   4NL 105           H3       4NL 105  -1.451 -10.875   1.941
  887    H5   4NL 105           H5       4NL 105  -1.974 -10.814  -0.248
  888    H4   4NL 105           H4       4NL 105   0.219 -11.592   3.670
  889    H1   4NL 105           H1       4NL 105   2.554 -13.573   0.587
  890    H7   4NL 105           H7       4NL 105   2.136 -13.364   4.126
  Start of MODEL    7
    1   1H    THR  -5          HT1       THR  -5 -10.507  -4.778  13.438
    2   2H    THR  -5          HT2       THR  -5 -11.830  -5.738  13.878
    3   3H    THR  -5          HT3       THR  -5 -11.907  -4.789  12.480
    4    HA   THR  -5           HA       THR  -5 -10.297  -6.097  11.373
    5    HB   THR  -5           HB       THR  -5 -10.123  -7.970  13.727
    6    HG1  THR  -5           HG1      THR  -5  -7.944  -6.690  13.841
    7   1HG2  THR  -5          HG21      THR  -5  -8.259  -7.262  11.452
    8   2HG2  THR  -5          HG22      THR  -5  -9.263  -8.708  11.556
    9   3HG2  THR  -5          HG23      THR  -5  -7.939  -8.470  12.698
   10    H    GLU  -4           HN       GLU  -4 -12.198  -6.507  10.202
   11    HA   GLU  -4           HA       GLU  -4 -13.542  -9.029  10.774
   12   1HB   GLU  -4          HB1       GLU  -4 -14.955  -7.146  11.759
   13   2HB   GLU  -4          HB2       GLU  -4 -15.130  -6.519  10.124
   14   1HG   GLU  -4          HG1       GLU  -4 -15.823  -9.369  10.500
   15   2HG   GLU  -4          HG2       GLU  -4 -16.888  -8.206  11.279
   16    H    PHE  -3           HN       PHE  -3 -11.887  -9.374   9.063
   17    HA   PHE  -3           HA       PHE  -3 -12.242  -8.226   6.481
   18   1HB   PHE  -3          HB1       PHE  -3 -10.021  -8.857   7.083
   19   2HB   PHE  -3          HB2       PHE  -3 -10.509 -10.518   7.394
   20    HD1  PHE  -3           HD1      PHE  -3 -10.027  -7.984   4.697
   21    HD2  PHE  -3           HD2      PHE  -3 -10.532 -12.145   5.659
   22    HE1  PHE  -3           HE1      PHE  -3  -9.567  -8.587   2.328
   23    HE2  PHE  -3           HE2      PHE  -3 -10.122 -12.746   3.281
   24    HZ   PHE  -3           HZ       PHE  -3  -9.671 -10.962   1.604
   25    H    LYS  -2           HN       LYS  -2 -12.894  -9.152   4.607
   26    HA   LYS  -2           HA       LYS  -2 -14.213 -11.696   4.423
   27   1HB   LYS  -2          HB1       LYS  -2 -15.807  -9.697   5.342
   28   2HB   LYS  -2          HB2       LYS  -2 -15.986  -9.458   3.604
   29   1HG   LYS  -2          HG1       LYS  -2 -17.184 -11.348   3.331
   30   2HG   LYS  -2          HG2       LYS  -2 -16.186 -12.261   4.458
   31   1HD   LYS  -2          HD1       LYS  -2 -17.992 -10.193   5.606
   32   2HD   LYS  -2          HD2       LYS  -2 -18.746 -11.649   4.957
   33   1HE   LYS  -2          HE1       LYS  -2 -18.384 -12.045   7.274
   34   2HE   LYS  -2          HE2       LYS  -2 -17.173 -12.986   6.410
   35   1HZ   LYS  -2          HZ1       LYS  -2 -15.553 -11.228   6.888
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.189 -11.900   8.300
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.732 -10.390   7.777
   38    H    ALA  -1           HN       ALA  -1 -13.750 -12.442   2.500
   39    HA   ALA  -1           HA       ALA  -1 -12.070 -11.307   0.671
   40   1HB   ALA  -1          HB1       ALA  -1 -14.143 -13.425   0.101
   41   2HB   ALA  -1          HB2       ALA  -1 -12.598 -13.711   0.901
   42   3HB   ALA  -1          HB3       ALA  -1 -12.634 -13.160  -0.774
   43    H    GLY   1           HN       GLY   1 -12.239 -10.254  -1.263
   44   1HA   GLY   1          HA1       GLY   1 -14.798  -8.939  -1.912
   45   2HA   GLY   1          HA2       GLY   1 -13.208  -8.256  -2.211
   46    H    SER   2           HN       SER   2 -13.340  -7.966  -4.346
   47    HA   SER   2           HA       SER   2 -12.989 -10.228  -6.098
   48   1HB   SER   2          HB1       SER   2 -15.123  -8.368  -7.032
   49   2HB   SER   2          HB2       SER   2 -14.887 -10.084  -7.386
   50    HG   SER   2           HG       SER   2 -15.424 -10.379  -5.057
   51    H    ALA   3           HN       ALA   3 -11.669  -9.688  -7.778
   52    HA   ALA   3           HA       ALA   3 -10.173  -7.416  -7.870
   53   1HB   ALA   3          HB1       ALA   3  -9.560  -8.091 -10.163
   54   2HB   ALA   3          HB2       ALA   3 -10.892  -9.248 -10.150
   55   3HB   ALA   3          HB3       ALA   3  -9.554  -9.433  -9.017
   56    H    LYS   4           HN       LYS   4 -13.317  -7.790  -9.567
   57    HA   LYS   4           HA       LYS   4 -13.050  -5.285 -10.906
   58   1HB   LYS   4          HB1       LYS   4 -14.261  -7.267 -11.825
   59   2HB   LYS   4          HB2       LYS   4 -15.577  -6.885 -10.714
   60   1HG   LYS   4          HG1       LYS   4 -14.901  -4.468 -12.007
   61   2HG   LYS   4          HG2       LYS   4 -14.960  -5.701 -13.260
   62   1HD   LYS   4          HD1       LYS   4 -17.216  -6.018 -13.028
   63   2HD   LYS   4          HD2       LYS   4 -17.200  -5.632 -11.303
   64   1HE   LYS   4          HE1       LYS   4 -16.717  -3.545 -13.432
   65   2HE   LYS   4          HE2       LYS   4 -18.334  -3.930 -12.841
   66   1HZ   LYS   4          HZ1       LYS   4 -16.156  -3.216 -10.984
   67   2HZ   LYS   4          HZ2       LYS   4 -17.826  -3.155 -10.730
   68   3HZ   LYS   4          HZ3       LYS   4 -17.089  -2.023 -11.746
   69    H    LYS   5           HN       LYS   5 -13.527  -5.640  -7.750
   70    HA   LYS   5           HA       LYS   5 -15.249  -3.249  -7.559
   71   1HB   LYS   5          HB1       LYS   5 -14.889  -5.402  -5.458
   72   2HB   LYS   5          HB2       LYS   5 -15.849  -3.940  -5.269
   73   1HG   LYS   5          HG1       LYS   5 -17.123  -4.809  -7.376
   74   2HG   LYS   5          HG2       LYS   5 -16.412  -6.365  -6.938
   75   1HD   LYS   5          HD1       LYS   5 -17.665  -4.889  -4.708
   76   2HD   LYS   5          HD2       LYS   5 -18.781  -5.428  -5.962
   77   1HE   LYS   5          HE1       LYS   5 -18.600  -7.109  -4.201
   78   2HE   LYS   5          HE2       LYS   5 -17.935  -7.730  -5.712
   79   1HZ   LYS   5          HZ1       LYS   5 -16.212  -6.484  -3.657
   80   2HZ   LYS   5          HZ2       LYS   5 -15.767  -7.494  -4.945
   81   3HZ   LYS   5          HZ3       LYS   5 -16.605  -8.134  -3.623
   82    H    GLY   6           HN       GLY   6 -12.535  -4.945  -5.955
   83   1HA   GLY   6          HA1       GLY   6 -11.593  -2.798  -4.423
   84   2HA   GLY   6          HA2       GLY   6 -10.606  -4.127  -5.008
   85    H    ALA   7           HN       ALA   7 -11.145  -3.460  -7.859
   86    HA   ALA   7           HA       ALA   7  -9.000  -1.761  -8.395
   87   1HB   ALA   7          HB1       ALA   7  -9.820  -3.449  -9.975
   88   2HB   ALA   7          HB2       ALA   7  -9.705  -1.855 -10.722
   89   3HB   ALA   7          HB3       ALA   7 -11.277  -2.489 -10.238
   90    H    THR   8           HN       THR   8 -12.545  -0.955  -8.577
   91    HA   THR   8           HA       THR   8 -12.244   1.679  -9.400
   92    HB   THR   8           HB       THR   8 -14.381   1.909  -7.705
   93    HG1  THR   8           HG1      THR   8 -14.106  -0.386  -7.248
   94   1HG2  THR   8          HG21      THR   8 -14.354   0.791 -10.510
   95   2HG2  THR   8          HG22      THR   8 -14.371   2.501 -10.073
   96   3HG2  THR   8          HG23      THR   8 -15.758   1.479  -9.692
   97    H    LEU   9           HN       LEU   9 -11.833   0.432  -6.127
   98    HA   LEU   9           HA       LEU   9 -11.716   2.899  -4.763
   99   1HB   LEU   9          HB1       LEU   9 -11.131   0.063  -4.155
  100   2HB   LEU   9          HB2       LEU   9 -10.203   1.232  -3.218
  101    HG   LEU   9           HG       LEU   9 -12.172   0.792  -1.956
  102   1HD1  LEU   9          HD11      LEU   9 -11.517   3.183  -2.164
  103   2HD1  LEU   9          HD12      LEU   9 -13.239   2.962  -1.854
  104   3HD1  LEU   9          HD13      LEU   9 -12.679   3.348  -3.481
  105   1HD2  LEU   9          HD21      LEU   9 -13.596  -0.210  -3.664
  106   2HD2  LEU   9          HD22      LEU   9 -13.745   1.346  -4.479
  107   3HD2  LEU   9          HD23      LEU   9 -14.451   1.120  -2.878
  108    H    PHE  10           HN       PHE  10  -8.948   0.709  -4.993
  109    HA   PHE  10           HA       PHE  10  -6.840   2.339  -4.674
  110   1HB   PHE  10          HB1       PHE  10  -6.783  -0.119  -5.057
  111   2HB   PHE  10          HB2       PHE  10  -6.972   0.172  -6.779
  112    HD1  PHE  10           HD1      PHE  10  -5.128   1.672  -7.916
  113    HD2  PHE  10           HD2      PHE  10  -4.670  -0.347  -4.145
  114    HE1  PHE  10           HE1      PHE  10  -2.649   1.766  -8.161
  115    HE2  PHE  10           HE2      PHE  10  -2.201  -0.137  -4.332
  116    HZ   PHE  10           HZ       PHE  10  -1.185   0.895  -6.348
  117    H    LYS  11           HN       LYS  11  -8.654   2.062  -7.705
  118    HA   LYS  11           HA       LYS  11  -6.950   3.482  -9.390
  119   1HB   LYS  11          HB1       LYS  11  -9.299   2.114  -9.685
  120   2HB   LYS  11          HB2       LYS  11  -9.791   3.770 -10.037
  121   1HG   LYS  11          HG1       LYS  11  -8.927   3.568 -12.078
  122   2HG   LYS  11          HG2       LYS  11  -7.331   3.396 -11.354
  123   1HD   LYS  11          HD1       LYS  11  -9.260   1.145 -11.963
  124   2HD   LYS  11          HD2       LYS  11  -7.813   1.547 -12.890
  125   1HE   LYS  11          HE1       LYS  11  -6.422   1.052 -10.913
  126   2HE   LYS  11          HE2       LYS  11  -7.870   0.638 -10.001
  127   1HZ   LYS  11          HZ1       LYS  11  -8.271  -1.185 -11.548
  128   2HZ   LYS  11          HZ2       LYS  11  -6.758  -1.338 -10.812
  129   3HZ   LYS  11          HZ3       LYS  11  -6.864  -0.787 -12.406
  130    H    THR  12           HN       THR  12  -9.042   4.796  -6.979
  131    HA   THR  12           HA       THR  12  -8.242   7.507  -7.663
  132    HB   THR  12           HB       THR  12 -10.404   7.121  -8.714
  133    HG1  THR  12           HG1      THR  12  -9.860   9.086  -6.883
  134   1HG2  THR  12          HG21      THR  12 -11.554   5.661  -7.161
  135   2HG2  THR  12          HG22      THR  12 -12.473   7.149  -7.394
  136   3HG2  THR  12          HG23      THR  12 -11.527   6.918  -5.923
  137    H    ARG  13           HN       ARG  13  -7.452   5.583  -5.657
  138    HA   ARG  13           HA       ARG  13  -7.660   7.227  -3.235
  139   1HB   ARG  13          HB1       ARG  13  -8.014   4.229  -3.339
  140   2HB   ARG  13          HB2       ARG  13  -7.802   5.148  -1.864
  141   1HG   ARG  13          HG1       ARG  13 -10.091   5.626  -3.749
  142   2HG   ARG  13          HG2       ARG  13 -10.152   4.421  -2.470
  143   1HD   ARG  13          HD1       ARG  13 -11.240   6.458  -1.736
  144   2HD   ARG  13          HD2       ARG  13  -9.753   6.223  -0.809
  145    HE   ARG  13           HE       ARG  13  -9.750   7.585  -3.229
  146   1HH1  ARG  13          HH11      ARG  13  -9.817   7.896   0.252
  147   2HH1  ARG  13          HH12      ARG  13  -8.925   9.364   0.422
  148   1HH2  ARG  13          HH21      ARG  13  -8.374   9.819  -2.923
  149   2HH2  ARG  13          HH22      ARG  13  -8.106  10.401  -1.317
  150    H    CYS  14           HN       CYS  14  -5.851   5.059  -5.227
  151    HA   CYS  14           HA       CYS  14  -3.417   5.539  -3.646
  152   1HB   CYS  14          HB1       CYS  14  -3.869   2.926  -5.028
  153   2HB   CYS  14          HB2       CYS  14  -2.756   3.306  -3.733
  154    H    LEU  15           HN       LEU  15  -4.756   4.575  -6.815
  155    HA   LEU  15           HA       LEU  15  -2.593   4.533  -8.434
  156   1HB   LEU  15          HB1       LEU  15  -5.167   4.326  -8.896
  157   2HB   LEU  15          HB2       LEU  15  -5.020   6.014  -9.367
  158    HG   LEU  15           HG       LEU  15  -3.206   5.352 -10.977
  159   1HD1  LEU  15          HD11      LEU  15  -2.944   3.032 -11.602
  160   2HD1  LEU  15          HD12      LEU  15  -4.126   2.539 -10.388
  161   3HD1  LEU  15          HD13      LEU  15  -2.578   3.221  -9.887
  162   1HD2  LEU  15          HD21      LEU  15  -4.733   4.252 -12.619
  163   2HD2  LEU  15          HD22      LEU  15  -5.412   5.694 -11.863
  164   3HD2  LEU  15          HD23      LEU  15  -5.926   4.092 -11.330
  165    H    GLN  16           HN       GLN  16  -4.137   7.503  -7.272
  166    HA   GLN  16           HA       GLN  16  -3.085   9.496  -8.722
  167   1HB   GLN  16          HB1       GLN  16  -2.975  10.731  -6.395
  168   2HB   GLN  16          HB2       GLN  16  -4.503  10.257  -7.118
  169   1HG   GLN  16          HG1       GLN  16  -4.357   8.137  -5.713
  170   2HG   GLN  16          HG2       GLN  16  -3.037   8.927  -4.847
  171   1HE2  GLN  16          HE21      GLN  16  -3.558  10.962  -3.722
  172   2HE2  GLN  16          HE22      GLN  16  -5.176  11.238  -3.194
  173    H    CYS  17           HN       CYS  17  -1.191   7.704  -6.310
  174    HA   CYS  17           HA       CYS  17   1.211   9.184  -7.142
  175   1HB   CYS  17          HB1       CYS  17   1.207   7.926  -4.464
  176   2HB   CYS  17          HB2       CYS  17   1.918   9.428  -5.030
  177    H    HIS  18           HN       HIS  18  -0.070   6.001  -6.338
  178    HA   HIS  18           HA       HIS  18   2.529   4.698  -6.556
  179   1HB   HIS  18          HB1       HIS  18  -0.177   3.895  -5.561
  180   2HB   HIS  18          HB2       HIS  18   1.032   2.672  -5.915
  181    HD1  HIS  18           HD1      HIS  18   3.456   3.181  -4.478
  182    HD2  HIS  18           HD2      HIS  18  -0.193   4.708  -3.106
  183    HE1  HIS  18           HE1      HIS  18   3.757   3.598  -1.995
  184    H    THR  19           HN       THR  19   2.281   2.408  -7.451
  185    HA   THR  19           HA       THR  19   0.886   2.275 -10.022
  186    HB   THR  19           HB       THR  19   3.173   0.920 -10.552
  187    HG1  THR  19           HG1      THR  19   4.443   3.122  -9.694
  188   1HG2  THR  19          HG21      THR  19   2.776   3.883 -10.971
  189   2HG2  THR  19          HG22      THR  19   2.147   2.607 -12.013
  190   3HG2  THR  19          HG23      THR  19   3.887   2.847 -11.865
  191    H    VAL  20           HN       VAL  20  -0.375   0.481 -10.110
  192    HA   VAL  20           HA       VAL  20  -0.289  -1.526  -8.069
  193    HB   VAL  20           HB       VAL  20  -2.236  -0.417  -9.502
  194   1HG1  VAL  20          HG11      VAL  20  -1.735  -1.578 -11.569
  195   2HG1  VAL  20          HG12      VAL  20  -3.324  -2.025 -10.947
  196   3HG1  VAL  20          HG13      VAL  20  -1.964  -3.133 -10.765
  197   1HG2  VAL  20          HG21      VAL  20  -3.785  -2.083  -8.590
  198   2HG2  VAL  20          HG22      VAL  20  -2.605  -1.531  -7.402
  199   3HG2  VAL  20          HG23      VAL  20  -2.414  -3.108  -8.165
  200    H    GLU  21           HN       GLU  21   0.857  -1.414 -11.315
  201    HA   GLU  21           HA       GLU  21   1.601  -4.264 -11.296
  202   1HB   GLU  21          HB1       GLU  21   1.848  -3.648 -13.893
  203   2HB   GLU  21          HB2       GLU  21   0.325  -4.190 -13.216
  204   1HG   GLU  21          HG1       GLU  21   0.239  -2.198 -14.795
  205   2HG   GLU  21          HG2       GLU  21  -0.599  -2.021 -13.256
  206    H    LYS  22           HN       LYS  22   3.714  -4.420 -13.001
  207    HA   LYS  22           HA       LYS  22   5.575  -2.438 -11.941
  208   1HB   LYS  22          HB1       LYS  22   5.740  -5.241 -12.292
  209   2HB   LYS  22          HB2       LYS  22   7.007  -4.487 -13.275
  210   1HG   LYS  22          HG1       LYS  22   8.046  -3.523 -11.474
  211   2HG   LYS  22          HG2       LYS  22   6.548  -3.378 -10.554
  212   1HD   LYS  22          HD1       LYS  22   6.588  -5.707 -10.003
  213   2HD   LYS  22          HD2       LYS  22   7.949  -5.989 -11.089
  214   1HE   LYS  22          HE1       LYS  22   8.858  -5.938  -8.895
  215   2HE   LYS  22          HE2       LYS  22   9.300  -4.415  -9.647
  216   1HZ   LYS  22          HZ1       LYS  22   7.488  -3.345  -8.379
  217   2HZ   LYS  22          HZ2       LYS  22   8.633  -4.062  -7.366
  218   3HZ   LYS  22          HZ3       LYS  22   7.147  -4.821  -7.623
  219    H    GLY  23           HN       GLY  23   3.870  -1.923 -14.427
  220   1HA   GLY  23          HA1       GLY  23   6.018  -1.498 -16.399
  221   2HA   GLY  23          HA2       GLY  23   4.296  -1.406 -16.728
  222    H    GLY  24           HN       GLY  24   3.970   0.286 -14.226
  223   1HA   GLY  24          HA1       GLY  24   4.305   2.870 -15.456
  224   2HA   GLY  24          HA2       GLY  24   3.495   2.515 -13.939
  225    HA   PRO  25           HA       PRO  25   8.211   3.738 -13.412
  226   1HB   PRO  25          HB1       PRO  25   8.118   6.473 -13.725
  227   2HB   PRO  25          HB2       PRO  25   8.692   5.347 -14.959
  228   1HG   PRO  25          HG1       PRO  25   6.023   6.664 -14.688
  229   2HG   PRO  25          HG2       PRO  25   6.985   6.368 -16.148
  230   1HD   PRO  25          HD1       PRO  25   4.874   4.829 -15.499
  231   2HD   PRO  25          HD2       PRO  25   6.315   4.157 -16.292
  232    H    HIS  26           HN       HIS  26   8.902   4.661 -11.433
  233    HA   HIS  26           HA       HIS  26   7.033   4.749  -9.347
  234   1HB   HIS  26          HB1       HIS  26   9.894   5.697  -9.575
  235   2HB   HIS  26          HB2       HIS  26   9.002   5.727  -8.063
  236    HD2  HIS  26           HD2      HIS  26  10.946   3.402 -10.367
  237    HE1  HIS  26           HE1      HIS  26   9.737   1.038  -7.052
  238    HE2  HIS  26           HE2      HIS  26  11.215   1.126  -9.115
  239    H    LYS  27           HN       LYS  27   5.672   6.376  -8.762
  240    HA   LYS  27           HA       LYS  27   6.179   9.097  -9.733
  241   1HB   LYS  27          HB1       LYS  27   4.115   7.690 -10.437
  242   2HB   LYS  27          HB2       LYS  27   3.480   8.116  -8.852
  243   1HG   LYS  27          HG1       LYS  27   4.023  10.559  -9.536
  244   2HG   LYS  27          HG2       LYS  27   4.089   9.913 -11.180
  245   1HD   LYS  27          HD1       LYS  27   1.756  10.268  -9.369
  246   2HD   LYS  27          HD2       LYS  27   1.853  10.405 -11.129
  247   1HE   LYS  27          HE1       LYS  27   1.873   8.001 -11.373
  248   2HE   LYS  27          HE2       LYS  27   1.984   7.782  -9.627
  249   1HZ   LYS  27          HZ1       LYS  27  -0.233   7.505  -9.882
  250   2HZ   LYS  27          HZ2       LYS  27  -0.323   8.468 -11.267
  251   3HZ   LYS  27          HZ3       LYS  27  -0.231   9.197  -9.745
  252    H    VAL  28           HN       VAL  28   4.011   9.962  -7.709
  253    HA   VAL  28           HA       VAL  28   5.661  10.993  -5.708
  254    HB   VAL  28           HB       VAL  28   2.705  10.500  -5.380
  255   1HG1  VAL  28          HG11      VAL  28   4.546  12.652  -4.319
  256   2HG1  VAL  28          HG12      VAL  28   3.821  11.340  -3.389
  257   3HG1  VAL  28          HG13      VAL  28   2.799  12.600  -4.082
  258   1HG2  VAL  28          HG21      VAL  28   4.060  12.728  -6.911
  259   2HG2  VAL  28          HG22      VAL  28   2.393  12.801  -6.344
  260   3HG2  VAL  28          HG23      VAL  28   2.870  11.578  -7.521
  261    H    GLY  29           HN       GLY  29   4.218   7.898  -6.047
  262   1HA   GLY  29          HA1       GLY  29   5.166   7.018  -3.398
  263   2HA   GLY  29          HA2       GLY  29   3.649   6.454  -4.079
  264    HA   PRO  30           HA       PRO  30   7.489   3.890  -5.522
  265   1HB   PRO  30          HB1       PRO  30   7.485   1.894  -3.691
  266   2HB   PRO  30          HB2       PRO  30   8.422   3.379  -3.493
  267   1HG   PRO  30          HG1       PRO  30   5.755   2.656  -2.330
  268   2HG   PRO  30          HG2       PRO  30   7.153   3.405  -1.536
  269   1HD   PRO  30          HD1       PRO  30   5.039   4.850  -2.374
  270   2HD   PRO  30          HD2       PRO  30   6.694   5.491  -2.414
  271    H    ASN  31           HN       ASN  31   7.433   1.581  -6.248
  272    HA   ASN  31           HA       ASN  31   4.858   0.911  -7.298
  273   1HB   ASN  31          HB1       ASN  31   7.046   0.682  -8.511
  274   2HB   ASN  31          HB2       ASN  31   7.465  -0.643  -7.434
  275   1HD2  ASN  31          HD21      ASN  31   5.373   0.322 -10.089
  276   2HD2  ASN  31          HD22      ASN  31   4.954  -1.298 -10.540
  277    H    LEU  32           HN       LEU  32   3.384  -0.464  -6.446
  278    HA   LEU  32           HA       LEU  32   3.805  -1.731  -3.873
  279   1HB   LEU  32          HB1       LEU  32   1.314  -1.193  -5.495
  280   2HB   LEU  32          HB2       LEU  32   1.324  -1.910  -3.896
  281    HG   LEU  32           HG       LEU  32   2.228   0.901  -4.585
  282   1HD1  LEU  32          HD11      LEU  32   0.283   1.501  -3.097
  283   2HD1  LEU  32          HD12      LEU  32  -0.211  -0.191  -3.177
  284   3HD1  LEU  32          HD13      LEU  32  -0.158   0.781  -4.647
  285   1HD2  LEU  32          HD21      LEU  32   3.532  -0.020  -2.707
  286   2HD2  LEU  32          HD22      LEU  32   2.032  -0.431  -1.876
  287   3HD2  LEU  32          HD23      LEU  32   2.436   1.258  -2.180
  288    H    HIS  33           HN       HIS  33   3.606  -2.729  -7.149
  289    HA   HIS  33           HA       HIS  33   2.508  -5.291  -7.044
  290   1HB   HIS  33          HB1       HIS  33   2.960  -3.837  -9.066
  291   2HB   HIS  33          HB2       HIS  33   4.653  -4.303  -8.931
  292    HD2  HIS  33           HD2      HIS  33   1.383  -6.459  -8.829
  293    HE1  HIS  33           HE1      HIS  33   3.954  -8.085 -11.796
  294    HE2  HIS  33           HE2      HIS  33   1.755  -8.386 -10.559
  295    H    GLY  34           HN       GLY  34   3.302  -6.508  -5.351
  296   1HA   GLY  34          HA1       GLY  34   4.795  -8.432  -5.056
  297   2HA   GLY  34          HA2       GLY  34   6.123  -7.368  -5.470
  298    H    ILE  35           HN       ILE  35   3.865  -5.801  -3.365
  299    HA   ILE  35           HA       ILE  35   5.793  -5.714  -1.299
  300    HB   ILE  35           HB       ILE  35   4.153  -4.622   0.121
  301   1HG1  ILE  35          HG11      ILE  35   2.193  -5.373  -2.015
  302   2HG1  ILE  35          HG12      ILE  35   1.977  -5.292  -0.268
  303   1HG2  ILE  35          HG21      ILE  35   4.458  -3.550  -2.674
  304   2HG2  ILE  35          HG22      ILE  35   5.582  -3.371  -1.328
  305   3HG2  ILE  35          HG23      ILE  35   4.002  -2.591  -1.265
  306   1HD1  ILE  35          HD11      ILE  35   2.049  -2.976  -2.205
  307   2HD1  ILE  35          HD12      ILE  35   2.047  -2.791  -0.451
  308   3HD1  ILE  35          HD13      ILE  35   0.672  -3.543  -1.258
  309    H    PHE  36           HN       PHE  36   2.879  -7.750  -1.585
  310    HA   PHE  36           HA       PHE  36   2.856  -8.824   0.968
  311   1HB   PHE  36          HB1       PHE  36   2.031 -10.167  -1.613
  312   2HB   PHE  36          HB2       PHE  36   1.589 -10.704   0.007
  313    HD1  PHE  36           HD1      PHE  36   0.743  -8.486   1.484
  314    HD2  PHE  36           HD2      PHE  36   0.252  -9.176  -2.734
  315    HE1  PHE  36           HE1      PHE  36  -1.198  -6.931   1.463
  316    HE2  PHE  36           HE2      PHE  36  -1.690  -7.621  -2.759
  317    HZ   PHE  36           HZ       PHE  36  -2.410  -6.490  -0.663
  318    H    GLY  37           HN       GLY  37   4.463  -9.648   1.992
  319   1HA   GLY  37          HA1       GLY  37   5.754 -11.549   2.590
  320   2HA   GLY  37          HA2       GLY  37   6.062 -11.849   0.890
  321    H    ARG  38           HN       ARG  38   6.479  -8.577   1.319
  322    HA   ARG  38           HA       ARG  38   9.398  -8.816   1.646
  323   1HB   ARG  38          HB1       ARG  38   7.647  -6.861   0.139
  324   2HB   ARG  38          HB2       ARG  38   9.329  -6.502   0.501
  325   1HG   ARG  38          HG1       ARG  38   9.615  -8.932  -0.632
  326   2HG   ARG  38          HG2       ARG  38   8.170  -8.365  -1.473
  327   1HD   ARG  38          HD1       ARG  38  10.823  -6.912  -1.302
  328   2HD   ARG  38          HD2       ARG  38  10.189  -7.753  -2.718
  329    HE   ARG  38           HE       ARG  38   8.677  -6.269  -1.499
  330   1HH1  ARG  38          HH21      ARG  38  11.195  -6.087  -3.846
  331   2HH1  ARG  38          HH22      ARG  38  10.380  -4.998  -4.846
  332   1HH2  ARG  38          HH11      ARG  38   7.961  -3.906  -2.916
  333   2HH2  ARG  38          HH12      ARG  38   9.290  -3.424  -3.877
  334    H    HIS  39           HN       HIS  39  10.246  -6.501   2.375
  335    HA   HIS  39           HA       HIS  39   8.888  -5.901   4.914
  336   1HB   HIS  39          HB1       HIS  39  11.768  -5.337   4.140
  337   2HB   HIS  39          HB2       HIS  39  11.057  -5.206   5.752
  338    HD2  HIS  39           HD2      HIS  39  10.404  -7.529   7.023
  339    HE1  HIS  39           HE1      HIS  39  12.519 -10.129   4.401
  340    HE2  HIS  39           HE2      HIS  39  11.245  -9.969   6.593
  341    H    SER  40           HN       SER  40   8.951  -3.604   5.639
  342    HA   SER  40           HA       SER  40   8.086  -1.805   3.668
  343   1HB   SER  40          HB1       SER  40   9.164  -0.754   6.255
  344   2HB   SER  40          HB2       SER  40   7.780  -0.207   5.321
  345    HG   SER  40           HG       SER  40   6.823  -2.303   5.956
  346    H    GLY  41           HN       GLY  41   9.055  -0.286   2.480
  347   1HA   GLY  41          HA1       GLY  41  10.720   1.186   1.784
  348   2HA   GLY  41          HA2       GLY  41  11.770   0.578   3.040
  349    H    GLN  42           HN       GLN  42  10.297  -1.337   0.330
  350    HA   GLN  42           HA       GLN  42  13.039  -1.769  -0.623
  351   1HB   GLN  42          HB1       GLN  42  10.915  -3.898  -0.574
  352   2HB   GLN  42          HB2       GLN  42  12.586  -4.091  -1.090
  353   1HG   GLN  42          HG1       GLN  42  13.351  -3.537   1.184
  354   2HG   GLN  42          HG2       GLN  42  11.675  -3.365   1.700
  355   1HE2  GLN  42          HE21      GLN  42  13.752  -5.245   2.667
  356   2HE2  GLN  42          HE22      GLN  42  13.093  -6.821   2.425
  357    H    ALA  43           HN       ALA  43  11.302   0.202  -1.925
  358    HA   ALA  43           HA       ALA  43  10.306  -0.832  -4.365
  359   1HB   ALA  43          HB1       ALA  43  11.129   1.981  -3.673
  360   2HB   ALA  43          HB2       ALA  43   9.539   1.262  -3.420
  361   3HB   ALA  43          HB3       ALA  43  10.146   1.504  -5.057
  362    H    GLU  44           HN       GLU  44  11.156  -1.159  -6.337
  363    HA   GLU  44           HA       GLU  44  13.964  -1.326  -6.691
  364   1HB   GLU  44          HB1       GLU  44  11.894  -1.811  -8.846
  365   2HB   GLU  44          HB2       GLU  44  13.508  -2.502  -8.715
  366   1HG   GLU  44          HG1       GLU  44  12.146  -4.256  -8.023
  367   2HG   GLU  44          HG2       GLU  44  12.684  -3.551  -6.511
  368    H    GLY  45           HN       GLY  45  14.198   1.068  -6.248
  369   1HA   GLY  45          HA1       GLY  45  15.554   2.653  -7.577
  370   2HA   GLY  45          HA2       GLY  45  14.265   2.626  -8.760
  371    H    TYR  46           HN       TYR  46  13.283   2.737  -5.437
  372    HA   TYR  46           HA       TYR  46  12.919   5.638  -5.491
  373   1HB   TYR  46          HB1       TYR  46  10.866   4.688  -6.283
  374   2HB   TYR  46          HB2       TYR  46  10.782   3.602  -4.902
  375    HD1  TYR  46           HD1      TYR  46  10.105   6.962  -6.150
  376    HD2  TYR  46           HD2      TYR  46  10.356   4.519  -2.626
  377    HE1  TYR  46           HE1      TYR  46   8.689   8.606  -4.926
  378    HE2  TYR  46           HE2      TYR  46   8.849   6.091  -1.417
  379    HH   TYR  46           HH       TYR  46   7.151   8.643  -3.070
  380    H    SER  47           HN       SER  47  13.040   6.731  -3.582
  381    HA   SER  47           HA       SER  47  14.279   5.347  -1.347
  382   1HB   SER  47          HB1       SER  47  14.040   8.217  -1.014
  383   2HB   SER  47          HB2       SER  47  15.487   7.209  -1.083
  384    HG   SER  47           HG       SER  47  15.546   7.419  -3.261
  385    H    TYR  48           HN       TYR  48  13.641   5.444   0.730
  386    HA   TYR  48           HA       TYR  48  10.911   6.227   1.451
  387   1HB   TYR  48          HB1       TYR  48  12.678   3.927   2.278
  388   2HB   TYR  48          HB2       TYR  48  11.190   4.332   3.128
  389    HD1  TYR  48           HD1      TYR  48   9.017   4.045   2.083
  390    HD2  TYR  48           HD2      TYR  48  12.626   2.956   0.014
  391    HE1  TYR  48           HE1      TYR  48   7.691   2.622   0.536
  392    HE2  TYR  48           HE2      TYR  48  11.310   1.530  -1.539
  393    HH   TYR  48           HH       TYR  48   8.345   0.379  -0.818
  394    H    THR  49           HN       THR  49  10.596   6.851   3.813
  395    HA   THR  49           HA       THR  49  12.449   8.813   4.729
  396    HB   THR  49           HB       THR  49  10.930   8.634   6.868
  397    HG1  THR  49           HG1      THR  49   9.043   7.736   5.020
  398   1HG2  THR  49          HG21      THR  49  11.014  10.520   5.300
  399   2HG2  THR  49          HG22      THR  49   9.386  10.205   5.899
  400   3HG2  THR  49          HG23      THR  49   9.841   9.694   4.273
  401    H    ASP  50           HN       ASP  50  13.453   8.953   6.815
  402    HA   ASP  50           HA       ASP  50  15.159   6.945   7.550
  403   1HB   ASP  50          HB1       ASP  50  15.534   9.224   8.184
  404   2HB   ASP  50          HB2       ASP  50  14.045   9.271   9.126
  405    H    ALA  51           HN       ALA  51  11.883   7.470   8.733
  406    HA   ALA  51           HA       ALA  51  12.048   5.501  10.824
  407   1HB   ALA  51          HB1       ALA  51  10.823   7.632  11.072
  408   2HB   ALA  51          HB2       ALA  51   9.814   6.219  11.383
  409   3HB   ALA  51          HB3       ALA  51   9.670   7.084   9.853
  410    H    ASN  52           HN       ASN  52  10.663   5.554   7.520
  411    HA   ASN  52           HA       ASN  52   9.090   3.207   7.864
  412   1HB   ASN  52          HB1       ASN  52   8.328   4.543   6.140
  413   2HB   ASN  52          HB2       ASN  52   9.946   4.889   5.545
  414   1HD2  ASN  52          HD21      ASN  52   7.179   2.895   5.129
  415   2HD2  ASN  52          HD22      ASN  52   7.857   1.984   3.828
  416    H    ILE  53           HN       ILE  53  12.410   3.727   6.779
  417    HA   ILE  53           HA       ILE  53  12.946   1.079   5.957
  418    HB   ILE  53           HB       ILE  53  14.749   3.312   6.828
  419   1HG1  ILE  53          HG11      ILE  53  14.256   2.189   4.051
  420   2HG1  ILE  53          HG12      ILE  53  13.370   3.562   4.709
  421   1HG2  ILE  53          HG21      ILE  53  15.898   1.146   7.179
  422   2HG2  ILE  53          HG22      ILE  53  16.636   2.082   5.879
  423   3HG2  ILE  53          HG23      ILE  53  15.582   0.722   5.495
  424   1HD1  ILE  53          HD11      ILE  53  15.161   4.337   3.267
  425   2HD1  ILE  53          HD12      ILE  53  16.348   3.434   4.208
  426   3HD1  ILE  53          HD13      ILE  53  15.501   4.798   4.936
  427    H    LYS  54           HN       LYS  54  14.292   2.616   8.937
  428    HA   LYS  54           HA       LYS  54  14.925   0.497  10.460
  429   1HB   LYS  54          HB1       LYS  54  13.441   2.956  11.393
  430   2HB   LYS  54          HB2       LYS  54  14.364   1.864  12.429
  431   1HG   LYS  54          HG1       LYS  54  16.416   2.420  11.357
  432   2HG   LYS  54          HG2       LYS  54  15.582   3.263  10.049
  433   1HD   LYS  54          HD1       LYS  54  14.777   4.948  11.675
  434   2HD   LYS  54          HD2       LYS  54  15.685   4.120  12.950
  435   1HE   LYS  54          HE1       LYS  54  17.776   4.555  11.835
  436   2HE   LYS  54          HE2       LYS  54  16.940   5.197  10.419
  437   1HZ   LYS  54          HZ1       LYS  54  16.990   6.392  13.130
  438   2HZ   LYS  54          HZ2       LYS  54  16.046   6.963  11.842
  439   3HZ   LYS  54          HZ3       LYS  54  17.734   6.998  11.731
  440    H    LYS  55           HN       LYS  55  11.746   1.021   9.355
  441    HA   LYS  55           HA       LYS  55  10.359  -0.299  11.527
  442   1HB   LYS  55          HB1       LYS  55   9.444   1.649  10.337
  443   2HB   LYS  55          HB2       LYS  55   9.356   0.708   8.867
  444   1HG   LYS  55          HG1       LYS  55   7.176   0.856   9.706
  445   2HG   LYS  55          HG2       LYS  55   7.714  -0.783  10.024
  446   1HD   LYS  55          HD1       LYS  55   7.898   1.324  12.154
  447   2HD   LYS  55          HD2       LYS  55   6.372   0.503  11.833
  448   1HE   LYS  55          HE1       LYS  55   8.979  -0.829  12.599
  449   2HE   LYS  55          HE2       LYS  55   7.594  -0.578  13.663
  450   1HZ   LYS  55          HZ1       LYS  55   7.492  -2.799  12.867
  451   2HZ   LYS  55          HZ2       LYS  55   7.731  -2.320  11.267
  452   3HZ   LYS  55          HZ3       LYS  55   6.282  -1.938  12.049
  453    H    ASN  56           HN       ASN  56  11.341  -1.169   8.278
  454    HA   ASN  56           HA       ASN  56  10.918  -2.937   6.914
  455   1HB   ASN  56          HB1       ASN  56  12.804  -3.525   9.075
  456   2HB   ASN  56          HB2       ASN  56  12.236  -4.947   8.231
  457   1HD2  ASN  56          HD21      ASN  56  13.752  -1.730   7.549
  458   2HD2  ASN  56          HD22      ASN  56  14.319  -2.388   6.075
  459    H    VAL  57           HN       VAL  57   8.462  -2.757   7.974
  460    HA   VAL  57           HA       VAL  57   7.614  -5.078   9.388
  461    HB   VAL  57           HB       VAL  57   6.477  -2.636   8.783
  462   1HG1  VAL  57          HG11      VAL  57   4.744  -4.763   7.526
  463   2HG1  VAL  57          HG12      VAL  57   5.443  -3.369   6.703
  464   3HG1  VAL  57          HG13      VAL  57   4.222  -3.133   7.954
  465   1HG2  VAL  57          HG21      VAL  57   6.269  -3.789  10.842
  466   2HG2  VAL  57          HG22      VAL  57   5.397  -5.120  10.081
  467   3HG2  VAL  57          HG23      VAL  57   4.641  -3.533  10.212
  468    H    LEU  58           HN       LEU  58   6.760  -6.997   8.646
  469    HA   LEU  58           HA       LEU  58   7.334  -7.612   5.875
  470   1HB   LEU  58          HB1       LEU  58   8.068  -9.167   7.632
  471   2HB   LEU  58          HB2       LEU  58   6.396  -9.415   8.118
  472    HG   LEU  58           HG       LEU  58   6.006 -10.192   5.668
  473   1HD1  LEU  58          HD11      LEU  58   9.016 -10.388   5.872
  474   2HD1  LEU  58          HD12      LEU  58   8.093  -9.424   4.719
  475   3HD1  LEU  58          HD13      LEU  58   8.041 -11.184   4.635
  476   1HD2  LEU  58          HD21      LEU  58   7.752 -11.923   7.433
  477   2HD2  LEU  58          HD22      LEU  58   6.694 -12.478   6.137
  478   3HD2  LEU  58          HD23      LEU  58   6.003 -11.759   7.591
  479    H    TRP  59           HN       TRP  59   5.866  -6.760   4.557
  480    HA   TRP  59           HA       TRP  59   3.178  -6.259   5.075
  481   1HB   TRP  59          HB1       TRP  59   4.611  -6.679   2.455
  482   2HB   TRP  59          HB2       TRP  59   2.981  -6.048   2.595
  483    HD1  TRP  59           HD1      TRP  59   6.217  -4.844   1.888
  484    HE1  TRP  59           HE1      TRP  59   6.521  -2.369   2.546
  485    HE3  TRP  59           HE3      TRP  59   2.124  -4.224   4.892
  486    HZ2  TRP  59           HZ2      TRP  59   5.296  -0.429   4.254
  487    HZ3  TRP  59           HZ3      TRP  59   1.705  -2.055   5.987
  488    HH2  TRP  59           HH2      TRP  59   3.258  -0.160   5.684
  489    H    ASP  60           HN       ASP  60   1.746  -7.687   5.570
  490    HA   ASP  60           HA       ASP  60   1.376 -10.207   4.127
  491   1HB   ASP  60          HB1       ASP  60   1.829 -11.205   6.081
  492   2HB   ASP  60          HB2       ASP  60   1.872  -9.667   6.920
  493    H    GLU  61           HN       GLU  61  -1.051 -10.955   5.024
  494    HA   GLU  61           HA       GLU  61  -2.843  -9.318   3.550
  495   1HB   GLU  61          HB1       GLU  61  -2.880 -11.929   4.135
  496   2HB   GLU  61          HB2       GLU  61  -3.922 -11.366   5.437
  497   1HG   GLU  61          HG1       GLU  61  -5.567 -11.621   3.914
  498   2HG   GLU  61          HG2       GLU  61  -5.011 -10.055   3.319
  499    H    ASN  62           HN       ASN  62  -2.639 -10.032   7.053
  500    HA   ASN  62           HA       ASN  62  -4.543  -7.983   7.721
  501   1HB   ASN  62          HB1       ASN  62  -4.504 -10.043   8.971
  502   2HB   ASN  62          HB2       ASN  62  -2.815  -9.815   9.393
  503   1HD2  ASN  62          HD21      ASN  62  -2.289  -8.342  11.016
  504   2HD2  ASN  62          HD22      ASN  62  -3.483  -7.676  12.071
  505    H    ASN  63           HN       ASN  63  -0.978  -8.307   8.160
  506    HA   ASN  63           HA       ASN  63  -0.460  -5.971   9.503
  507   1HB   ASN  63          HB1       ASN  63   1.282  -7.490   9.299
  508   2HB   ASN  63          HB2       ASN  63   1.113  -7.617   7.559
  509   1HD2  ASN  63          HD21      ASN  63   2.390  -5.565  10.165
  510   2HD2  ASN  63          HD22      ASN  63   3.217  -4.581   9.010
  511    H    MET  64           HN       MET  64  -0.676  -6.154   5.876
  512    HA   MET  64           HA       MET  64   0.007  -3.531   5.331
  513   1HB   MET  64          HB1       MET  64  -0.353  -5.268   3.636
  514   2HB   MET  64          HB2       MET  64  -2.087  -5.183   3.917
  515   1HG   MET  64          HG1       MET  64  -2.010  -2.793   3.220
  516   2HG   MET  64          HG2       MET  64  -0.323  -3.015   2.798
  517   1HE   MET  64          HE1       MET  64  -3.412  -5.400   2.279
  518   2HE   MET  64          HE2       MET  64  -3.877  -5.019   0.620
  519   3HE   MET  64          HE3       MET  64  -4.068  -3.808   1.889
  520    H    SER  65           HN       SER  65  -3.131  -4.677   6.538
  521    HA   SER  65           HA       SER  65  -4.481  -2.187   6.313
  522   1HB   SER  65          HB1       SER  65  -5.195  -4.375   8.254
  523   2HB   SER  65          HB2       SER  65  -6.258  -3.173   7.533
  524    HG   SER  65           HG       SER  65  -5.288  -5.552   6.501
  525    H    GLU  66           HN       GLU  66  -2.621  -3.639   8.955
  526    HA   GLU  66           HA       GLU  66  -3.201  -1.946  11.053
  527   1HB   GLU  66          HB1       GLU  66  -1.580  -3.148  12.054
  528   2HB   GLU  66          HB2       GLU  66  -1.394  -3.984  10.516
  529   1HG   GLU  66          HG1       GLU  66   0.266  -2.191   9.868
  530   2HG   GLU  66          HG2       GLU  66   0.203  -1.647  11.545
  531    H    TYR  67           HN       TYR  67  -1.023  -1.429   8.350
  532    HA   TYR  67           HA       TYR  67  -0.205   1.229   9.163
  533   1HB   TYR  67          HB1       TYR  67   1.517  -0.079   8.268
  534   2HB   TYR  67          HB2       TYR  67   0.520  -0.652   6.944
  535    HD1  TYR  67           HD1      TYR  67   0.371   0.565   4.870
  536    HD2  TYR  67           HD2      TYR  67   2.457   2.208   8.246
  537    HE1  TYR  67           HE1      TYR  67   1.499   2.200   3.369
  538    HE2  TYR  67           HE2      TYR  67   3.635   3.814   6.758
  539    HH   TYR  67           HH       TYR  67   2.815   4.154   3.366
  540    H    LEU  68           HN       LEU  68  -2.139  -0.185   6.446
  541    HA   LEU  68           HA       LEU  68  -2.573   2.187   5.070
  542   1HB   LEU  68          HB1       LEU  68  -4.258  -0.276   5.362
  543   2HB   LEU  68          HB2       LEU  68  -4.756   1.067   4.349
  544    HG   LEU  68           HG       LEU  68  -2.349  -0.721   3.988
  545   1HD1  LEU  68          HD11      LEU  68  -4.718  -0.003   2.244
  546   2HD1  LEU  68          HD12      LEU  68  -4.580  -1.469   3.214
  547   3HD1  LEU  68          HD13      LEU  68  -3.471  -1.193   1.871
  548   1HD2  LEU  68          HD21      LEU  68  -1.600   1.567   3.465
  549   2HD2  LEU  68          HD22      LEU  68  -3.027   1.812   2.458
  550   3HD2  LEU  68          HD23      LEU  68  -1.807   0.630   1.984
  551    H    THR  69           HN       THR  69  -4.408   1.033   7.917
  552    HA   THR  69           HA       THR  69  -6.501   2.889   7.793
  553    HB   THR  69           HB       THR  69  -5.432   1.956  10.424
  554    HG1  THR  69           HG1      THR  69  -5.452   0.068   9.368
  555   1HG2  THR  69          HG21      THR  69  -7.743   1.820  11.047
  556   2HG2  THR  69          HG22      THR  69  -8.267   2.082   9.384
  557   3HG2  THR  69          HG23      THR  69  -7.506   3.393  10.285
  558    H    ASN  70           HN       ASN  70  -3.195   3.356   8.821
  559    HA   ASN  70           HA       ASN  70  -3.438   6.160   8.728
  560   1HB   ASN  70          HB1       ASN  70  -4.509   5.577  10.993
  561   2HB   ASN  70          HB2       ASN  70  -2.874   5.211  11.533
  562   1HD2  ASN  70          HD21      ASN  70  -4.692   7.317  12.460
  563   2HD2  ASN  70          HD22      ASN  70  -3.641   8.682  12.333
  564    HA   PRO  71           HA       PRO  71   0.792   4.531   7.834
  565   1HB   PRO  71          HB1       PRO  71   1.355   6.585   6.087
  566   2HB   PRO  71          HB2       PRO  71   0.609   5.051   5.627
  567   1HG   PRO  71          HG1       PRO  71  -0.677   7.696   6.176
  568   2HG   PRO  71          HG2       PRO  71  -1.040   6.515   4.904
  569   1HD   PRO  71          HD1       PRO  71  -2.570   6.733   7.098
  570   2HD   PRO  71          HD2       PRO  71  -2.256   5.158   6.338
  571    H    LYS  72           HN       LYS  72  -0.070   7.955   8.320
  572    HA   LYS  72           HA       LYS  72   2.473   8.840   9.161
  573   1HB   LYS  72          HB1       LYS  72  -0.289  10.000   9.399
  574   2HB   LYS  72          HB2       LYS  72   1.091  10.793  10.138
  575   1HG   LYS  72          HG1       LYS  72   2.073  10.529   7.678
  576   2HG   LYS  72          HG2       LYS  72   0.361  10.520   7.274
  577   1HD   LYS  72          HD1       LYS  72   0.052  12.694   8.247
  578   2HD   LYS  72          HD2       LYS  72   1.681  12.678   8.924
  579   1HE   LYS  72          HE1       LYS  72   1.121  12.553   5.965
  580   2HE   LYS  72          HE2       LYS  72   1.345  14.067   6.827
  581   1HZ   LYS  72          HZ1       LYS  72   3.367  13.301   5.725
  582   2HZ   LYS  72          HZ2       LYS  72   3.355  11.892   6.657
  583   3HZ   LYS  72          HZ3       LYS  72   3.567  13.388   7.409
  584    H    LYS  73           HN       LYS  73  -0.268   7.549  10.970
  585    HA   LYS  73           HA       LYS  73   0.859   8.196  13.524
  586   1HB   LYS  73          HB1       LYS  73  -1.530   8.027  13.352
  587   2HB   LYS  73          HB2       LYS  73  -1.423   6.373  12.769
  588   1HG   LYS  73          HG1       LYS  73  -2.105   6.289  15.053
  589   2HG   LYS  73          HG2       LYS  73  -0.442   5.722  14.976
  590   1HD   LYS  73          HD1       LYS  73  -0.032   8.355  15.484
  591   2HD   LYS  73          HD2       LYS  73  -1.579   8.118  16.293
  592   1HE   LYS  73          HE1       LYS  73   0.065   7.718  17.941
  593   2HE   LYS  73          HE2       LYS  73  -0.508   6.125  17.456
  594   1HZ   LYS  73          HZ1       LYS  73   1.750   5.847  17.462
  595   2HZ   LYS  73          HZ2       LYS  73   2.073   7.412  16.915
  596   3HZ   LYS  73          HZ3       LYS  73   1.489   6.250  15.836
  597    H    TYR  74           HN       TYR  74   0.867   5.270  11.525
  598    HA   TYR  74           HA       TYR  74   2.191   3.605  13.403
  599   1HB   TYR  74          HB1       TYR  74   0.843   2.793  11.496
  600   2HB   TYR  74          HB2       TYR  74   2.092   3.372  10.394
  601    HD1  TYR  74           HD1      TYR  74   3.606   1.740   9.606
  602    HD2  TYR  74           HD2      TYR  74   1.864   1.376  13.520
  603    HE1  TYR  74           HE1      TYR  74   4.776  -0.444   9.923
  604    HE2  TYR  74           HE2      TYR  74   3.014  -0.796  13.848
  605    HH   TYR  74           HH       TYR  74   3.908  -2.689  11.980
  606    H    ILE  75           HN       ILE  75   3.432   5.265  10.529
  607    HA   ILE  75           HA       ILE  75   6.197   4.963  11.469
  608    HB   ILE  75           HB       ILE  75   5.144   5.501   8.680
  609   1HG1  ILE  75          HG11      ILE  75   6.548   3.077   9.865
  610   2HG1  ILE  75          HG12      ILE  75   4.863   3.146   9.369
  611   1HG2  ILE  75          HG21      ILE  75   7.969   5.290   9.753
  612   2HG2  ILE  75          HG22      ILE  75   7.217   6.691   8.992
  613   3HG2  ILE  75          HG23      ILE  75   7.564   5.251   8.037
  614   1HD1  ILE  75          HD11      ILE  75   7.162   3.526   7.450
  615   2HD1  ILE  75          HD12      ILE  75   5.464   3.250   7.062
  616   3HD1  ILE  75          HD13      ILE  75   6.423   1.960   7.786
  617    HA   PRO  76           HA       PRO  76   5.333   9.318  12.544
  618   1HB   PRO  76          HB1       PRO  76   7.437   9.513  14.271
  619   2HB   PRO  76          HB2       PRO  76   5.860   8.857  14.724
  620   1HG   PRO  76          HG1       PRO  76   8.372   7.414  13.979
  621   2HG   PRO  76          HG2       PRO  76   7.206   7.045  15.264
  622   1HD   PRO  76          HD1       PRO  76   7.241   5.714  12.910
  623   2HD   PRO  76          HD2       PRO  76   5.743   6.013  13.813
  624    H    GLY  77           HN       GLY  77   5.897  10.304  10.618
  625   1HA   GLY  77          HA1       GLY  77   7.560  12.037   9.974
  626   2HA   GLY  77          HA2       GLY  77   8.770  10.779  10.133
  627    H    THR  78           HN       THR  78   6.376   9.081   8.797
  628    HA   THR  78           HA       THR  78   7.458   8.804   6.250
  629    HB   THR  78           HB       THR  78   5.689   7.424   7.712
  630    HG1  THR  78           HG1      THR  78   6.779   7.195   5.300
  631   1HG2  THR  78          HG21      THR  78   3.739   8.825   7.133
  632   2HG2  THR  78          HG22      THR  78   3.579   7.160   6.571
  633   3HG2  THR  78          HG23      THR  78   3.996   8.439   5.431
  634    H    LYS  79           HN       LYS  79   6.820   9.392   4.193
  635    HA   LYS  79           HA       LYS  79   5.503  12.000   4.004
  636   1HB   LYS  79          HB1       LYS  79   6.415  11.989   1.686
  637   2HB   LYS  79          HB2       LYS  79   7.638  11.860   2.939
  638   1HG   LYS  79          HG1       LYS  79   7.921   9.501   2.490
  639   2HG   LYS  79          HG2       LYS  79   6.582   9.530   1.332
  640   1HD   LYS  79          HD1       LYS  79   7.839  10.509  -0.297
  641   2HD   LYS  79          HD2       LYS  79   8.705  11.535   0.854
  642   1HE   LYS  79          HE1       LYS  79  10.231   9.921  -0.175
  643   2HE   LYS  79          HE2       LYS  79  10.061   9.606   1.552
  644   1HZ   LYS  79          HZ1       LYS  79   8.783   7.730   1.164
  645   2HZ   LYS  79          HZ2       LYS  79   9.946   7.645  -0.058
  646   3HZ   LYS  79          HZ3       LYS  79   8.390   8.190  -0.421
  647    H    MET  80           HN       MET  80   4.149   9.038   3.989
  648    HA   MET  80           HA       MET  80   2.712   9.153   1.511
  649   1HB   MET  80          HB1       MET  80   3.037   6.961   2.087
  650   2HB   MET  80          HB2       MET  80   2.785   7.258   3.811
  651   1HG   MET  80          HG1       MET  80   0.486   7.296   3.616
  652   2HG   MET  80          HG2       MET  80   0.530   7.670   1.904
  653   1HE   MET  80          HE1       MET  80  -1.519   6.027   1.682
  654   2HE   MET  80          HE2       MET  80  -1.440   5.573   3.385
  655   3HE   MET  80          HE3       MET  80  -1.485   4.324   2.141
  656    H    ALA  81           HN       ALA  81   1.581  10.944   1.348
  657    HA   ALA  81           HA       ALA  81  -0.287  11.832   3.347
  658   1HB   ALA  81          HB1       ALA  81  -0.560  13.780   1.879
  659   2HB   ALA  81          HB2       ALA  81   0.512  13.018   0.705
  660   3HB   ALA  81          HB3       ALA  81   1.122  13.455   2.301
  661    H    PHE  82           HN       PHE  82  -1.709  10.111   3.274
  662    HA   PHE  82           HA       PHE  82  -3.911  10.279   1.392
  663   1HB   PHE  82          HB1       PHE  82  -2.719   8.353   0.704
  664   2HB   PHE  82          HB2       PHE  82  -2.562   7.770   2.356
  665    HD1  PHE  82           HD1      PHE  82  -5.188   8.603  -0.200
  666    HD2  PHE  82           HD2      PHE  82  -4.030   6.152   3.140
  667    HE1  PHE  82           HE1      PHE  82  -7.324   7.340  -0.385
  668    HE2  PHE  82           HE2      PHE  82  -6.169   4.899   2.965
  669    HZ   PHE  82           HZ       PHE  82  -7.825   5.507   1.215
  670    H    GLY  83           HN       GLY  83  -3.001  10.100   4.744
  671   1HA   GLY  83          HA1       GLY  83  -4.395  10.614   6.552
  672   2HA   GLY  83          HA2       GLY  83  -5.786  10.449   5.504
  673    H    GLY  84           HN       GLY  84  -5.400   7.777   4.645
  674   1HA   GLY  84          HA1       GLY  84  -5.097   5.544   5.433
  675   2HA   GLY  84          HA2       GLY  84  -5.320   6.123   7.074
  676    H    LEU  85           HN       LEU  85  -6.677   4.128   5.071
  677    HA   LEU  85           HA       LEU  85  -9.447   4.924   5.058
  678   1HB   LEU  85          HB1       LEU  85  -7.925   2.537   4.074
  679   2HB   LEU  85          HB2       LEU  85  -9.668   2.460   4.222
  680    HG   LEU  85           HG       LEU  85  -8.077   4.307   2.429
  681   1HD1  LEU  85          HD11      LEU  85 -10.009   2.032   1.940
  682   2HD1  LEU  85          HD12      LEU  85  -8.286   2.065   1.564
  683   3HD1  LEU  85          HD13      LEU  85  -9.401   3.106   0.679
  684   1HD2  LEU  85          HD21      LEU  85 -10.089   5.487   3.322
  685   2HD2  LEU  85          HD22      LEU  85 -11.089   4.166   2.719
  686   3HD2  LEU  85          HD23      LEU  85 -10.184   5.171   1.589
  687    H    LYS  86           HN       LYS  86 -10.052   5.138   7.085
  688    HA   LYS  86           HA       LYS  86  -9.699   3.420   9.278
  689   1HB   LYS  86          HB1       LYS  86 -11.886   5.473   8.978
  690   2HB   LYS  86          HB2       LYS  86 -11.106   4.927  10.457
  691   1HG   LYS  86          HG1       LYS  86  -9.440   6.243   8.348
  692   2HG   LYS  86          HG2       LYS  86 -10.466   7.240   9.382
  693   1HD   LYS  86          HD1       LYS  86  -9.380   6.308  11.376
  694   2HD   LYS  86          HD2       LYS  86  -8.377   5.273  10.360
  695   1HE   LYS  86          HE1       LYS  86  -8.342   8.299  10.419
  696   2HE   LYS  86          HE2       LYS  86  -7.119   7.232  11.104
  697   1HZ   LYS  86          HZ1       LYS  86  -6.534   8.180   8.908
  698   2HZ   LYS  86          HZ2       LYS  86  -7.813   7.313   8.223
  699   3HZ   LYS  86          HZ3       LYS  86  -6.526   6.485   8.940
  700    H    LYS  87           HN       LYS  87 -11.760   3.014   6.643
  701    HA   LYS  87           HA       LYS  87 -13.859   1.558   8.076
  702   1HB   LYS  87          HB1       LYS  87 -13.599   2.018   5.120
  703   2HB   LYS  87          HB2       LYS  87 -15.023   1.519   5.993
  704   1HG   LYS  87          HG1       LYS  87 -15.195   3.836   6.948
  705   2HG   LYS  87          HG2       LYS  87 -13.825   4.303   5.894
  706   1HD   LYS  87          HD1       LYS  87 -15.238   2.807   4.200
  707   2HD   LYS  87          HD2       LYS  87 -16.550   3.362   5.183
  708   1HE   LYS  87          HE1       LYS  87 -16.512   5.456   4.225
  709   2HE   LYS  87          HE2       LYS  87 -14.809   5.314   3.736
  710   1HZ   LYS  87          HZ1       LYS  87 -16.999   3.591   2.694
  711   2HZ   LYS  87          HZ2       LYS  87 -15.390   3.574   2.188
  712   3HZ   LYS  87          HZ3       LYS  87 -16.362   4.924   1.860
  713    H    GLU  88           HN       GLU  88 -13.514  -0.556   8.414
  714    HA   GLU  88           HA       GLU  88 -11.623  -2.207   7.217
  715   1HB   GLU  88          HB1       GLU  88 -14.177  -3.122   8.526
  716   2HB   GLU  88          HB2       GLU  88 -12.643  -3.983   8.437
  717   1HG   GLU  88          HG1       GLU  88 -11.894  -1.644   9.658
  718   2HG   GLU  88          HG2       GLU  88 -13.516  -1.904  10.314
  719    H    LYS  89           HN       LYS  89 -15.105  -1.997   6.394
  720    HA   LYS  89           HA       LYS  89 -15.237  -4.113   4.607
  721   1HB   LYS  89          HB1       LYS  89 -16.814  -1.590   4.195
  722   2HB   LYS  89          HB2       LYS  89 -17.314  -3.263   3.968
  723   1HG   LYS  89          HG1       LYS  89 -16.536  -2.305   6.692
  724   2HG   LYS  89          HG2       LYS  89 -18.136  -1.938   6.060
  725   1HD   LYS  89          HD1       LYS  89 -18.531  -4.375   5.754
  726   2HD   LYS  89          HD2       LYS  89 -16.952  -4.691   6.491
  727   1HE   LYS  89          HE1       LYS  89 -17.643  -3.623   8.553
  728   2HE   LYS  89          HE2       LYS  89 -19.174  -3.131   7.830
  729   1HZ   LYS  89          HZ1       LYS  89 -19.577  -5.028   9.166
  730   2HZ   LYS  89          HZ2       LYS  89 -18.294  -5.886   8.478
  731   3HZ   LYS  89          HZ3       LYS  89 -19.666  -5.542   7.553
  732    H    ASP  90           HN       ASP  90 -14.435  -0.789   4.017
  733    HA   ASP  90           HA       ASP  90 -13.982  -0.710   1.313
  734   1HB   ASP  90          HB1       ASP  90 -13.207   0.816   3.736
  735   2HB   ASP  90          HB2       ASP  90 -12.291   1.148   2.277
  736    H    ARG  91           HN       ARG  91 -11.548  -1.436   3.913
  737    HA   ARG  91           HA       ARG  91  -9.466  -1.981   2.030
  738   1HB   ARG  91          HB1       ARG  91  -9.434  -3.068   4.842
  739   2HB   ARG  91          HB2       ARG  91  -8.068  -2.678   3.804
  740   1HG   ARG  91          HG1       ARG  91  -8.483  -0.329   4.026
  741   2HG   ARG  91          HG2       ARG  91  -9.993  -0.621   4.871
  742   1HD   ARG  91          HD1       ARG  91  -7.177  -0.906   5.862
  743   2HD   ARG  91          HD2       ARG  91  -8.502   0.018   6.551
  744    HE   ARG  91           HE       ARG  91  -8.087  -2.431   6.188
  745   1HH1  ARG  91          HH21      ARG  91  -9.283  -0.028   8.394
  746   2HH1  ARG  91          HH22      ARG  91  -9.943  -0.983   9.676
  747   1HH2  ARG  91          HH11      ARG  91  -9.106  -4.005   8.282
  748   2HH2  ARG  91          HH12      ARG  91  -9.861  -3.203   9.614
  749    H    ASN  92           HN       ASN  92 -11.836  -4.066   3.628
  750    HA   ASN  92           HA       ASN  92 -10.854  -6.560   3.190
  751   1HB   ASN  92          HB1       ASN  92 -13.676  -5.527   3.018
  752   2HB   ASN  92          HB2       ASN  92 -13.306  -7.236   2.858
  753   1HD2  ASN  92          HD21      ASN  92 -14.953  -6.154   4.840
  754   2HD2  ASN  92          HD22      ASN  92 -14.154  -6.628   6.299
  755    H    ASP  93           HN       ASP  93 -12.895  -4.879   0.749
  756    HA   ASP  93           HA       ASP  93 -12.402  -6.709  -1.337
  757   1HB   ASP  93          HB1       ASP  93 -14.045  -4.501  -0.975
  758   2HB   ASP  93          HB2       ASP  93 -12.963  -4.004  -2.267
  759    H    LEU  94           HN       LEU  94 -10.678  -3.643  -0.506
  760    HA   LEU  94           HA       LEU  94  -9.038  -3.435  -2.701
  761   1HB   LEU  94          HB1       LEU  94  -9.201  -2.348   0.011
  762   2HB   LEU  94          HB2       LEU  94  -7.595  -2.429  -0.612
  763    HG   LEU  94           HG       LEU  94  -9.800  -1.158  -2.206
  764   1HD1  LEU  94          HD11      LEU  94  -9.571  -0.166   0.100
  765   2HD1  LEU  94          HD12      LEU  94  -9.304   0.958  -1.237
  766   3HD1  LEU  94          HD13      LEU  94  -7.928   0.305  -0.349
  767   1HD2  LEU  94          HD21      LEU  94  -8.118   0.041  -3.364
  768   2HD2  LEU  94          HD22      LEU  94  -7.550  -1.626  -3.307
  769   3HD2  LEU  94          HD23      LEU  94  -6.874  -0.427  -2.206
  770    H    ILE  95           HN       ILE  95  -8.543  -5.372   0.231
  771    HA   ILE  95           HA       ILE  95  -5.904  -6.213  -0.251
  772    HB   ILE  95           HB       ILE  95  -8.129  -7.521   1.325
  773   1HG1  ILE  95          HG11      ILE  95  -5.737  -5.958   2.337
  774   2HG1  ILE  95          HG12      ILE  95  -7.291  -5.202   1.997
  775   1HG2  ILE  95          HG21      ILE  95  -6.339  -9.155   0.700
  776   2HG2  ILE  95          HG22      ILE  95  -6.464  -8.875   2.435
  777   3HG2  ILE  95          HG23      ILE  95  -5.167  -8.115   1.513
  778   1HD1  ILE  95          HD11      ILE  95  -8.366  -6.612   3.677
  779   2HD1  ILE  95          HD12      ILE  95  -7.024  -5.711   4.384
  780   3HD1  ILE  95          HD13      ILE  95  -6.830  -7.420   3.997
  781    H    THR  96           HN       THR  96  -8.996  -7.889  -0.983
  782    HA   THR  96           HA       THR  96  -7.957 -10.113  -2.292
  783    HB   THR  96           HB       THR  96 -10.576  -8.783  -3.005
  784    HG1  THR  96           HG1      THR  96  -9.811  -9.800  -0.673
  785   1HG2  THR  96          HG21      THR  96  -9.778 -11.699  -3.041
  786   2HG2  THR  96          HG22      THR  96  -9.800 -10.664  -4.469
  787   3HG2  THR  96          HG23      THR  96 -11.299 -11.005  -3.604
  788    H    TYR  97           HN       TYR  97  -8.746  -6.913  -3.700
  789    HA   TYR  97           HA       TYR  97  -8.160  -7.575  -6.367
  790   1HB   TYR  97          HB1       TYR  97  -9.335  -5.565  -5.989
  791   2HB   TYR  97          HB2       TYR  97  -8.098  -4.954  -4.897
  792    HD1  TYR  97           HD1      TYR  97  -6.703  -3.302  -5.685
  793    HD2  TYR  97           HD2      TYR  97  -8.367  -6.127  -8.467
  794    HE1  TYR  97           HE1      TYR  97  -5.590  -2.105  -7.558
  795    HE2  TYR  97           HE2      TYR  97  -7.359  -4.868 -10.362
  796    HH   TYR  97           HH       TYR  97  -4.917  -2.821 -10.124
  797    H    LEU  98           HN       LEU  98  -5.983  -5.900  -4.036
  798    HA   LEU  98           HA       LEU  98  -3.684  -5.934  -5.632
  799   1HB   LEU  98          HB1       LEU  98  -4.420  -5.127  -3.019
  800   2HB   LEU  98          HB2       LEU  98  -3.015  -6.173  -2.848
  801    HG   LEU  98           HG       LEU  98  -2.333  -3.809  -3.124
  802   1HD1  LEU  98          HD11      LEU  98  -1.676  -5.489  -5.554
  803   2HD1  LEU  98          HD12      LEU  98  -0.869  -5.611  -3.991
  804   3HD1  LEU  98          HD13      LEU  98  -0.736  -4.129  -4.939
  805   1HD2  LEU  98          HD21      LEU  98  -3.724  -4.066  -5.796
  806   2HD2  LEU  98          HD22      LEU  98  -2.670  -2.731  -5.331
  807   3HD2  LEU  98          HD23      LEU  98  -4.186  -2.998  -4.470
  808    H    LYS  99           HN       LYS  99  -4.857  -8.216  -3.242
  809    HA   LYS  99           HA       LYS  99  -2.735 -10.023  -3.200
  810   1HB   LYS  99          HB1       LYS  99  -4.034 -10.648  -1.490
  811   2HB   LYS  99          HB2       LYS  99  -5.457  -9.903  -2.193
  812   1HG   LYS  99          HG1       LYS  99  -5.932 -11.887  -3.477
  813   2HG   LYS  99          HG2       LYS  99  -4.423 -12.628  -2.980
  814   1HD   LYS  99          HD1       LYS  99  -6.182 -11.916  -0.738
  815   2HD   LYS  99          HD2       LYS  99  -6.883 -13.092  -1.854
  816   1HE   LYS  99          HE1       LYS  99  -5.613 -14.136  -0.001
  817   2HE   LYS  99          HE2       LYS  99  -5.000 -14.555  -1.593
  818   1HZ   LYS  99          HZ1       LYS  99  -3.028 -13.852  -0.962
  819   2HZ   LYS  99          HZ2       LYS  99  -3.632 -13.438   0.568
  820   3HZ   LYS  99          HZ3       LYS  99  -3.650 -12.295  -0.680
  821    H    LYS 100           HN       LYS 100  -5.508  -9.826  -5.423
  822    HA   LYS 100           HA       LYS 100  -4.904 -12.233  -6.812
  823   1HB   LYS 100          HB1       LYS 100  -7.090 -10.600  -6.629
  824   2HB   LYS 100          HB2       LYS 100  -6.576 -10.378  -8.284
  825   1HG   LYS 100          HG1       LYS 100  -8.349 -12.128  -7.939
  826   2HG   LYS 100          HG2       LYS 100  -6.912 -12.705  -8.787
  827   1HD   LYS 100          HD1       LYS 100  -6.945 -12.939  -5.851
  828   2HD   LYS 100          HD2       LYS 100  -8.070 -13.952  -6.700
  829   1HE   LYS 100          HE1       LYS 100  -6.405 -15.438  -6.424
  830   2HE   LYS 100          HE2       LYS 100  -5.776 -14.693  -7.903
  831   1HZ   LYS 100          HZ1       LYS 100  -4.044 -13.839  -6.786
  832   2HZ   LYS 100          HZ2       LYS 100  -4.493 -14.809  -5.476
  833   3HZ   LYS 100          HZ3       LYS 100  -5.044 -13.212  -5.567
  834    H    ALA 101           HN       ALA 101  -3.941  -9.048  -7.287
  835    HA   ALA 101           HA       ALA 101  -2.825  -9.203  -9.900
  836   1HB   ALA 101          HB1       ALA 101  -2.172  -6.895  -9.458
  837   2HB   ALA 101          HB2       ALA 101  -2.599  -7.085  -7.758
  838   3HB   ALA 101          HB3       ALA 101  -3.852  -7.172  -8.997
  839    H    THR 102           HN       THR 102  -1.507  -9.389  -6.617
  840    HA   THR 102           HA       THR 102   1.258  -9.527  -7.428
  841    HB   THR 102           HB       THR 102   0.238 -10.138  -4.666
  842    HG1  THR 102           HG1      THR 102  -0.625  -8.106  -5.385
  843   1HG2  THR 102          HG21      THR 102   2.363  -9.222  -3.952
  844   2HG2  THR 102          HG22      THR 102   2.769  -8.781  -5.611
  845   3HG2  THR 102          HG23      THR 102   2.653 -10.480  -5.154
  846    H    GLU 103           HN       GLU 103  -1.218 -11.825  -6.267
  847    HA   GLU 103           HA       GLU 103   0.578 -14.018  -7.081
  848   1HB   GLU 103          HB1       GLU 103  -0.873 -15.319  -5.248
  849   2HB   GLU 103          HB2       GLU 103   0.630 -14.501  -4.855
  850   1HG   GLU 103          HG1       GLU 103  -0.404 -13.190  -3.411
  851   2HG   GLU 103          HG2       GLU 103  -1.541 -12.654  -4.643
  852    HHA  HEC 104           HA       HEC 104   5.082   3.428   1.532
  853    HHB  HEC 104           HB       HEC 104  -0.464   0.336   0.162
  854    HHC  HEC 104           HC       HEC 104  -3.166   5.999  -1.463
  855    HHD  HEC 104           HD       HEC 104   2.674   8.751  -1.276
  856   1HMA  HEC 104          HMA1      HEC 104   1.336  -1.010   2.016
  857   2HMA  HEC 104          HMA2      HEC 104   2.884  -1.323   1.230
  858   3HMA  HEC 104          HMA3      HEC 104   1.412  -1.205   0.265
  859   1HAA  HEC 104          HAA1      HEC 104   4.362  -0.265   2.180
  860   2HAA  HEC 104          HAA2      HEC 104   4.978   1.329   2.578
  861   1HBA  HEC 104          HBA1      HEC 104   5.890   1.519   0.276
  862   2HBA  HEC 104          HBA2      HEC 104   5.333  -0.114  -0.055
  863   1HMB  HEC 104          HMB1      HEC 104  -2.316  -0.042  -0.508
  864   2HMB  HEC 104          HMB2      HEC 104  -3.226   0.527  -1.907
  865   3HMB  HEC 104          HMB3      HEC 104  -3.931   0.636  -0.295
  866    HAB  HEC 104           HAB      HEC 104  -4.521   4.621  -1.547
  867   1HBB  HEC 104          HBB1      HEC 104  -4.862   3.381   0.730
  868   2HBB  HEC 104          HBB2      HEC 104  -5.797   2.278  -0.280
  869   3HBB  HEC 104          HBB3      HEC 104  -6.213   3.992  -0.225
  870   1HMC  HEC 104          HMC1      HEC 104  -3.309   8.563  -1.620
  871   2HMC  HEC 104          HMC2      HEC 104  -2.909   7.854  -3.184
  872   3HMC  HEC 104          HMC3      HEC 104  -2.367   9.485  -2.790
  873    HAC  HEC 104           HAC      HEC 104   1.469   9.763  -2.579
  874   1HBC  HEC 104          HBC1      HEC 104   0.588  11.117  -0.921
  875   2HBC  HEC 104          HBC2      HEC 104  -1.054  10.990  -1.550
  876   3HBC  HEC 104          HBC3      HEC 104   0.166  11.897  -2.445
  877   1HMD  HEC 104          HMD1      HEC 104   4.771   9.224  -0.314
  878   2HMD  HEC 104          HMD2      HEC 104   5.289   8.259  -1.697
  879   3HMD  HEC 104          HMD3      HEC 104   6.275   8.307  -0.235
  880   1HAD  HEC 104          HAD1      HEC 104   7.128   6.461   0.558
  881   2HAD  HEC 104          HAD2      HEC 104   6.714   4.901   1.260
  882   1HBD  HEC 104          HBD1      HEC 104   6.116   5.824   3.299
  883   2HBD  HEC 104          HBD2      HEC 104   5.755   7.390   2.605
  884    H2   4NL 105           H2       4NL 105  -0.455 -12.834  -1.444
  885    H6   4NL 105           H6       4NL 105   1.522 -13.479   3.628
  886    H3   4NL 105           H3       4NL 105  -1.786 -10.411   1.907
  887    H5   4NL 105           H5       4NL 105  -2.617 -10.216  -0.176
  888    H4   4NL 105           H4       4NL 105  -0.068 -11.500   3.375
  889    H1   4NL 105           H1       4NL 105   1.262 -13.922   0.025
  890    H7   4NL 105           H7       4NL 105   2.577 -13.708   2.212
  Start of MODEL    8
    1   1H    THR  -5          HT1       THR  -5 -12.261  -6.727  13.504
    2   2H    THR  -5          HT2       THR  -5 -11.746  -6.039  12.045
    3   3H    THR  -5          HT3       THR  -5 -10.703  -6.072  13.376
    4    HA   THR  -5           HA       THR  -5 -10.185  -7.763  11.669
    5    HB   THR  -5           HB       THR  -5 -11.054  -9.262  14.115
    6    HG1  THR  -5           HG1      THR  -5  -8.910  -8.194  14.910
    7   1HG2  THR  -5          HG21      THR  -5  -8.466  -9.012  12.568
    8   2HG2  THR  -5          HG22      THR  -5  -9.608 -10.354  12.490
    9   3HG2  THR  -5          HG23      THR  -5  -8.705 -10.049  13.975
   10    H    GLU  -4           HN       GLU  -4 -12.563  -7.240  10.603
   11    HA   GLU  -4           HA       GLU  -4 -13.999  -9.808  10.588
   12   1HB   GLU  -4          HB1       GLU  -4 -15.244  -7.833  11.751
   13   2HB   GLU  -4          HB2       GLU  -4 -15.400  -7.161  10.133
   14   1HG   GLU  -4          HG1       GLU  -4 -16.306  -9.959  10.743
   15   2HG   GLU  -4          HG2       GLU  -4 -17.339  -8.576  11.078
   16    H    PHE  -3           HN       PHE  -3 -12.109  -9.837   8.962
   17    HA   PHE  -3           HA       PHE  -3 -12.401  -8.391   6.528
   18   1HB   PHE  -3          HB1       PHE  -3 -10.183  -8.960   7.067
   19   2HB   PHE  -3          HB2       PHE  -3 -10.585 -10.654   7.318
   20    HD1  PHE  -3           HD1      PHE  -3 -10.783  -8.085   4.561
   21    HD2  PHE  -3           HD2      PHE  -3  -9.887 -12.140   5.679
   22    HE1  PHE  -3           HE1      PHE  -3 -10.238  -8.616   2.193
   23    HE2  PHE  -3           HE2      PHE  -3  -9.389 -12.685   3.304
   24    HZ   PHE  -3           HZ       PHE  -3  -9.594 -10.930   1.554
   25    H    LYS  -2           HN       LYS  -2 -13.762  -8.666   5.049
   26    HA   LYS  -2           HA       LYS  -2 -14.944 -11.281   4.427
   27   1HB   LYS  -2          HB1       LYS  -2 -16.078  -8.604   4.793
   28   2HB   LYS  -2          HB2       LYS  -2 -16.568  -9.343   3.271
   29   1HG   LYS  -2          HG1       LYS  -2 -17.445 -11.272   4.403
   30   2HG   LYS  -2          HG2       LYS  -2 -16.786 -10.730   5.944
   31   1HD   LYS  -2          HD1       LYS  -2 -18.307  -8.772   5.872
   32   2HD   LYS  -2          HD2       LYS  -2 -18.987  -9.379   4.364
   33   1HE   LYS  -2          HE1       LYS  -2 -20.319  -9.862   6.469
   34   2HE   LYS  -2          HE2       LYS  -2 -19.969 -11.245   5.439
   35   1HZ   LYS  -2          HZ1       LYS  -2 -19.660 -11.489   7.949
   36   2HZ   LYS  -2          HZ2       LYS  -2 -18.248 -10.585   7.750
   37   3HZ   LYS  -2          HZ3       LYS  -2 -18.419 -12.057   6.943
   38    H    ALA  -1           HN       ALA  -1 -14.251 -12.115   2.628
   39    HA   ALA  -1           HA       ALA  -1 -12.351 -11.091   0.925
   40   1HB   ALA  -1          HB1       ALA  -1 -14.382 -13.257   0.379
   41   2HB   ALA  -1          HB2       ALA  -1 -12.830 -13.464   1.191
   42   3HB   ALA  -1          HB3       ALA  -1 -12.879 -13.008  -0.512
   43    H    GLY   1           HN       GLY   1 -12.335 -10.172  -1.095
   44   1HA   GLY   1          HA1       GLY   1 -14.810  -8.883  -2.044
   45   2HA   GLY   1          HA2       GLY   1 -13.195  -8.213  -2.220
   46    H    SER   2           HN       SER   2 -13.151  -8.028  -4.376
   47    HA   SER   2           HA       SER   2 -12.595 -10.352  -5.975
   48   1HB   SER   2          HB1       SER   2 -14.727  -8.659  -7.181
   49   2HB   SER   2          HB2       SER   2 -14.400 -10.384  -7.390
   50    HG   SER   2           HG       SER   2 -15.139 -10.600  -5.147
   51    H    ALA   3           HN       ALA   3 -11.273  -9.836  -7.689
   52    HA   ALA   3           HA       ALA   3  -9.783  -7.566  -7.760
   53   1HB   ALA   3          HB1       ALA   3  -9.217  -9.648  -8.895
   54   2HB   ALA   3          HB2       ALA   3  -9.050  -8.261  -9.972
   55   3HB   ALA   3          HB3       ALA   3 -10.448  -9.324 -10.116
   56    H    LYS   4           HN       LYS   4 -12.830  -7.972  -9.646
   57    HA   LYS   4           HA       LYS   4 -12.540  -5.411 -10.874
   58   1HB   LYS   4          HB1       LYS   4 -13.620  -7.436 -11.921
   59   2HB   LYS   4          HB2       LYS   4 -15.045  -7.047 -10.957
   60   1HG   LYS   4          HG1       LYS   4 -14.089  -4.670 -12.258
   61   2HG   LYS   4          HG2       LYS   4 -14.291  -5.949 -13.448
   62   1HD   LYS   4          HD1       LYS   4 -16.570  -6.014 -13.186
   63   2HD   LYS   4          HD2       LYS   4 -16.497  -5.509 -11.494
   64   1HE   LYS   4          HE1       LYS   4 -15.802  -3.650 -13.771
   65   2HE   LYS   4          HE2       LYS   4 -17.446  -3.806 -13.150
   66   1HZ   LYS   4          HZ1       LYS   4 -16.897  -2.825 -11.186
   67   2HZ   LYS   4          HZ2       LYS   4 -15.832  -2.010 -12.214
   68   3HZ   LYS   4          HZ3       LYS   4 -15.268  -3.289 -11.261
   69    H    LYS   5           HN       LYS   5 -13.270  -5.913  -7.784
   70    HA   LYS   5           HA       LYS   5 -15.142  -3.635  -7.643
   71   1HB   LYS   5          HB1       LYS   5 -14.653  -5.784  -5.564
   72   2HB   LYS   5          HB2       LYS   5 -15.697  -4.386  -5.343
   73   1HG   LYS   5          HG1       LYS   5 -16.849  -5.320  -7.539
   74   2HG   LYS   5          HG2       LYS   5 -16.131  -6.836  -6.987
   75   1HD   LYS   5          HD1       LYS   5 -17.517  -5.291  -4.891
   76   2HD   LYS   5          HD2       LYS   5 -18.565  -5.887  -6.178
   77   1HE   LYS   5          HE1       LYS   5 -18.477  -7.513  -4.375
   78   2HE   LYS   5          HE2       LYS   5 -17.680  -8.171  -5.803
   79   1HZ   LYS   5          HZ1       LYS   5 -15.992  -6.749  -3.900
   80   2HZ   LYS   5          HZ2       LYS   5 -15.672  -8.136  -4.824
   81   3HZ   LYS   5          HZ3       LYS   5 -16.596  -8.258  -3.413
   82    H    GLY   6           HN       GLY   6 -12.445  -5.100  -5.782
   83   1HA   GLY   6          HA1       GLY   6 -11.755  -2.827  -4.305
   84   2HA   GLY   6          HA2       GLY   6 -10.653  -4.132  -4.714
   85    H    ALA   7           HN       ALA   7 -11.003  -3.610  -7.651
   86    HA   ALA   7           HA       ALA   7  -8.867  -1.903  -8.126
   87   1HB   ALA   7          HB1       ALA   7  -9.603  -3.602  -9.720
   88   2HB   ALA   7          HB2       ALA   7  -9.494  -2.016 -10.484
   89   3HB   ALA   7          HB3       ALA   7 -11.068  -2.674 -10.042
   90    H    THR   8           HN       THR   8 -12.397  -1.090  -8.457
   91    HA   THR   8           HA       THR   8 -12.080   1.522  -9.323
   92    HB   THR   8           HB       THR   8 -14.239   1.806  -7.670
   93    HG1  THR   8           HG1      THR   8 -14.059  -0.421  -7.079
   94   1HG2  THR   8          HG21      THR   8 -14.078   2.246 -10.124
   95   2HG2  THR   8          HG22      THR   8 -15.581   1.464  -9.632
   96   3HG2  THR   8          HG23      THR   8 -14.305   0.517 -10.399
   97    H    LEU   9           HN       LEU   9 -11.747   0.363  -6.005
   98    HA   LEU   9           HA       LEU   9 -11.657   2.869  -4.711
   99   1HB   LEU   9          HB1       LEU   9 -11.102   0.050  -4.003
  100   2HB   LEU   9          HB2       LEU   9 -10.200   1.243  -3.072
  101    HG   LEU   9           HG       LEU   9 -12.205   0.851  -1.858
  102   1HD1  LEU   9          HD11      LEU   9 -13.383   3.038  -2.020
  103   2HD1  LEU   9          HD12      LEU   9 -12.480   3.371  -3.497
  104   3HD1  LEU   9          HD13      LEU   9 -11.627   3.199  -1.964
  105   1HD2  LEU   9          HD21      LEU   9 -13.633  -0.218  -3.460
  106   2HD2  LEU   9          HD22      LEU   9 -13.642   1.214  -4.488
  107   3HD2  LEU   9          HD23      LEU   9 -14.461   1.247  -2.926
  108    H    PHE  10           HN       PHE  10  -8.894   0.662  -4.798
  109    HA   PHE  10           HA       PHE  10  -6.792   2.303  -4.462
  110   1HB   PHE  10          HB1       PHE  10  -6.660  -0.137  -4.712
  111   2HB   PHE  10          HB2       PHE  10  -6.919   0.020  -6.442
  112    HD1  PHE  10           HD1      PHE  10  -5.141   1.474  -7.749
  113    HD2  PHE  10           HD2      PHE  10  -4.511  -0.295  -3.880
  114    HE1  PHE  10           HE1      PHE  10  -2.675   1.576  -8.099
  115    HE2  PHE  10           HE2      PHE  10  -2.054  -0.074  -4.178
  116    HZ   PHE  10           HZ       PHE  10  -1.130   0.837  -6.294
  117    H    LYS  11           HN       LYS  11  -8.520   1.930  -7.528
  118    HA   LYS  11           HA       LYS  11  -6.734   3.314  -9.187
  119   1HB   LYS  11          HB1       LYS  11  -8.972   1.823  -9.586
  120   2HB   LYS  11          HB2       LYS  11  -9.558   3.438  -9.989
  121   1HG   LYS  11          HG1       LYS  11  -8.275   3.596 -11.845
  122   2HG   LYS  11          HG2       LYS  11  -6.916   2.757 -11.104
  123   1HD   LYS  11          HD1       LYS  11  -9.349   1.165 -11.763
  124   2HD   LYS  11          HD2       LYS  11  -8.317   1.687 -13.096
  125   1HE   LYS  11          HE1       LYS  11  -7.733  -0.575 -12.257
  126   2HE   LYS  11          HE2       LYS  11  -6.403   0.570 -12.117
  127   1HZ   LYS  11          HZ1       LYS  11  -6.776   0.767  -9.791
  128   2HZ   LYS  11          HZ2       LYS  11  -6.739  -0.885 -10.146
  129   3HZ   LYS  11          HZ3       LYS  11  -8.220  -0.118  -9.873
  130    H    THR  12           HN       THR  12  -8.944   4.644  -6.919
  131    HA   THR  12           HA       THR  12  -8.288   7.356  -7.761
  132    HB   THR  12           HB       THR  12 -10.465   6.770  -8.700
  133    HG1  THR  12           HG1      THR  12  -9.740   8.926  -7.475
  134   1HG2  THR  12          HG21      THR  12 -11.540   6.813  -5.883
  135   2HG2  THR  12          HG22      THR  12 -11.402   5.373  -6.894
  136   3HG2  THR  12          HG23      THR  12 -12.474   6.690  -7.374
  137    H    ARG  13           HN       ARG  13  -7.478   5.466  -5.620
  138    HA   ARG  13           HA       ARG  13  -7.661   7.256  -3.294
  139   1HB   ARG  13          HB1       ARG  13  -7.940   4.250  -3.288
  140   2HB   ARG  13          HB2       ARG  13  -7.670   5.202  -1.844
  141   1HG   ARG  13          HG1       ARG  13 -10.096   5.202  -3.620
  142   2HG   ARG  13          HG2       ARG  13  -9.975   4.628  -1.964
  143   1HD   ARG  13          HD1       ARG  13 -10.567   6.643  -1.213
  144   2HD   ARG  13          HD2       ARG  13  -9.190   7.378  -2.043
  145    HE   ARG  13           HE       ARG  13 -10.254   7.675  -3.796
  146   1HH1  ARG  13          HH11      ARG  13 -12.407   6.451  -1.327
  147   2HH1  ARG  13          HH12      ARG  13 -13.886   7.164  -1.861
  148   1HH2  ARG  13          HH21      ARG  13 -12.538   8.750  -4.576
  149   2HH2  ARG  13          HH22      ARG  13 -13.953   8.441  -3.632
  150    H    CYS  14           HN       CYS  14  -5.796   5.051  -5.198
  151    HA   CYS  14           HA       CYS  14  -3.374   5.643  -3.631
  152   1HB   CYS  14          HB1       CYS  14  -3.771   3.002  -4.981
  153   2HB   CYS  14          HB2       CYS  14  -2.652   3.423  -3.704
  154    H    LEU  15           HN       LEU  15  -4.721   4.690  -6.765
  155    HA   LEU  15           HA       LEU  15  -2.556   4.583  -8.401
  156   1HB   LEU  15          HB1       LEU  15  -5.123   4.358  -8.848
  157   2HB   LEU  15          HB2       LEU  15  -5.001   6.046  -9.325
  158    HG   LEU  15           HG       LEU  15  -3.168   5.378 -10.936
  159   1HD1  LEU  15          HD11      LEU  15  -2.482   3.265 -10.004
  160   2HD1  LEU  15          HD12      LEU  15  -3.127   2.992 -11.623
  161   3HD1  LEU  15          HD13      LEU  15  -4.105   2.605 -10.206
  162   1HD2  LEU  15          HD21      LEU  15  -4.820   4.121 -12.495
  163   2HD2  LEU  15          HD22      LEU  15  -5.194   5.773 -12.004
  164   3HD2  LEU  15          HD23      LEU  15  -5.992   4.415 -11.211
  165    H    GLN  16           HN       GLN  16  -4.065   7.571  -7.250
  166    HA   GLN  16           HA       GLN  16  -3.025   9.544  -8.744
  167   1HB   GLN  16          HB1       GLN  16  -2.928  10.861  -6.513
  168   2HB   GLN  16          HB2       GLN  16  -4.465  10.237  -7.090
  169   1HG   GLN  16          HG1       GLN  16  -3.685   8.159  -5.552
  170   2HG   GLN  16          HG2       GLN  16  -2.894   9.487  -4.699
  171   1HE2  GLN  16          HE21      GLN  16  -4.213  11.055  -3.661
  172   2HE2  GLN  16          HE22      GLN  16  -5.910  10.824  -3.457
  173    H    CYS  17           HN       CYS  17  -1.112   7.786  -6.310
  174    HA   CYS  17           HA       CYS  17   1.288   9.234  -7.206
  175   1HB   CYS  17          HB1       CYS  17   1.320   7.974  -4.529
  176   2HB   CYS  17          HB2       CYS  17   2.036   9.469  -5.106
  177    H    HIS  18           HN       HIS  18   0.010   6.060  -6.340
  178    HA   HIS  18           HA       HIS  18   2.590   4.739  -6.639
  179   1HB   HIS  18          HB1       HIS  18  -0.097   3.946  -5.584
  180   2HB   HIS  18          HB2       HIS  18   1.102   2.726  -5.959
  181    HD1  HIS  18           HD1      HIS  18   3.557   3.239  -4.572
  182    HD2  HIS  18           HD2      HIS  18  -0.067   4.760  -3.130
  183    HE1  HIS  18           HE1      HIS  18   3.906   3.660  -2.095
  184    H    THR  19           HN       THR  19   2.251   2.428  -7.509
  185    HA   THR  19           HA       THR  19   0.786   2.300 -10.034
  186    HB   THR  19           HB       THR  19   3.105   0.979 -10.626
  187    HG1  THR  19           HG1      THR  19   4.318   3.261  -9.956
  188   1HG2  THR  19          HG21      THR  19   2.431   3.870 -11.172
  189   2HG2  THR  19          HG22      THR  19   2.000   2.479 -12.167
  190   3HG2  THR  19          HG23      THR  19   3.689   2.955 -12.003
  191    H    VAL  20           HN       VAL  20  -0.431   0.474 -10.088
  192    HA   VAL  20           HA       VAL  20  -0.232  -1.519  -8.040
  193    HB   VAL  20           HB       VAL  20  -2.253  -0.449  -9.401
  194   1HG1  VAL  20          HG11      VAL  20  -1.822  -1.613 -11.480
  195   2HG1  VAL  20          HG12      VAL  20  -3.373  -2.093 -10.787
  196   3HG1  VAL  20          HG13      VAL  20  -1.981  -3.168 -10.658
  197   1HG2  VAL  20          HG21      VAL  20  -2.283  -3.106  -7.991
  198   2HG2  VAL  20          HG22      VAL  20  -3.726  -2.202  -8.446
  199   3HG2  VAL  20          HG23      VAL  20  -2.581  -1.511  -7.299
  200    H    GLU  21           HN       GLU  21   0.793  -1.402 -11.324
  201    HA   GLU  21           HA       GLU  21   1.616  -4.231 -11.304
  202   1HB   GLU  21          HB1       GLU  21   1.704  -3.663 -13.921
  203   2HB   GLU  21          HB2       GLU  21   0.236  -4.237 -13.154
  204   1HG   GLU  21          HG1       GLU  21   0.003  -2.284 -14.766
  205   2HG   GLU  21          HG2       GLU  21  -0.757  -2.099 -13.188
  206    H    LYS  22           HN       LYS  22   3.621  -4.307 -13.178
  207    HA   LYS  22           HA       LYS  22   5.485  -2.297 -12.179
  208   1HB   LYS  22          HB1       LYS  22   5.700  -5.091 -12.580
  209   2HB   LYS  22          HB2       LYS  22   6.900  -4.291 -13.608
  210   1HG   LYS  22          HG1       LYS  22   8.049  -3.433 -11.851
  211   2HG   LYS  22          HG2       LYS  22   6.588  -3.143 -10.907
  212   1HD   LYS  22          HD1       LYS  22   6.471  -5.501 -10.332
  213   2HD   LYS  22          HD2       LYS  22   7.891  -5.830 -11.326
  214   1HE   LYS  22          HE1       LYS  22   8.657  -5.736  -9.076
  215   2HE   LYS  22          HE2       LYS  22   9.183  -4.250  -9.846
  216   1HZ   LYS  22          HZ1       LYS  22   8.424  -3.640  -7.721
  217   2HZ   LYS  22          HZ2       LYS  22   7.038  -4.598  -7.826
  218   3HZ   LYS  22          HZ3       LYS  22   7.159  -3.195  -8.755
  219    H    GLY  23           HN       GLY  23   3.644  -1.805 -14.577
  220   1HA   GLY  23          HA1       GLY  23   5.635  -1.368 -16.691
  221   2HA   GLY  23          HA2       GLY  23   3.897  -1.183 -16.854
  222    H    GLY  24           HN       GLY  24   3.860   0.463 -14.316
  223   1HA   GLY  24          HA1       GLY  24   4.384   3.056 -15.504
  224   2HA   GLY  24          HA2       GLY  24   3.490   2.731 -14.028
  225    HA   PRO  25           HA       PRO  25   8.283   3.449 -13.290
  226   1HB   PRO  25          HB1       PRO  25   8.531   6.172 -13.623
  227   2HB   PRO  25          HB2       PRO  25   9.030   4.972 -14.819
  228   1HG   PRO  25          HG1       PRO  25   6.525   6.598 -14.694
  229   2HG   PRO  25          HG2       PRO  25   7.517   6.173 -16.101
  230   1HD   PRO  25          HD1       PRO  25   5.209   4.902 -15.553
  231   2HD   PRO  25          HD2       PRO  25   6.598   4.055 -16.266
  232    H    HIS  26           HN       HIS  26   9.028   4.446 -11.329
  233    HA   HIS  26           HA       HIS  26   7.142   4.679  -9.279
  234   1HB   HIS  26          HB1       HIS  26  10.012   5.622  -9.460
  235   2HB   HIS  26          HB2       HIS  26   9.088   5.575  -7.969
  236    HD2  HIS  26           HD2      HIS  26  11.281   3.453 -10.177
  237    HE1  HIS  26           HE1      HIS  26   9.790   0.820  -7.198
  238    HE2  HIS  26           HE2      HIS  26  11.494   1.103  -9.058
  239    H    LYS  27           HN       LYS  27   5.699   6.318  -9.021
  240    HA   LYS  27           HA       LYS  27   6.318   8.995 -10.015
  241   1HB   LYS  27          HB1       LYS  27   4.246   7.621 -10.692
  242   2HB   LYS  27          HB2       LYS  27   3.602   8.065  -9.116
  243   1HG   LYS  27          HG1       LYS  27   4.163  10.501  -9.831
  244   2HG   LYS  27          HG2       LYS  27   4.217   9.830 -11.465
  245   1HD   LYS  27          HD1       LYS  27   1.897  10.261  -9.667
  246   2HD   LYS  27          HD2       LYS  27   1.984  10.302 -11.432
  247   1HE   LYS  27          HE1       LYS  27   1.908   7.921 -11.581
  248   2HE   LYS  27          HE2       LYS  27   2.170   7.739  -9.846
  249   1HZ   LYS  27          HZ1       LYS  27  -0.113   7.365 -10.249
  250   2HZ   LYS  27          HZ2       LYS  27  -0.257   8.749 -11.208
  251   3HZ   LYS  27          HZ3       LYS  27  -0.007   8.905  -9.544
  252    H    VAL  28           HN       VAL  28   4.050   9.802  -7.953
  253    HA   VAL  28           HA       VAL  28   5.708  11.042  -6.060
  254    HB   VAL  28           HB       VAL  28   2.795  10.425  -5.604
  255   1HG1  VAL  28          HG11      VAL  28   4.301  12.936  -4.901
  256   2HG1  VAL  28          HG12      VAL  28   4.256  11.541  -3.824
  257   3HG1  VAL  28          HG13      VAL  28   2.759  12.363  -4.264
  258   1HG2  VAL  28          HG21      VAL  28   2.895  11.343  -7.851
  259   2HG2  VAL  28          HG22      VAL  28   3.935  12.657  -7.302
  260   3HG2  VAL  28          HG23      VAL  28   2.264  12.565  -6.746
  261    H    GLY  29           HN       GLY  29   4.391   7.873  -6.215
  262   1HA   GLY  29          HA1       GLY  29   5.495   7.149  -3.581
  263   2HA   GLY  29          HA2       GLY  29   3.941   6.537  -4.121
  264    HA   PRO  30           HA       PRO  30   7.647   3.853  -5.621
  265   1HB   PRO  30          HB1       PRO  30   7.546   1.862  -3.788
  266   2HB   PRO  30          HB2       PRO  30   8.543   3.307  -3.585
  267   1HG   PRO  30          HG1       PRO  30   5.843   2.695  -2.438
  268   2HG   PRO  30          HG2       PRO  30   7.264   3.393  -1.638
  269   1HD   PRO  30          HD1       PRO  30   5.209   4.913  -2.497
  270   2HD   PRO  30          HD2       PRO  30   6.887   5.493  -2.522
  271    H    ASN  31           HN       ASN  31   7.491   1.635  -6.466
  272    HA   ASN  31           HA       ASN  31   4.857   1.035  -7.424
  273   1HB   ASN  31          HB1       ASN  31   6.974   0.877  -8.766
  274   2HB   ASN  31          HB2       ASN  31   7.450  -0.505  -7.789
  275   1HD2  ASN  31          HD21      ASN  31   5.134   0.610 -10.208
  276   2HD2  ASN  31          HD22      ASN  31   4.720  -0.984 -10.750
  277    H    LEU  32           HN       LEU  32   3.409  -0.283  -6.471
  278    HA   LEU  32           HA       LEU  32   3.977  -1.687  -4.015
  279   1HB   LEU  32          HB1       LEU  32   1.397  -1.103  -5.474
  280   2HB   LEU  32          HB2       LEU  32   1.503  -1.854  -3.894
  281    HG   LEU  32           HG       LEU  32   2.365   0.971  -4.576
  282   1HD1  LEU  32          HD11      LEU  32   0.513   1.574  -3.016
  283   2HD1  LEU  32          HD12      LEU  32   0.036  -0.124  -2.992
  284   3HD1  LEU  32          HD13      LEU  32  -0.038   0.789  -4.498
  285   1HD2  LEU  32          HD21      LEU  32   2.713   1.275  -2.177
  286   2HD2  LEU  32          HD22      LEU  32   3.783   0.019  -2.802
  287   3HD2  LEU  32          HD23      LEU  32   2.338  -0.425  -1.893
  288    H    HIS  33           HN       HIS  33   3.814  -2.602  -7.264
  289    HA   HIS  33           HA       HIS  33   2.624  -5.120  -7.304
  290   1HB   HIS  33          HB1       HIS  33   3.333  -3.585  -9.229
  291   2HB   HIS  33          HB2       HIS  33   4.948  -4.253  -9.020
  292    HD2  HIS  33           HD2      HIS  33   1.624  -6.277  -8.905
  293    HE1  HIS  33           HE1      HIS  33   3.861  -7.655 -12.246
  294    HE2  HIS  33           HE2      HIS  33   1.798  -8.055 -10.816
  295    H    GLY  34           HN       GLY  34   3.255  -6.392  -5.577
  296   1HA   GLY  34          HA1       GLY  34   4.543  -8.389  -5.156
  297   2HA   GLY  34          HA2       GLY  34   5.975  -7.519  -5.663
  298    H    ILE  35           HN       ILE  35   3.768  -5.851  -3.462
  299    HA   ILE  35           HA       ILE  35   5.849  -5.721  -1.519
  300    HB   ILE  35           HB       ILE  35   4.259  -4.576  -0.034
  301   1HG1  ILE  35          HG11      ILE  35   2.277  -5.214  -2.181
  302   2HG1  ILE  35          HG12      ILE  35   2.051  -5.096  -0.438
  303   1HG2  ILE  35          HG21      ILE  35   5.749  -3.352  -1.397
  304   2HG2  ILE  35          HG22      ILE  35   4.188  -2.535  -1.468
  305   3HG2  ILE  35          HG23      ILE  35   4.720  -3.538  -2.817
  306   1HD1  ILE  35          HD11      ILE  35   2.244  -2.616  -0.633
  307   2HD1  ILE  35          HD12      ILE  35   0.863  -3.290  -1.501
  308   3HD1  ILE  35          HD13      ILE  35   2.307  -2.802  -2.387
  309    H    PHE  36           HN       PHE  36   2.949  -7.755  -1.697
  310    HA   PHE  36           HA       PHE  36   2.966  -8.671   0.947
  311   1HB   PHE  36          HB1       PHE  36   1.871  -9.946  -1.562
  312   2HB   PHE  36          HB2       PHE  36   1.600 -10.582   0.060
  313    HD1  PHE  36           HD1      PHE  36   0.877  -8.577   1.788
  314    HD2  PHE  36           HD2      PHE  36   0.093  -8.737  -2.439
  315    HE1  PHE  36           HE1      PHE  36  -1.023  -7.000   2.089
  316    HE2  PHE  36           HE2      PHE  36  -1.808  -7.159  -2.142
  317    HZ   PHE  36           HZ       PHE  36  -2.360  -6.282   0.119
  318    H    GLY  37           HN       GLY  37   4.521  -9.612   1.940
  319   1HA   GLY  37          HA1       GLY  37   5.709 -11.639   2.448
  320   2HA   GLY  37          HA2       GLY  37   6.066 -11.811   0.740
  321    H    ARG  38           HN       ARG  38   6.546  -8.610   1.268
  322    HA   ARG  38           HA       ARG  38   9.415  -8.911   1.884
  323   1HB   ARG  38          HB1       ARG  38   7.886  -7.198  -0.043
  324   2HB   ARG  38          HB2       ARG  38   9.360  -6.540   0.655
  325   1HG   ARG  38          HG1       ARG  38  10.710  -7.952  -0.511
  326   2HG   ARG  38          HG2       ARG  38   9.534  -9.268  -0.493
  327   1HD   ARG  38          HD1       ARG  38   9.557  -8.623  -2.740
  328   2HD   ARG  38          HD2       ARG  38   8.163  -7.753  -2.097
  329    HE   ARG  38           HE       ARG  38  10.248  -6.699  -1.624
  330   1HH1  ARG  38          HH21      ARG  38   8.324  -7.214  -4.436
  331   2HH1  ARG  38          HH22      ARG  38   8.451  -5.626  -4.994
  332   1HH2  ARG  38          HH11      ARG  38  10.891  -4.401  -3.177
  333   2HH2  ARG  38          HH12      ARG  38  10.316  -4.635  -4.772
  334    H    HIS  39           HN       HIS  39  10.292  -6.673   2.662
  335    HA   HIS  39           HA       HIS  39   8.686  -5.909   4.992
  336   1HB   HIS  39          HB1       HIS  39  11.619  -5.347   4.465
  337   2HB   HIS  39          HB2       HIS  39  10.764  -5.207   6.004
  338    HD2  HIS  39           HD2      HIS  39  10.216  -7.455   7.354
  339    HE1  HIS  39           HE1      HIS  39  12.276 -10.165   4.801
  340    HE2  HIS  39           HE2      HIS  39  11.032  -9.916   7.001
  341    H    SER  40           HN       SER  40   9.039  -3.515   5.680
  342    HA   SER  40           HA       SER  40   8.149  -1.820   3.598
  343   1HB   SER  40          HB1       SER  40   9.256  -0.663   6.129
  344   2HB   SER  40          HB2       SER  40   7.896  -0.118   5.158
  345    HG   SER  40           HG       SER  40   6.823  -2.087   5.900
  346    H    GLY  41           HN       GLY  41   9.128  -0.182   2.494
  347   1HA   GLY  41          HA1       GLY  41  10.826   1.158   1.689
  348   2HA   GLY  41          HA2       GLY  41  11.854   0.597   2.985
  349    H    GLN  42           HN       GLN  42  10.404  -1.368   0.289
  350    HA   GLN  42           HA       GLN  42  13.159  -1.889  -0.575
  351   1HB   GLN  42          HB1       GLN  42  11.051  -4.028  -0.586
  352   2HB   GLN  42          HB2       GLN  42  12.780  -4.208  -0.856
  353   1HG   GLN  42          HG1       GLN  42  13.183  -3.462   1.483
  354   2HG   GLN  42          HG2       GLN  42  11.440  -3.420   1.736
  355   1HE2  GLN  42          HE21      GLN  42  13.351  -5.058   3.184
  356   2HE2  GLN  42          HE22      GLN  42  12.942  -6.703   2.865
  357    H    ALA  43           HN       ALA  43  11.234  -0.024  -1.959
  358    HA   ALA  43           HA       ALA  43  10.365  -1.178  -4.374
  359   1HB   ALA  43          HB1       ALA  43  11.068   1.701  -3.844
  360   2HB   ALA  43          HB2       ALA  43   9.527   0.932  -3.464
  361   3HB   ALA  43          HB3       ALA  43  10.043   1.091  -5.142
  362    H    GLU  44           HN       GLU  44  11.220  -1.450  -6.366
  363    HA   GLU  44           HA       GLU  44  14.044  -1.548  -6.682
  364   1HB   GLU  44          HB1       GLU  44  12.096  -2.120  -8.914
  365   2HB   GLU  44          HB2       GLU  44  13.668  -2.851  -8.603
  366   1HG   GLU  44          HG1       GLU  44  12.299  -4.548  -7.894
  367   2HG   GLU  44          HG2       GLU  44  12.527  -3.682  -6.387
  368    H    GLY  45           HN       GLY  45  14.319   0.808  -6.320
  369   1HA   GLY  45          HA1       GLY  45  15.635   2.371  -7.693
  370   2HA   GLY  45          HA2       GLY  45  14.332   2.322  -8.858
  371    H    TYR  46           HN       TYR  46  13.571   2.558  -5.449
  372    HA   TYR  46           HA       TYR  46  13.146   5.439  -5.594
  373   1HB   TYR  46          HB1       TYR  46  11.076   4.440  -6.328
  374   2HB   TYR  46          HB2       TYR  46  11.005   3.448  -4.878
  375    HD1  TYR  46           HD1      TYR  46  10.407   6.762  -6.313
  376    HD2  TYR  46           HD2      TYR  46  10.559   4.478  -2.677
  377    HE1  TYR  46           HE1      TYR  46   9.026   8.499  -5.180
  378    HE2  TYR  46           HE2      TYR  46   9.086   6.147  -1.557
  379    HH   TYR  46           HH       TYR  46   7.480   8.671  -3.344
  380    H    SER  47           HN       SER  47  13.299   6.576  -3.711
  381    HA   SER  47           HA       SER  47  14.527   5.226  -1.444
  382   1HB   SER  47          HB1       SER  47  14.498   8.012  -0.999
  383   2HB   SER  47          HB2       SER  47  15.868   7.007  -1.479
  384    HG   SER  47           HG       SER  47  15.765   7.886  -3.374
  385    H    TYR  48           HN       TYR  48  13.834   5.274   0.587
  386    HA   TYR  48           HA       TYR  48  11.163   6.231   1.311
  387   1HB   TYR  48          HB1       TYR  48  12.834   3.879   2.202
  388   2HB   TYR  48          HB2       TYR  48  11.340   4.355   3.007
  389    HD1  TYR  48           HD1      TYR  48   9.186   4.095   1.939
  390    HD2  TYR  48           HD2      TYR  48  12.796   2.892  -0.062
  391    HE1  TYR  48           HE1      TYR  48   7.847   2.685   0.389
  392    HE2  TYR  48           HE2      TYR  48  11.469   1.478  -1.618
  393    HH   TYR  48           HH       TYR  48   8.525   0.371  -0.936
  394    H    THR  49           HN       THR  49  10.875   6.917   3.657
  395    HA   THR  49           HA       THR  49  12.829   8.810   4.525
  396    HB   THR  49           HB       THR  49  11.290   8.840   6.632
  397    HG1  THR  49           HG1      THR  49   9.282   7.981   4.948
  398   1HG2  THR  49          HG21      THR  49   9.841  10.420   5.590
  399   2HG2  THR  49          HG22      THR  49  10.165   9.742   3.995
  400   3HG2  THR  49          HG23      THR  49  11.445  10.580   4.874
  401    H    ASP  50           HN       ASP  50  13.551   8.976   6.821
  402    HA   ASP  50           HA       ASP  50  15.246   6.928   7.593
  403   1HB   ASP  50          HB1       ASP  50  15.487   9.306   8.184
  404   2HB   ASP  50          HB2       ASP  50  14.099   9.179   9.263
  405    H    ALA  51           HN       ALA  51  11.924   7.530   8.599
  406    HA   ALA  51           HA       ALA  51  11.939   5.583  10.716
  407   1HB   ALA  51          HB1       ALA  51   9.649   7.199   9.601
  408   2HB   ALA  51          HB2       ALA  51  10.742   7.738  10.876
  409   3HB   ALA  51          HB3       ALA  51   9.692   6.348  11.146
  410    H    ASN  52           HN       ASN  52  10.721   5.627   7.344
  411    HA   ASN  52           HA       ASN  52   9.079   3.313   7.668
  412   1HB   ASN  52          HB1       ASN  52   8.368   4.699   5.951
  413   2HB   ASN  52          HB2       ASN  52   9.998   4.974   5.352
  414   1HD2  ASN  52          HD21      ASN  52   7.140   3.158   4.889
  415   2HD2  ASN  52          HD22      ASN  52   7.789   2.168   3.631
  416    H    ILE  53           HN       ILE  53  12.411   3.788   6.588
  417    HA   ILE  53           HA       ILE  53  12.886   1.126   5.761
  418    HB   ILE  53           HB       ILE  53  14.764   3.324   6.576
  419   1HG1  ILE  53          HG11      ILE  53  14.098   2.267   3.809
  420   2HG1  ILE  53          HG12      ILE  53  13.313   3.669   4.531
  421   1HG2  ILE  53          HG21      ILE  53  15.976   1.251   6.858
  422   2HG2  ILE  53          HG22      ILE  53  16.527   2.017   5.368
  423   3HG2  ILE  53          HG23      ILE  53  15.408   0.656   5.296
  424   1HD1  ILE  53          HD11      ILE  53  15.168   4.206   2.932
  425   2HD1  ILE  53          HD12      ILE  53  16.293   3.479   4.079
  426   3HD1  ILE  53          HD13      ILE  53  15.365   4.905   4.539
  427    H    LYS  54           HN       LYS  54  14.431   2.642   8.645
  428    HA   LYS  54           HA       LYS  54  15.071   0.558  10.177
  429   1HB   LYS  54          HB1       LYS  54  13.679   3.077  11.080
  430   2HB   LYS  54          HB2       LYS  54  14.518   1.962  12.162
  431   1HG   LYS  54          HG1       LYS  54  16.619   2.366  11.106
  432   2HG   LYS  54          HG2       LYS  54  15.854   3.237   9.774
  433   1HD   LYS  54          HD1       LYS  54  15.152   5.006  11.335
  434   2HD   LYS  54          HD2       LYS  54  15.932   4.135  12.664
  435   1HE   LYS  54          HE1       LYS  54  18.098   4.410  11.687
  436   2HE   LYS  54          HE2       LYS  54  17.405   5.010  10.177
  437   1HZ   LYS  54          HZ1       LYS  54  18.139   6.896  11.318
  438   2HZ   LYS  54          HZ2       LYS  54  17.535   6.350  12.804
  439   3HZ   LYS  54          HZ3       LYS  54  16.467   6.866  11.596
  440    H    LYS  55           HN       LYS  55  11.839   1.119   9.228
  441    HA   LYS  55           HA       LYS  55  10.568  -0.232  11.455
  442   1HB   LYS  55          HB1       LYS  55   9.489   1.689  10.555
  443   2HB   LYS  55          HB2       LYS  55   9.545   1.046   8.931
  444   1HG   LYS  55          HG1       LYS  55   7.363   0.720   9.384
  445   2HG   LYS  55          HG2       LYS  55   7.995  -0.809   9.968
  446   1HD   LYS  55          HD1       LYS  55   7.419   1.571  11.737
  447   2HD   LYS  55          HD2       LYS  55   6.277   0.262  11.441
  448   1HE   LYS  55          HE1       LYS  55   9.002   0.006  12.731
  449   2HE   LYS  55          HE2       LYS  55   7.444  -0.084  13.556
  450   1HZ   LYS  55          HZ1       LYS  55   8.296  -2.291  13.160
  451   2HZ   LYS  55          HZ2       LYS  55   8.460  -1.982  11.509
  452   3HZ   LYS  55          HZ3       LYS  55   6.920  -2.047  12.201
  453    H    ASN  56           HN       ASN  56  11.391  -1.034   8.154
  454    HA   ASN  56           HA       ASN  56  10.800  -2.743   6.751
  455   1HB   ASN  56          HB1       ASN  56  12.850  -3.401   8.728
  456   2HB   ASN  56          HB2       ASN  56  12.189  -4.805   7.922
  457   1HD2  ASN  56          HD21      ASN  56  13.711  -1.611   7.163
  458   2HD2  ASN  56          HD22      ASN  56  14.121  -2.246   5.629
  459    H    VAL  57           HN       VAL  57   8.418  -2.609   7.834
  460    HA   VAL  57           HA       VAL  57   7.647  -4.899   9.359
  461    HB   VAL  57           HB       VAL  57   6.483  -2.457   8.762
  462   1HG1  VAL  57          HG11      VAL  57   4.667  -4.622   7.706
  463   2HG1  VAL  57          HG12      VAL  57   5.300  -3.254   6.790
  464   3HG1  VAL  57          HG13      VAL  57   4.173  -2.980   8.119
  465   1HG2  VAL  57          HG21      VAL  57   6.448  -3.586  10.865
  466   2HG2  VAL  57          HG22      VAL  57   5.455  -4.885  10.205
  467   3HG2  VAL  57          HG23      VAL  57   4.785  -3.263  10.371
  468    H    LEU  58           HN       LEU  58   6.762  -6.827   8.689
  469    HA   LEU  58           HA       LEU  58   7.200  -7.499   5.915
  470   1HB   LEU  58          HB1       LEU  58   7.933  -9.036   7.695
  471   2HB   LEU  58          HB2       LEU  58   6.263  -9.239   8.207
  472    HG   LEU  58           HG       LEU  58   5.809 -10.058   5.793
  473   1HD1  LEU  58          HD11      LEU  58   7.901  -9.284   4.806
  474   2HD1  LEU  58          HD12      LEU  58   7.773 -11.037   4.669
  475   3HD1  LEU  58          HD13      LEU  58   8.821 -10.325   5.896
  476   1HD2  LEU  58          HD21      LEU  58   5.900 -11.583   7.774
  477   2HD2  LEU  58          HD22      LEU  58   7.624 -11.798   7.474
  478   3HD2  LEU  58          HD23      LEU  58   6.448 -12.334   6.275
  479    H    TRP  59           HN       TRP  59   5.721  -6.634   4.620
  480    HA   TRP  59           HA       TRP  59   3.031  -6.130   5.170
  481   1HB   TRP  59          HB1       TRP  59   4.340  -6.608   2.494
  482   2HB   TRP  59          HB2       TRP  59   2.796  -5.819   2.753
  483    HD1  TRP  59           HD1      TRP  59   6.185  -4.998   1.971
  484    HE1  TRP  59           HE1      TRP  59   6.741  -2.551   2.565
  485    HE3  TRP  59           HE3      TRP  59   2.150  -3.865   4.903
  486    HZ2  TRP  59           HZ2      TRP  59   5.710  -0.445   4.202
  487    HZ3  TRP  59           HZ3      TRP  59   1.951  -1.634   5.932
  488    HH2  TRP  59           HH2      TRP  59   3.698   0.078   5.598
  489    H    ASP  60           HN       ASP  60   1.635  -7.583   5.705
  490    HA   ASP  60           HA       ASP  60   1.299 -10.129   4.299
  491   1HB   ASP  60          HB1       ASP  60   1.713 -11.056   6.296
  492   2HB   ASP  60          HB2       ASP  60   1.711  -9.491   7.087
  493    H    GLU  61           HN       GLU  61  -1.147 -10.872   5.167
  494    HA   GLU  61           HA       GLU  61  -2.899  -9.339   3.549
  495   1HB   GLU  61          HB1       GLU  61  -2.935 -11.911   4.301
  496   2HB   GLU  61          HB2       GLU  61  -4.038 -11.274   5.516
  497   1HG   GLU  61          HG1       GLU  61  -5.554 -11.770   3.881
  498   2HG   GLU  61          HG2       GLU  61  -5.142 -10.127   3.383
  499    H    ASN  62           HN       ASN  62  -2.766  -9.807   7.094
  500    HA   ASN  62           HA       ASN  62  -4.729  -7.757   7.575
  501   1HB   ASN  62          HB1       ASN  62  -4.681  -9.736   8.957
  502   2HB   ASN  62          HB2       ASN  62  -3.014  -9.431   9.417
  503   1HD2  ASN  62          HD21      ASN  62  -2.585  -7.712  10.869
  504   2HD2  ASN  62          HD22      ASN  62  -3.832  -7.098  11.893
  505    H    ASN  63           HN       ASN  63  -1.170  -7.990   8.112
  506    HA   ASN  63           HA       ASN  63  -0.670  -5.592   9.308
  507   1HB   ASN  63          HB1       ASN  63   1.039  -7.213   9.019
  508   2HB   ASN  63          HB2       ASN  63   0.933  -7.125   7.272
  509   1HD2  ASN  63          HD21      ASN  63   2.012  -5.318  10.150
  510   2HD2  ASN  63          HD22      ASN  63   2.905  -4.233   9.143
  511    H    MET  64           HN       MET  64  -1.025  -5.903   5.703
  512    HA   MET  64           HA       MET  64  -0.429  -3.299   5.017
  513   1HB   MET  64          HB1       MET  64  -0.835  -4.996   3.361
  514   2HB   MET  64          HB2       MET  64  -2.521  -5.126   3.841
  515   1HG   MET  64          HG1       MET  64  -2.834  -2.761   3.128
  516   2HG   MET  64          HG2       MET  64  -1.192  -2.773   2.514
  517   1HE   MET  64          HE1       MET  64  -3.585  -5.824   2.340
  518   2HE   MET  64          HE2       MET  64  -4.422  -5.601   0.802
  519   3HE   MET  64          HE3       MET  64  -4.764  -4.523   2.156
  520    H    SER  65           HN       SER  65  -3.510  -4.428   6.409
  521    HA   SER  65           HA       SER  65  -4.873  -1.953   6.231
  522   1HB   SER  65          HB1       SER  65  -5.461  -4.016   8.333
  523   2HB   SER  65          HB2       SER  65  -6.572  -2.919   7.524
  524    HG   SER  65           HG       SER  65  -5.556  -5.361   6.706
  525    H    GLU  66           HN       GLU  66  -2.824  -3.311   8.786
  526    HA   GLU  66           HA       GLU  66  -3.212  -1.510  10.838
  527   1HB   GLU  66          HB1       GLU  66  -0.543  -2.669   9.995
  528   2HB   GLU  66          HB2       GLU  66  -1.027  -2.187  11.618
  529   1HG   GLU  66          HG1       GLU  66  -2.619  -3.985  11.750
  530   2HG   GLU  66          HG2       GLU  66  -2.346  -4.409  10.060
  531    H    TYR  67           HN       TYR  67  -1.173  -1.180   7.986
  532    HA   TYR  67           HA       TYR  67  -0.154   1.430   8.581
  533   1HB   TYR  67          HB1       TYR  67   1.117  -0.280   7.368
  534   2HB   TYR  67          HB2       TYR  67  -0.056  -0.230   6.065
  535    HD1  TYR  67           HD1      TYR  67   0.954   0.627   4.159
  536    HD2  TYR  67           HD2      TYR  67   1.707   2.468   7.966
  537    HE1  TYR  67           HE1      TYR  67   2.445   2.288   3.054
  538    HE2  TYR  67           HE2      TYR  67   3.242   4.102   6.892
  539    HH   TYR  67           HH       TYR  67   3.632   4.260   3.391
  540    H    LEU  68           HN       LEU  68  -2.639   0.211   6.247
  541    HA   LEU  68           HA       LEU  68  -3.095   2.726   5.063
  542   1HB   LEU  68          HB1       LEU  68  -4.938   0.359   5.320
  543   2HB   LEU  68          HB2       LEU  68  -5.243   1.751   4.296
  544    HG   LEU  68           HG       LEU  68  -2.975  -0.235   3.999
  545   1HD1  LEU  68          HD11      LEU  68  -5.260  -0.961   3.357
  546   2HD1  LEU  68          HD12      LEU  68  -4.179  -0.840   1.969
  547   3HD1  LEU  68          HD13      LEU  68  -5.373   0.423   2.270
  548   1HD2  LEU  68          HD21      LEU  68  -2.159   1.958   3.276
  549   2HD2  LEU  68          HD22      LEU  68  -3.632   2.224   2.344
  550   3HD2  LEU  68          HD23      LEU  68  -2.501   0.959   1.863
  551    H    THR  69           HN       THR  69  -4.684   1.295   7.936
  552    HA   THR  69           HA       THR  69  -6.752   3.158   8.202
  553    HB   THR  69           HB       THR  69  -5.408   1.937  10.586
  554    HG1  THR  69           HG1      THR  69  -5.662   0.221   9.244
  555   1HG2  THR  69          HG21      THR  69  -7.316   3.384  11.077
  556   2HG2  THR  69          HG22      THR  69  -7.745   1.698  11.365
  557   3HG2  THR  69          HG23      THR  69  -8.300   2.511   9.902
  558    H    ASN  70           HN       ASN  70  -3.373   3.424   9.228
  559    HA   ASN  70           HA       ASN  70  -3.538   6.256   9.323
  560   1HB   ASN  70          HB1       ASN  70  -4.312   5.057  11.696
  561   2HB   ASN  70          HB2       ASN  70  -2.627   5.472  11.987
  562   1HD2  ASN  70          HD21      ASN  70  -3.323   7.042  13.542
  563   2HD2  ASN  70          HD22      ASN  70  -3.731   8.585  12.881
  564    HA   PRO  71           HA       PRO  71   0.616   4.657   8.093
  565   1HB   PRO  71          HB1       PRO  71   1.170   6.923   6.615
  566   2HB   PRO  71          HB2       PRO  71   0.393   5.469   5.980
  567   1HG   PRO  71          HG1       PRO  71  -0.841   8.033   6.899
  568   2HG   PRO  71          HG2       PRO  71  -1.261   7.023   5.503
  569   1HD   PRO  71          HD1       PRO  71  -2.722   6.984   7.752
  570   2HD   PRO  71          HD2       PRO  71  -2.449   5.510   6.799
  571    H    LYS  72           HN       LYS  72  -0.172   7.977   9.091
  572    HA   LYS  72           HA       LYS  72   2.372   8.786   9.939
  573   1HB   LYS  72          HB1       LYS  72  -0.385   9.775  10.259
  574   2HB   LYS  72          HB2       LYS  72   0.726  10.262  11.528
  575   1HG   LYS  72          HG1       LYS  72   0.520  11.911   9.695
  576   2HG   LYS  72          HG2       LYS  72   2.167  11.345   9.950
  577   1HD   LYS  72          HD1       LYS  72   1.904   9.809   8.024
  578   2HD   LYS  72          HD2       LYS  72   0.283  10.451   7.759
  579   1HE   LYS  72          HE1       LYS  72   1.105  12.570   7.145
  580   2HE   LYS  72          HE2       LYS  72   2.697  12.242   7.813
  581   1HZ   LYS  72          HZ1       LYS  72   2.216  12.157   5.245
  582   2HZ   LYS  72          HZ2       LYS  72   1.784  10.564   5.605
  583   3HZ   LYS  72          HZ3       LYS  72   3.337  11.112   5.976
  584    H    LYS  73           HN       LYS  73  -0.163   7.049  11.678
  585    HA   LYS  73           HA       LYS  73   1.242   7.204  14.186
  586   1HB   LYS  73          HB1       LYS  73  -1.203   7.110  14.146
  587   2HB   LYS  73          HB2       LYS  73  -1.140   5.509  13.423
  588   1HG   LYS  73          HG1       LYS  73  -1.627   5.382  15.812
  589   2HG   LYS  73          HG2       LYS  73  -0.091   4.611  15.436
  590   1HD   LYS  73          HD1       LYS  73   0.743   7.126  16.065
  591   2HD   LYS  73          HD2       LYS  73  -0.673   6.982  17.104
  592   1HE   LYS  73          HE1       LYS  73   1.031   6.185  18.466
  593   2HE   LYS  73          HE2       LYS  73   0.363   4.702  17.793
  594   1HZ   LYS  73          HZ1       LYS  73   2.669   4.496  17.625
  595   2HZ   LYS  73          HZ2       LYS  73   2.873   6.072  17.054
  596   3HZ   LYS  73          HZ3       LYS  73   2.167   4.905  16.058
  597    H    TYR  74           HN       TYR  74   0.876   4.705  11.694
  598    HA   TYR  74           HA       TYR  74   2.348   2.698  13.061
  599   1HB   TYR  74          HB1       TYR  74   0.683   2.577  11.044
  600   2HB   TYR  74          HB2       TYR  74   2.147   2.790  10.082
  601    HD1  TYR  74           HD1      TYR  74   3.382   0.859   9.462
  602    HD2  TYR  74           HD2      TYR  74   0.841   0.805  12.929
  603    HE1  TYR  74           HE1      TYR  74   3.814  -1.585   9.740
  604    HE2  TYR  74           HE2      TYR  74   1.254  -1.623  13.215
  605    HH   TYR  74           HH       TYR  74   1.884  -3.561  11.659
  606    H    ILE  75           HN       ILE  75   3.281   5.094  10.663
  607    HA   ILE  75           HA       ILE  75   6.122   4.630  11.214
  608    HB   ILE  75           HB       ILE  75   4.948   5.085   8.458
  609   1HG1  ILE  75          HG11      ILE  75   6.235   2.637   9.718
  610   2HG1  ILE  75          HG12      ILE  75   4.591   2.765   9.109
  611   1HG2  ILE  75          HG21      ILE  75   7.274   4.870   7.687
  612   2HG2  ILE  75          HG22      ILE  75   7.817   4.679   9.353
  613   3HG2  ILE  75          HG23      ILE  75   7.112   6.207   8.827
  614   1HD1  ILE  75          HD11      ILE  75   5.996   1.470   7.594
  615   2HD1  ILE  75          HD12      ILE  75   7.108   2.829   7.435
  616   3HD1  ILE  75          HD13      ILE  75   5.462   2.961   6.817
  617    HA   PRO  76           HA       PRO  76   5.082   8.991  12.139
  618   1HB   PRO  76          HB1       PRO  76   7.126   9.313  13.910
  619   2HB   PRO  76          HB2       PRO  76   5.562   8.615  14.343
  620   1HG   PRO  76          HG1       PRO  76   8.142   7.241  13.711
  621   2HG   PRO  76          HG2       PRO  76   6.959   6.874  14.980
  622   1HD   PRO  76          HD1       PRO  76   7.102   5.470  12.670
  623   2HD   PRO  76          HD2       PRO  76   5.575   5.734  13.535
  624    H    GLY  77           HN       GLY  77   5.656  10.183  10.393
  625   1HA   GLY  77          HA1       GLY  77   7.214  11.869   9.650
  626   2HA   GLY  77          HA2       GLY  77   8.517  10.738   9.957
  627    H    THR  78           HN       THR  78   6.046   9.038   8.473
  628    HA   THR  78           HA       THR  78   7.444   8.659   6.030
  629    HB   THR  78           HB       THR  78   5.759   7.151   7.433
  630    HG1  THR  78           HG1      THR  78   6.967   6.964   5.109
  631   1HG2  THR  78          HG21      THR  78   4.031   8.016   5.114
  632   2HG2  THR  78          HG22      THR  78   3.700   8.349   6.814
  633   3HG2  THR  78          HG23      THR  78   3.710   6.686   6.228
  634    H    LYS  79           HN       LYS  79   6.902   9.149   3.929
  635    HA   LYS  79           HA       LYS  79   5.697  11.680   3.440
  636   1HB   LYS  79          HB1       LYS  79   6.310   9.574   1.375
  637   2HB   LYS  79          HB2       LYS  79   6.252  11.315   1.153
  638   1HG   LYS  79          HG1       LYS  79   8.274  11.535   2.567
  639   2HG   LYS  79          HG2       LYS  79   8.345   9.770   2.688
  640   1HD   LYS  79          HD1       LYS  79   8.069  10.203  -0.036
  641   2HD   LYS  79          HD2       LYS  79   9.139  11.516   0.474
  642   1HE   LYS  79          HE1       LYS  79  10.770   9.962   0.262
  643   2HE   LYS  79          HE2       LYS  79  10.204   9.418   1.841
  644   1HZ   LYS  79          HZ1       LYS  79   8.827   8.344  -0.491
  645   2HZ   LYS  79          HZ2       LYS  79   9.233   7.593   0.967
  646   3HZ   LYS  79          HZ3       LYS  79  10.411   7.804  -0.224
  647    H    MET  80           HN       MET  80   4.293   8.437   3.415
  648    HA   MET  80           HA       MET  80   2.154   9.023   1.664
  649   1HB   MET  80          HB1       MET  80   2.487   6.767   1.772
  650   2HB   MET  80          HB2       MET  80   2.808   6.782   3.510
  651   1HG   MET  80          HG1       MET  80   0.670   6.471   4.031
  652   2HG   MET  80          HG2       MET  80   0.125   7.683   2.887
  653   1HE   MET  80          HE1       MET  80  -0.999   4.574   3.922
  654   2HE   MET  80          HE2       MET  80   0.675   4.043   3.768
  655   3HE   MET  80          HE3       MET  80  -0.576   3.312   2.764
  656    H    ALA  81           HN       ALA  81   0.882  10.630   1.995
  657    HA   ALA  81           HA       ALA  81  -0.537  10.937   4.536
  658   1HB   ALA  81          HB1       ALA  81   1.196  12.620   4.291
  659   2HB   ALA  81          HB2       ALA  81  -0.414  13.338   4.308
  660   3HB   ALA  81          HB3       ALA  81   0.458  13.167   2.785
  661    H    PHE  82           HN       PHE  82  -1.735   9.449   2.789
  662    HA   PHE  82           HA       PHE  82  -3.729  10.731   1.191
  663   1HB   PHE  82          HB1       PHE  82  -4.131   8.653   0.276
  664   2HB   PHE  82          HB2       PHE  82  -2.422   8.572   0.686
  665    HD1  PHE  82           HD1      PHE  82  -5.438   6.804   0.779
  666    HD2  PHE  82           HD2      PHE  82  -1.965   7.645   3.176
  667    HE1  PHE  82           HE1      PHE  82  -5.927   4.812   2.189
  668    HE2  PHE  82           HE2      PHE  82  -2.461   5.665   4.592
  669    HZ   PHE  82           HZ       PHE  82  -4.453   4.261   4.111
  670    H    GLY  83           HN       GLY  83  -3.833  10.914   4.313
  671   1HA   GLY  83          HA1       GLY  83  -5.686  11.339   5.672
  672   2HA   GLY  83          HA2       GLY  83  -6.718  10.618   4.457
  673    H    GLY  84           HN       GLY  84  -5.564   8.038   4.335
  674   1HA   GLY  84          HA1       GLY  84  -5.150   6.068   5.537
  675   2HA   GLY  84          HA2       GLY  84  -5.581   6.896   7.021
  676    H    LEU  85           HN       LEU  85  -6.584   4.678   4.737
  677    HA   LEU  85           HA       LEU  85  -9.424   5.002   4.839
  678   1HB   LEU  85          HB1       LEU  85  -7.675   2.747   3.856
  679   2HB   LEU  85          HB2       LEU  85  -9.423   2.734   3.747
  680    HG   LEU  85           HG       LEU  85  -7.568   4.681   2.349
  681   1HD1  LEU  85          HD11      LEU  85  -7.576   2.405   1.417
  682   2HD1  LEU  85          HD12      LEU  85  -8.361   3.546   0.325
  683   3HD1  LEU  85          HD13      LEU  85  -9.336   2.455   1.309
  684   1HD2  LEU  85          HD21      LEU  85  -9.508   5.548   1.205
  685   2HD2  LEU  85          HD22      LEU  85  -9.787   5.702   2.939
  686   3HD2  LEU  85          HD23      LEU  85 -10.567   4.406   2.033
  687    H    LYS  86           HN       LYS  86  -9.598   5.155   7.082
  688    HA   LYS  86           HA       LYS  86  -9.088   3.215   9.022
  689   1HB   LYS  86          HB1       LYS  86 -10.966   5.570   8.923
  690   2HB   LYS  86          HB2       LYS  86 -10.773   4.575  10.360
  691   1HG   LYS  86          HG1       LYS  86  -8.888   5.632  10.937
  692   2HG   LYS  86          HG2       LYS  86  -8.196   5.413   9.328
  693   1HD   LYS  86          HD1       LYS  86  -9.403   7.386   8.521
  694   2HD   LYS  86          HD2       LYS  86 -10.155   7.591  10.102
  695   1HE   LYS  86          HE1       LYS  86  -8.313   9.150   9.881
  696   2HE   LYS  86          HE2       LYS  86  -7.908   7.936  11.092
  697   1HZ   LYS  86          HZ1       LYS  86  -6.704   6.751   9.242
  698   2HZ   LYS  86          HZ2       LYS  86  -6.008   8.198   9.769
  699   3HZ   LYS  86          HZ3       LYS  86  -6.887   8.167   8.327
  700    H    LYS  87           HN       LYS  87 -11.640   3.322   6.716
  701    HA   LYS  87           HA       LYS  87 -13.588   1.770   8.159
  702   1HB   LYS  87          HB1       LYS  87 -13.350   2.334   5.213
  703   2HB   LYS  87          HB2       LYS  87 -14.751   1.681   6.018
  704   1HG   LYS  87          HG1       LYS  87 -14.849   3.994   7.238
  705   2HG   LYS  87          HG2       LYS  87 -13.800   4.526   5.888
  706   1HD   LYS  87          HD1       LYS  87 -15.478   2.855   4.621
  707   2HD   LYS  87          HD2       LYS  87 -16.549   3.430   5.853
  708   1HE   LYS  87          HE1       LYS  87 -16.898   5.401   4.771
  709   2HE   LYS  87          HE2       LYS  87 -15.284   5.407   4.025
  710   1HZ   LYS  87          HZ1       LYS  87 -17.323   3.346   3.392
  711   2HZ   LYS  87          HZ2       LYS  87 -15.889   3.661   2.561
  712   3HZ   LYS  87          HZ3       LYS  87 -17.169   4.772   2.485
  713    H    GLU  88           HN       GLU  88 -13.078  -0.313   8.601
  714    HA   GLU  88           HA       GLU  88 -11.406  -2.057   7.266
  715   1HB   GLU  88          HB1       GLU  88 -12.354  -2.280   9.568
  716   2HB   GLU  88          HB2       GLU  88 -13.853  -2.841   8.837
  717   1HG   GLU  88          HG1       GLU  88 -12.475  -4.658   7.705
  718   2HG   GLU  88          HG2       GLU  88 -11.152  -4.184   8.780
  719    H    LYS  89           HN       LYS  89 -14.966  -1.873   6.826
  720    HA   LYS  89           HA       LYS  89 -15.256  -4.052   5.133
  721   1HB   LYS  89          HB1       LYS  89 -16.967  -1.613   4.804
  722   2HB   LYS  89          HB2       LYS  89 -17.428  -3.314   4.782
  723   1HG   LYS  89          HG1       LYS  89 -16.306  -2.126   7.286
  724   2HG   LYS  89          HG2       LYS  89 -17.986  -1.825   6.863
  725   1HD   LYS  89          HD1       LYS  89 -18.144  -3.696   8.240
  726   2HD   LYS  89          HD2       LYS  89 -18.104  -4.433   6.630
  727   1HE   LYS  89          HE1       LYS  89 -15.914  -5.154   6.860
  728   2HE   LYS  89          HE2       LYS  89 -15.520  -3.913   8.049
  729   1HZ   LYS  89          HZ1       LYS  89 -17.202  -5.224   9.499
  730   2HZ   LYS  89          HZ2       LYS  89 -15.617  -5.787   9.336
  731   3HZ   LYS  89          HZ3       LYS  89 -16.858  -6.498   8.434
  732    H    ASP  90           HN       ASP  90 -14.508  -0.759   4.388
  733    HA   ASP  90           HA       ASP  90 -14.423  -0.780   1.618
  734   1HB   ASP  90          HB1       ASP  90 -13.346   0.881   3.853
  735   2HB   ASP  90          HB2       ASP  90 -12.784   1.209   2.224
  736    H    ARG  91           HN       ARG  91 -11.779  -1.472   3.991
  737    HA   ARG  91           HA       ARG  91  -9.849  -1.942   1.916
  738   1HB   ARG  91          HB1       ARG  91  -9.581  -2.877   4.780
  739   2HB   ARG  91          HB2       ARG  91  -8.294  -2.692   3.594
  740   1HG   ARG  91          HG1       ARG  91  -8.618  -0.283   3.581
  741   2HG   ARG  91          HG2       ARG  91  -9.962  -0.436   4.701
  742   1HD   ARG  91          HD1       ARG  91  -7.055  -1.033   5.267
  743   2HD   ARG  91          HD2       ARG  91  -7.972   0.347   5.849
  744    HE   ARG  91           HE       ARG  91  -8.011  -2.126   6.155
  745   1HH1  ARG  91          HH21      ARG  91  -8.951   0.915   7.550
  746   2HH1  ARG  91          HH22      ARG  91  -9.680   0.439   9.044
  747   1HH2  ARG  91          HH11      ARG  91  -9.115  -2.920   8.615
  748   2HH2  ARG  91          HH12      ARG  91  -9.813  -1.704   9.624
  749    H    ASN  92           HN       ASN  92 -11.991  -4.063   3.768
  750    HA   ASN  92           HA       ASN  92 -11.054  -6.541   3.349
  751   1HB   ASN  92          HB1       ASN  92 -13.869  -5.502   3.175
  752   2HB   ASN  92          HB2       ASN  92 -13.525  -7.215   2.999
  753   1HD2  ASN  92          HD21      ASN  92 -15.165  -6.487   4.966
  754   2HD2  ASN  92          HD22      ASN  92 -14.310  -6.862   6.423
  755    H    ASP  93           HN       ASP  93 -13.006  -4.869   0.834
  756    HA   ASP  93           HA       ASP  93 -12.505  -6.790  -1.191
  757   1HB   ASP  93          HB1       ASP  93 -14.265  -4.739  -0.934
  758   2HB   ASP  93          HB2       ASP  93 -13.116  -4.034  -2.060
  759    H    LEU  94           HN       LEU  94 -10.804  -3.719  -0.380
  760    HA   LEU  94           HA       LEU  94  -9.157  -3.523  -2.581
  761   1HB   LEU  94          HB1       LEU  94  -9.340  -2.389   0.116
  762   2HB   LEU  94          HB2       LEU  94  -7.738  -2.445  -0.521
  763    HG   LEU  94           HG       LEU  94  -9.980  -1.255  -2.124
  764   1HD1  LEU  94          HD11      LEU  94  -9.829  -0.195   0.132
  765   2HD1  LEU  94          HD12      LEU  94  -9.480   0.907  -1.204
  766   3HD1  LEU  94          HD13      LEU  94  -8.160   0.247  -0.240
  767   1HD2  LEU  94          HD21      LEU  94  -8.341  -0.045  -3.317
  768   2HD2  LEU  94          HD22      LEU  94  -7.700  -1.684  -3.203
  769   3HD2  LEU  94          HD23      LEU  94  -7.084  -0.420  -2.139
  770    H    ILE  95           HN       ILE  95  -8.703  -5.437   0.363
  771    HA   ILE  95           HA       ILE  95  -6.027  -6.201  -0.002
  772    HB   ILE  95           HB       ILE  95  -8.232  -7.722   1.407
  773   1HG1  ILE  95          HG11      ILE  95  -6.254  -5.737   2.575
  774   2HG1  ILE  95          HG12      ILE  95  -7.910  -5.323   2.143
  775   1HG2  ILE  95          HG21      ILE  95  -6.200  -9.085   1.042
  776   2HG2  ILE  95          HG22      ILE  95  -6.451  -8.724   2.749
  777   3HG2  ILE  95          HG23      ILE  95  -5.234  -7.837   1.831
  778   1HD1  ILE  95          HD11      ILE  95  -7.632  -5.776   4.556
  779   2HD1  ILE  95          HD12      ILE  95  -7.137  -7.425   4.171
  780   3HD1  ILE  95          HD13      ILE  95  -8.770  -6.885   3.788
  781    H    THR  96           HN       THR  96  -9.031  -7.945  -0.914
  782    HA   THR  96           HA       THR  96  -7.864 -10.101  -2.241
  783    HB   THR  96           HB       THR  96 -10.470  -8.878  -3.135
  784    HG1  THR  96           HG1      THR  96  -9.847  -9.707  -0.675
  785   1HG2  THR  96          HG21      THR  96  -9.442 -11.718  -2.960
  786   2HG2  THR  96          HG22      THR  96  -9.724 -10.795  -4.436
  787   3HG2  THR  96          HG23      THR  96 -11.085 -11.267  -3.417
  788    H    TYR  97           HN       TYR  97  -8.680  -6.874  -3.564
  789    HA   TYR  97           HA       TYR  97  -7.989  -7.441  -6.232
  790   1HB   TYR  97          HB1       TYR  97  -9.257  -5.488  -5.830
  791   2HB   TYR  97          HB2       TYR  97  -8.071  -4.858  -4.694
  792    HD1  TYR  97           HD1      TYR  97  -6.697  -3.153  -5.405
  793    HD2  TYR  97           HD2      TYR  97  -8.233  -5.938  -8.298
  794    HE1  TYR  97           HE1      TYR  97  -5.586  -1.871  -7.222
  795    HE2  TYR  97           HE2      TYR  97  -7.228  -4.597 -10.137
  796    HH   TYR  97           HH       TYR  97  -4.887  -2.648  -9.932
  797    H    LEU  98           HN       LEU  98  -5.964  -5.771  -3.767
  798    HA   LEU  98           HA       LEU  98  -3.615  -5.652  -5.295
  799   1HB   LEU  98          HB1       LEU  98  -4.424  -4.727  -2.851
  800   2HB   LEU  98          HB2       LEU  98  -3.271  -5.975  -2.387
  801    HG   LEU  98           HG       LEU  98  -1.502  -4.933  -3.665
  802   1HD1  LEU  98          HD11      LEU  98  -3.560  -2.901  -4.555
  803   2HD1  LEU  98          HD12      LEU  98  -2.912  -4.188  -5.571
  804   3HD1  LEU  98          HD13      LEU  98  -1.847  -2.913  -4.976
  805   1HD2  LEU  98          HD21      LEU  98  -2.001  -3.968  -1.424
  806   2HD2  LEU  98          HD22      LEU  98  -3.016  -2.759  -2.210
  807   3HD2  LEU  98          HD23      LEU  98  -1.284  -2.803  -2.538
  808    H    LYS  99           HN       LYS  99  -4.698  -8.014  -2.930
  809    HA   LYS  99           HA       LYS  99  -2.551  -9.764  -2.909
  810   1HB   LYS  99          HB1       LYS  99  -3.885 -10.522  -1.286
  811   2HB   LYS  99          HB2       LYS  99  -5.299  -9.762  -1.991
  812   1HG   LYS  99          HG1       LYS  99  -5.643 -11.693  -3.440
  813   2HG   LYS  99          HG2       LYS  99  -4.190 -12.449  -2.815
  814   1HD   LYS  99          HD1       LYS  99  -6.181 -11.784  -0.753
  815   2HD   LYS  99          HD2       LYS  99  -6.738 -12.954  -1.953
  816   1HE   LYS  99          HE1       LYS  99  -5.515 -13.801   0.168
  817   2HE   LYS  99          HE2       LYS  99  -5.121 -14.504  -1.393
  818   1HZ   LYS  99          HZ1       LYS  99  -3.324 -13.615   0.343
  819   2HZ   LYS  99          HZ2       LYS  99  -3.510 -12.232  -0.617
  820   3HZ   LYS  99          HZ3       LYS  99  -3.071 -13.701  -1.338
  821    H    LYS 100           HN       LYS 100  -5.274  -9.625  -5.206
  822    HA   LYS 100           HA       LYS 100  -4.530 -11.947  -6.656
  823   1HB   LYS 100          HB1       LYS 100  -6.790 -10.501  -6.472
  824   2HB   LYS 100          HB2       LYS 100  -6.225 -10.011  -8.052
  825   1HG   LYS 100          HG1       LYS 100  -7.899 -11.998  -7.828
  826   2HG   LYS 100          HG2       LYS 100  -6.562 -12.124  -8.975
  827   1HD   LYS 100          HD1       LYS 100  -6.003 -13.029  -6.246
  828   2HD   LYS 100          HD2       LYS 100  -7.213 -13.960  -7.072
  829   1HE   LYS 100          HE1       LYS 100  -5.414 -15.256  -7.471
  830   2HE   LYS 100          HE2       LYS 100  -5.212 -14.162  -8.849
  831   1HZ   LYS 100          HZ1       LYS 100  -3.643 -12.857  -7.638
  832   2HZ   LYS 100          HZ2       LYS 100  -3.169 -14.469  -7.462
  833   3HZ   LYS 100          HZ3       LYS 100  -3.965 -13.684  -6.190
  834    H    ALA 101           HN       ALA 101  -3.658  -8.717  -7.006
  835    HA   ALA 101           HA       ALA 101  -2.409  -8.783  -9.568
  836   1HB   ALA 101          HB1       ALA 101  -1.879  -6.460  -9.067
  837   2HB   ALA 101          HB2       ALA 101  -2.367  -6.692  -7.388
  838   3HB   ALA 101          HB3       ALA 101  -3.564  -6.809  -8.678
  839    H    THR 102           HN       THR 102  -1.254  -8.962  -6.221
  840    HA   THR 102           HA       THR 102   1.547  -8.991  -6.841
  841    HB   THR 102           HB       THR 102   0.227  -9.781  -4.243
  842    HG1  THR 102           HG1      THR 102  -0.291  -7.611  -4.930
  843   1HG2  THR 102          HG21      THR 102   2.985  -8.657  -4.749
  844   2HG2  THR 102          HG22      THR 102   2.646 -10.373  -4.515
  845   3HG2  THR 102          HG23      THR 102   2.329  -9.226  -3.213
  846    H    GLU 103           HN       GLU 103  -0.897 -11.476  -6.065
  847    HA   GLU 103           HA       GLU 103   1.048 -13.515  -6.944
  848   1HB   GLU 103          HB1       GLU 103  -0.542 -15.011  -5.362
  849   2HB   GLU 103          HB2       GLU 103   0.940 -14.253  -4.803
  850   1HG   GLU 103          HG1       GLU 103  -0.253 -13.298  -3.208
  851   2HG   GLU 103          HG2       GLU 103  -1.007 -12.308  -4.452
  852    HHA  HEC 104           HA       HEC 104   5.292   3.470   1.407
  853    HHB  HEC 104           HB       HEC 104  -0.291   0.399   0.138
  854    HHC  HEC 104           HC       HEC 104  -3.001   6.074  -1.432
  855    HHD  HEC 104           HD       HEC 104   2.852   8.805  -1.351
  856   1HMA  HEC 104          HMA1      HEC 104   1.539  -0.954   1.957
  857   2HMA  HEC 104          HMA2      HEC 104   3.071  -1.272   1.142
  858   3HMA  HEC 104          HMA3      HEC 104   1.582  -1.148   0.204
  859   1HAA  HEC 104          HAA1      HEC 104   4.571  -0.221   2.065
  860   2HAA  HEC 104          HAA2      HEC 104   5.199   1.370   2.453
  861   1HBA  HEC 104          HBA1      HEC 104   6.069   1.559   0.134
  862   2HBA  HEC 104          HBA2      HEC 104   5.500  -0.072  -0.187
  863   1HMB  HEC 104          HMB1      HEC 104  -2.156   0.029  -0.498
  864   2HMB  HEC 104          HMB2      HEC 104  -3.089   0.603  -1.879
  865   3HMB  HEC 104          HMB3      HEC 104  -3.764   0.713  -0.254
  866    HAB  HEC 104           HAB      HEC 104  -4.362   4.702  -1.491
  867   1HBB  HEC 104          HBB1      HEC 104  -4.665   3.461   0.790
  868   2HBB  HEC 104          HBB2      HEC 104  -5.623   2.362  -0.203
  869   3HBB  HEC 104          HBB3      HEC 104  -6.032   4.078  -0.139
  870   1HMC  HEC 104          HMC1      HEC 104  -3.137   8.639  -1.584
  871   2HMC  HEC 104          HMC2      HEC 104  -2.768   7.930  -3.156
  872   3HMC  HEC 104          HMC3      HEC 104  -2.214   9.559  -2.771
  873    HAC  HEC 104           HAC      HEC 104   1.627   9.822  -2.630
  874   1HBC  HEC 104          HBC1      HEC 104   0.783  11.178  -0.956
  875   2HBC  HEC 104          HBC2      HEC 104  -0.871  11.057  -1.554
  876   3HBC  HEC 104          HBC3      HEC 104   0.335  11.961  -2.471
  877   1HMD  HEC 104          HMD1      HEC 104   4.968   9.268  -0.428
  878   2HMD  HEC 104          HMD2      HEC 104   5.457   8.303  -1.821
  879   3HMD  HEC 104          HMD3      HEC 104   6.470   8.345  -0.378
  880   1HAD  HEC 104          HAD1      HEC 104   7.331   6.496   0.398
  881   2HAD  HEC 104          HAD2      HEC 104   6.924   4.937   1.105
  882   1HBD  HEC 104          HBD1      HEC 104   6.368   5.860   3.157
  883   2HBD  HEC 104          HBD2      HEC 104   6.000   7.428   2.470
  884    H2   4NL 105           H2       4NL 105  -0.300 -12.860  -1.227
  885    H6   4NL 105           H6       4NL 105   1.455 -13.589   3.898
  886    H3   4NL 105           H3       4NL 105  -1.644 -10.350   2.053
  887    H5   4NL 105           H5       4NL 105  -2.477 -10.218  -0.027
  888    H4   4NL 105           H4       4NL 105  -0.017 -11.484   3.589
  889    H1   4NL 105           H1       4NL 105   1.327 -13.995   0.308
  890    H7   4NL 105           H7       4NL 105   2.609 -13.737   2.550
  Start of MODEL    9
    1   1H    THR  -5          HT1       THR  -5 -13.295  -4.508  13.188
    2   2H    THR  -5          HT2       THR  -5 -12.403  -4.010  11.838
    3   3H    THR  -5          HT3       THR  -5 -11.673  -4.046  13.364
    4    HA   THR  -5           HA       THR  -5 -11.202  -5.944  11.716
    5    HB   THR  -5           HB       THR  -5 -12.108  -6.907  14.422
    6    HG1  THR  -5           HG1      THR  -5  -9.758  -6.009  14.836
    7   1HG2  THR  -5          HG21      THR  -5  -9.614  -7.307  12.757
    8   2HG2  THR  -5          HG22      THR  -5 -10.933  -8.461  12.947
    9   3HG2  THR  -5          HG23      THR  -5  -9.918  -8.047  14.330
   10    H    GLU  -4           HN       GLU  -4 -12.778  -6.434  10.165
   11    HA   GLU  -4           HA       GLU  -4 -14.575  -8.559  10.733
   12   1HB   GLU  -4          HB1       GLU  -4 -15.789  -6.274  11.412
   13   2HB   GLU  -4          HB2       GLU  -4 -16.037  -6.156   9.674
   14   1HG   GLU  -4          HG1       GLU  -4 -16.966  -8.384  11.486
   15   2HG   GLU  -4          HG2       GLU  -4 -17.972  -7.174  10.700
   16    H    PHE  -3           HN       PHE  -3 -12.727  -9.002   9.203
   17    HA   PHE  -3           HA       PHE  -3 -12.909  -7.932   6.544
   18   1HB   PHE  -3          HB1       PHE  -3 -10.698  -8.324   7.356
   19   2HB   PHE  -3          HB2       PHE  -3 -11.060 -10.009   7.710
   20    HD1  PHE  -3           HD1      PHE  -3 -10.733  -7.568   4.885
   21    HD2  PHE  -3           HD2      PHE  -3 -10.641 -11.689   6.112
   22    HE1  PHE  -3           HE1      PHE  -3 -10.024  -8.231   2.596
   23    HE2  PHE  -3           HE2      PHE  -3  -9.980 -12.359   3.809
   24    HZ   PHE  -3           HZ       PHE  -3  -9.701 -10.632   2.040
   25    H    LYS  -2           HN       LYS  -2 -13.157  -9.129   4.657
   26    HA   LYS  -2           HA       LYS  -2 -14.210 -11.768   4.522
   27   1HB   LYS  -2          HB1       LYS  -2 -16.096  -9.833   5.132
   28   2HB   LYS  -2          HB2       LYS  -2 -16.205  -9.938   3.376
   29   1HG   LYS  -2          HG1       LYS  -2 -16.870 -12.159   3.405
   30   2HG   LYS  -2          HG2       LYS  -2 -16.165 -12.457   4.991
   31   1HD   LYS  -2          HD1       LYS  -2 -18.733 -11.013   4.336
   32   2HD   LYS  -2          HD2       LYS  -2 -18.528 -12.485   5.283
   33   1HE   LYS  -2          HE1       LYS  -2 -17.672  -9.691   6.068
   34   2HE   LYS  -2          HE2       LYS  -2 -19.010 -10.608   6.750
   35   1HZ   LYS  -2          HZ1       LYS  -2 -16.106 -11.147   7.043
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.293 -12.261   7.489
   37   3HZ   LYS  -2          HZ3       LYS  -2 -17.227 -10.759   8.258
   38    H    ALA  -1           HN       ALA  -1 -13.611 -12.545   2.635
   39    HA   ALA  -1           HA       ALA  -1 -11.899 -11.331   0.885
   40   1HB   ALA  -1          HB1       ALA  -1 -12.244 -13.260  -0.545
   41   2HB   ALA  -1          HB2       ALA  -1 -13.760 -13.630   0.280
   42   3HB   ALA  -1          HB3       ALA  -1 -12.231 -13.756   1.149
   43    H    GLY   1           HN       GLY   1 -12.021 -10.338  -1.085
   44   1HA   GLY   1          HA1       GLY   1 -14.632  -9.291  -1.966
   45   2HA   GLY   1          HA2       GLY   1 -13.104  -8.439  -2.129
   46    H    SER   2           HN       SER   2 -13.123  -8.177  -4.280
   47    HA   SER   2           HA       SER   2 -12.392 -10.408  -5.966
   48   1HB   SER   2          HB1       SER   2 -14.558  -8.780  -7.167
   49   2HB   SER   2          HB2       SER   2 -14.208 -10.504  -7.342
   50    HG   SER   2           HG       SER   2 -14.939 -10.619  -5.046
   51    H    ALA   3           HN       ALA   3 -11.058  -9.759  -7.614
   52    HA   ALA   3           HA       ALA   3  -9.691  -7.405  -7.539
   53   1HB   ALA   3          HB1       ALA   3  -8.868  -7.978  -9.784
   54   2HB   ALA   3          HB2       ALA   3 -10.145  -9.186  -9.926
   55   3HB   ALA   3          HB3       ALA   3  -8.897  -9.366  -8.695
   56    H    LYS   4           HN       LYS   4 -12.622  -7.929  -9.573
   57    HA   LYS   4           HA       LYS   4 -12.427  -5.362 -10.776
   58   1HB   LYS   4          HB1       LYS   4 -13.418  -7.370 -11.866
   59   2HB   LYS   4          HB2       LYS   4 -14.840  -7.140 -10.847
   60   1HG   LYS   4          HG1       LYS   4 -14.193  -4.630 -12.031
   61   2HG   LYS   4          HG2       LYS   4 -14.194  -5.846 -13.303
   62   1HD   LYS   4          HD1       LYS   4 -16.449  -6.255 -13.092
   63   2HD   LYS   4          HD2       LYS   4 -16.476  -5.816 -11.380
   64   1HE   LYS   4          HE1       LYS   4 -16.017  -3.794 -13.579
   65   2HE   LYS   4          HE2       LYS   4 -17.625  -4.186 -12.968
   66   1HZ   LYS   4          HZ1       LYS   4 -16.227  -2.232 -11.968
   67   2HZ   LYS   4          HZ2       LYS   4 -15.549  -3.470 -11.039
   68   3HZ   LYS   4          HZ3       LYS   4 -17.215  -3.194 -10.983
   69    H    LYS   5           HN       LYS   5 -13.170  -5.872  -7.686
   70    HA   LYS   5           HA       LYS   5 -15.066  -3.612  -7.573
   71   1HB   LYS   5          HB1       LYS   5 -14.624  -5.786  -5.511
   72   2HB   LYS   5          HB2       LYS   5 -15.655  -4.381  -5.278
   73   1HG   LYS   5          HG1       LYS   5 -16.828  -5.235  -7.467
   74   2HG   LYS   5          HG2       LYS   5 -16.084  -6.773  -7.022
   75   1HD   LYS   5          HD1       LYS   5 -17.495  -5.329  -4.850
   76   2HD   LYS   5          HD2       LYS   5 -18.514  -5.982  -6.134
   77   1HE   LYS   5          HE1       LYS   5 -18.278  -7.585  -4.294
   78   2HE   LYS   5          HE2       LYS   5 -17.549  -8.209  -5.773
   79   1HZ   LYS   5          HZ1       LYS   5 -16.275  -8.362  -3.535
   80   2HZ   LYS   5          HZ2       LYS   5 -15.887  -6.740  -3.844
   81   3HZ   LYS   5          HZ3       LYS   5 -15.440  -7.942  -4.950
   82    H    GLY   6           HN       GLY   6 -12.318  -5.071  -5.796
   83   1HA   GLY   6          HA1       GLY   6 -11.664  -2.810  -4.258
   84   2HA   GLY   6          HA2       GLY   6 -10.550  -4.095  -4.697
   85    H    ALA   7           HN       ALA   7 -10.996  -3.503  -7.631
   86    HA   ALA   7           HA       ALA   7  -8.881  -1.746  -8.100
   87   1HB   ALA   7          HB1       ALA   7 -11.040  -2.365 -10.105
   88   2HB   ALA   7          HB2       ALA   7  -9.788  -3.523  -9.655
   89   3HB   ALA   7          HB3       ALA   7  -9.341  -1.991 -10.403
   90    H    THR   8           HN       THR   8 -12.439  -1.040  -8.383
   91    HA   THR   8           HA       THR   8 -12.216   1.591  -9.216
   92    HB   THR   8           HB       THR   8 -14.355   1.777  -7.516
   93    HG1  THR   8           HG1      THR   8 -13.974  -0.531  -7.077
   94   1HG2  THR   8          HG21      THR   8 -14.321   2.328  -9.915
   95   2HG2  THR   8          HG22      THR   8 -15.724   1.349  -9.483
   96   3HG2  THR   8          HG23      THR   8 -14.348   0.606 -10.301
   97    H    LEU   9           HN       LEU   9 -11.755   0.393  -5.935
   98    HA   LEU   9           HA       LEU   9 -11.699   2.893  -4.610
   99   1HB   LEU   9          HB1       LEU   9 -11.084   0.075  -3.939
  100   2HB   LEU   9          HB2       LEU   9 -10.187   1.277  -3.014
  101    HG   LEU   9           HG       LEU   9 -12.181   0.807  -1.780
  102   1HD1  LEU   9          HD11      LEU   9 -12.551   3.384  -3.314
  103   2HD1  LEU   9          HD12      LEU   9 -11.551   3.174  -1.877
  104   3HD1  LEU   9          HD13      LEU   9 -13.301   2.991  -1.767
  105   1HD2  LEU   9          HD21      LEU   9 -13.454  -0.082  -3.826
  106   2HD2  LEU   9          HD22      LEU   9 -13.883   1.600  -4.135
  107   3HD2  LEU   9          HD23      LEU   9 -14.386   0.825  -2.633
  108    H    PHE  10           HN       PHE  10  -8.902   0.732  -4.751
  109    HA   PHE  10           HA       PHE  10  -6.808   2.379  -4.487
  110   1HB   PHE  10          HB1       PHE  10  -6.730  -0.083  -4.818
  111   2HB   PHE  10          HB2       PHE  10  -6.940   0.167  -6.544
  112    HD1  PHE  10           HD1      PHE  10  -5.119   1.637  -7.742
  113    HD2  PHE  10           HD2      PHE  10  -4.607  -0.255  -3.914
  114    HE1  PHE  10           HE1      PHE  10  -2.643   1.744  -8.015
  115    HE2  PHE  10           HE2      PHE  10  -2.142  -0.030  -4.131
  116    HZ   PHE  10           HZ       PHE  10  -1.154   0.945  -6.189
  117    H    LYS  11           HN       LYS  11  -8.560   1.958  -7.550
  118    HA   LYS  11           HA       LYS  11  -6.920   3.367  -9.268
  119   1HB   LYS  11          HB1       LYS  11  -9.267   2.021  -9.511
  120   2HB   LYS  11          HB2       LYS  11  -9.793   3.678  -9.815
  121   1HG   LYS  11          HG1       LYS  11  -8.993   3.545 -11.886
  122   2HG   LYS  11          HG2       LYS  11  -7.373   3.327 -11.231
  123   1HD   LYS  11          HD1       LYS  11  -9.350   1.098 -11.757
  124   2HD   LYS  11          HD2       LYS  11  -8.017   1.540 -12.824
  125   1HE   LYS  11          HE1       LYS  11  -6.413   1.008 -11.028
  126   2HE   LYS  11          HE2       LYS  11  -7.748   0.560  -9.971
  127   1HZ   LYS  11          HZ1       LYS  11  -6.948  -0.808 -12.486
  128   2HZ   LYS  11          HZ2       LYS  11  -8.317  -1.202 -11.577
  129   3HZ   LYS  11          HZ3       LYS  11  -6.779  -1.404 -10.906
  130    H    THR  12           HN       THR  12  -9.157   4.767  -6.971
  131    HA   THR  12           HA       THR  12  -8.233   7.450  -7.657
  132    HB   THR  12           HB       THR  12 -10.384   7.093  -8.719
  133    HG1  THR  12           HG1      THR  12 -10.082   9.026  -6.720
  134   1HG2  THR  12          HG21      THR  12 -12.468   7.050  -7.505
  135   2HG2  THR  12          HG22      THR  12 -11.608   6.994  -5.965
  136   3HG2  THR  12          HG23      THR  12 -11.506   5.633  -7.083
  137    H    ARG  13           HN       ARG  13  -7.392   5.637  -5.632
  138    HA   ARG  13           HA       ARG  13  -7.668   7.293  -3.227
  139   1HB   ARG  13          HB1       ARG  13  -8.033   4.304  -3.369
  140   2HB   ARG  13          HB2       ARG  13  -7.661   5.137  -1.875
  141   1HG   ARG  13          HG1       ARG  13 -10.106   5.677  -3.545
  142   2HG   ARG  13          HG2       ARG  13 -10.058   4.547  -2.200
  143   1HD   ARG  13          HD1       ARG  13 -11.021   6.615  -1.439
  144   2HD   ARG  13          HD2       ARG  13  -9.418   6.453  -0.711
  145    HE   ARG  13           HE       ARG  13  -9.546   7.574  -3.198
  146   1HH1  ARG  13          HH11      ARG  13  -9.869   8.335   0.198
  147   2HH1  ARG  13          HH12      ARG  13  -9.146   9.902   0.207
  148   1HH2  ARG  13          HH21      ARG  13  -8.376   9.941  -3.126
  149   2HH2  ARG  13          HH22      ARG  13  -8.306  10.773  -1.612
  150    H    CYS  14           HN       CYS  14  -5.830   4.956  -5.062
  151    HA   CYS  14           HA       CYS  14  -3.405   5.586  -3.513
  152   1HB   CYS  14          HB1       CYS  14  -3.838   2.906  -4.773
  153   2HB   CYS  14          HB2       CYS  14  -2.724   3.352  -3.499
  154    H    LEU  15           HN       LEU  15  -4.766   4.674  -6.660
  155    HA   LEU  15           HA       LEU  15  -2.556   4.500  -8.254
  156   1HB   LEU  15          HB1       LEU  15  -5.131   4.295  -8.732
  157   2HB   LEU  15          HB2       LEU  15  -4.960   5.961  -9.269
  158    HG   LEU  15           HG       LEU  15  -3.119   5.203 -10.820
  159   1HD1  LEU  15          HD11      LEU  15  -4.107   2.459 -10.043
  160   2HD1  LEU  15          HD12      LEU  15  -2.500   3.117  -9.734
  161   3HD1  LEU  15          HD13      LEU  15  -3.025   2.811 -11.391
  162   1HD2  LEU  15          HD21      LEU  15  -4.699   3.984 -12.405
  163   2HD2  LEU  15          HD22      LEU  15  -5.206   5.580 -11.853
  164   3HD2  LEU  15          HD23      LEU  15  -5.914   4.132 -11.136
  165    H    GLN  16           HN       GLN  16  -4.095   7.514  -7.207
  166    HA   GLN  16           HA       GLN  16  -3.024   9.457  -8.703
  167   1HB   GLN  16          HB1       GLN  16  -2.931  10.784  -6.451
  168   2HB   GLN  16          HB2       GLN  16  -4.464  10.226  -7.104
  169   1HG   GLN  16          HG1       GLN  16  -4.164   8.172  -5.591
  170   2HG   GLN  16          HG2       GLN  16  -2.905   9.111  -4.784
  171   1HE2  GLN  16          HE21      GLN  16  -3.556  11.093  -3.699
  172   2HE2  GLN  16          HE22      GLN  16  -5.199  11.322  -3.228
  173    H    CYS  17           HN       CYS  17  -1.141   7.709  -6.250
  174    HA   CYS  17           HA       CYS  17   1.276   9.115  -7.160
  175   1HB   CYS  17          HB1       CYS  17   1.327   7.933  -4.457
  176   2HB   CYS  17          HB2       CYS  17   2.005   9.430  -5.072
  177    H    HIS  18           HN       HIS  18  -0.039   5.987  -6.179
  178    HA   HIS  18           HA       HIS  18   2.502   4.607  -6.516
  179   1HB   HIS  18          HB1       HIS  18  -0.191   3.869  -5.432
  180   2HB   HIS  18          HB2       HIS  18   0.992   2.630  -5.799
  181    HD1  HIS  18           HD1      HIS  18   3.451   3.108  -4.421
  182    HD2  HIS  18           HD2      HIS  18  -0.133   4.734  -2.995
  183    HE1  HIS  18           HE1      HIS  18   3.817   3.560  -1.952
  184    H    THR  19           HN       THR  19   2.253   2.374  -7.440
  185    HA   THR  19           HA       THR  19   0.664   2.205  -9.893
  186    HB   THR  19           HB       THR  19   3.019   0.873 -10.475
  187    HG1  THR  19           HG1      THR  19   4.425   2.889 -10.182
  188   1HG2  THR  19          HG21      THR  19   3.411   2.621 -12.099
  189   2HG2  THR  19          HG22      THR  19   2.331   3.713 -11.232
  190   3HG2  THR  19          HG23      THR  19   1.684   2.275 -12.019
  191    H    VAL  20           HN       VAL  20  -0.507   0.342  -9.965
  192    HA   VAL  20           HA       VAL  20  -0.241  -1.659  -7.923
  193    HB   VAL  20           HB       VAL  20  -2.311  -0.607  -9.224
  194   1HG1  VAL  20          HG11      VAL  20  -1.951  -1.717 -11.326
  195   2HG1  VAL  20          HG12      VAL  20  -3.440  -2.297 -10.577
  196   3HG1  VAL  20          HG13      VAL  20  -1.985  -3.294 -10.535
  197   1HG2  VAL  20          HG21      VAL  20  -3.749  -2.225  -8.169
  198   2HG2  VAL  20          HG22      VAL  20  -2.419  -1.802  -7.092
  199   3HG2  VAL  20          HG23      VAL  20  -2.397  -3.336  -7.958
  200    H    GLU  21           HN       GLU  21   0.773  -1.464 -11.192
  201    HA   GLU  21           HA       GLU  21   1.590  -4.294 -11.256
  202   1HB   GLU  21          HB1       GLU  21   1.701  -3.670 -13.847
  203   2HB   GLU  21          HB2       GLU  21   0.206  -4.215 -13.110
  204   1HG   GLU  21          HG1       GLU  21   0.035  -2.233 -14.680
  205   2HG   GLU  21          HG2       GLU  21  -0.711  -2.036 -13.097
  206    H    LYS  22           HN       LYS  22   3.611  -4.304 -13.125
  207    HA   LYS  22           HA       LYS  22   5.460  -2.313 -12.057
  208   1HB   LYS  22          HB1       LYS  22   5.687  -5.103 -12.467
  209   2HB   LYS  22          HB2       LYS  22   6.900  -4.298 -13.475
  210   1HG   LYS  22          HG1       LYS  22   7.997  -3.389 -11.695
  211   2HG   LYS  22          HG2       LYS  22   6.523  -3.208 -10.745
  212   1HD   LYS  22          HD1       LYS  22   6.530  -5.543 -10.189
  213   2HD   LYS  22          HD2       LYS  22   7.883  -5.841 -11.280
  214   1HE   LYS  22          HE1       LYS  22   8.859  -5.780  -9.140
  215   2HE   LYS  22          HE2       LYS  22   9.217  -4.210  -9.836
  216   1HZ   LYS  22          HZ1       LYS  22   7.346  -3.297  -8.501
  217   2HZ   LYS  22          HZ2       LYS  22   8.585  -3.939  -7.551
  218   3HZ   LYS  22          HZ3       LYS  22   7.157  -4.812  -7.768
  219    H    GLY  23           HN       GLY  23   3.668  -1.755 -14.450
  220   1HA   GLY  23          HA1       GLY  23   5.714  -1.306 -16.522
  221   2HA   GLY  23          HA2       GLY  23   3.977  -1.199 -16.757
  222    H    GLY  24           HN       GLY  24   3.779   0.460 -14.229
  223   1HA   GLY  24          HA1       GLY  24   4.198   3.067 -15.418
  224   2HA   GLY  24          HA2       GLY  24   3.318   2.707 -13.942
  225    HA   PRO  25           HA       PRO  25   8.052   3.720 -13.201
  226   1HB   PRO  25          HB1       PRO  25   8.105   6.457 -13.490
  227   2HB   PRO  25          HB2       PRO  25   8.674   5.317 -14.712
  228   1HG   PRO  25          HG1       PRO  25   6.061   6.759 -14.534
  229   2HG   PRO  25          HG2       PRO  25   7.068   6.434 -15.957
  230   1HD   PRO  25          HD1       PRO  25   4.863   4.989 -15.417
  231   2HD   PRO  25          HD2       PRO  25   6.302   4.258 -16.157
  232    H    HIS  26           HN       HIS  26   8.742   4.775 -11.236
  233    HA   HIS  26           HA       HIS  26   6.791   4.864  -9.199
  234   1HB   HIS  26          HB1       HIS  26   9.648   5.865  -9.253
  235   2HB   HIS  26          HB2       HIS  26   8.685   5.666  -7.799
  236    HD2  HIS  26           HD2      HIS  26  10.648   3.648 -10.424
  237    HE1  HIS  26           HE1      HIS  26   9.775   0.991  -7.229
  238    HE2  HIS  26           HE2      HIS  26  11.085   1.294  -9.382
  239    H    LYS  27           HN       LYS  27   5.306   6.487  -9.022
  240    HA   LYS  27           HA       LYS  27   5.887   9.168  -9.963
  241   1HB   LYS  27          HB1       LYS  27   3.407   7.644  -9.258
  242   2HB   LYS  27          HB2       LYS  27   3.353   9.398  -9.329
  243   1HG   LYS  27          HG1       LYS  27   3.837   9.450 -11.622
  244   2HG   LYS  27          HG2       LYS  27   4.479   7.804 -11.614
  245   1HD   LYS  27          HD1       LYS  27   1.581   8.643 -11.337
  246   2HD   LYS  27          HD2       LYS  27   2.311   7.732 -12.665
  247   1HE   LYS  27          HE1       LYS  27   2.471   5.785 -11.424
  248   2HE   LYS  27          HE2       LYS  27   2.518   6.647  -9.886
  249   1HZ   LYS  27          HZ1       LYS  27   0.154   6.155 -11.606
  250   2HZ   LYS  27          HZ2       LYS  27   0.140   7.227 -10.300
  251   3HZ   LYS  27          HZ3       LYS  27   0.428   5.583 -10.032
  252    H    VAL  28           HN       VAL  28   3.753   9.902  -7.690
  253    HA   VAL  28           HA       VAL  28   5.578  11.114  -5.897
  254    HB   VAL  28           HB       VAL  28   2.654  10.603  -5.361
  255   1HG1  VAL  28          HG11      VAL  28   3.915  11.472  -3.457
  256   2HG1  VAL  28          HG12      VAL  28   2.803  12.694  -4.075
  257   3HG1  VAL  28          HG13      VAL  28   4.524  12.797  -4.449
  258   1HG2  VAL  28          HG21      VAL  28   2.712  11.657  -7.531
  259   2HG2  VAL  28          HG22      VAL  28   3.888  12.846  -6.972
  260   3HG2  VAL  28          HG23      VAL  28   2.243  12.869  -6.337
  261    H    GLY  29           HN       GLY  29   4.146   7.998  -6.045
  262   1HA   GLY  29          HA1       GLY  29   5.312   7.197  -3.458
  263   2HA   GLY  29          HA2       GLY  29   3.749   6.605  -3.998
  264    HA   PRO  30           HA       PRO  30   7.508   4.023  -5.616
  265   1HB   PRO  30          HB1       PRO  30   7.537   2.023  -3.788
  266   2HB   PRO  30          HB2       PRO  30   8.489   3.502  -3.616
  267   1HG   PRO  30          HG1       PRO  30   5.849   2.798  -2.383
  268   2HG   PRO  30          HG2       PRO  30   7.275   3.535  -1.626
  269   1HD   PRO  30          HD1       PRO  30   5.152   5.000  -2.404
  270   2HD   PRO  30          HD2       PRO  30   6.812   5.625  -2.495
  271    H    ASN  31           HN       ASN  31   7.452   1.607  -6.179
  272    HA   ASN  31           HA       ASN  31   4.851   0.988  -7.259
  273   1HB   ASN  31          HB1       ASN  31   7.028   0.761  -8.504
  274   2HB   ASN  31          HB2       ASN  31   7.447  -0.577  -7.444
  275   1HD2  ASN  31          HD21      ASN  31   5.216   0.445  -9.987
  276   2HD2  ASN  31          HD22      ASN  31   4.810  -1.169 -10.472
  277    H    LEU  32           HN       LEU  32   3.403  -0.416  -6.402
  278    HA   LEU  32           HA       LEU  32   3.884  -1.732  -3.859
  279   1HB   LEU  32          HB1       LEU  32   1.374  -1.092  -5.408
  280   2HB   LEU  32          HB2       LEU  32   1.381  -1.942  -3.875
  281    HG   LEU  32           HG       LEU  32   2.309   0.909  -4.331
  282   1HD1  LEU  32          HD11      LEU  32  -0.043  -0.138  -2.744
  283   2HD1  LEU  32          HD12      LEU  32  -0.159   0.525  -4.374
  284   3HD1  LEU  32          HD13      LEU  32   0.376   1.550  -3.044
  285   1HD2  LEU  32          HD21      LEU  32   3.574  -0.320  -2.529
  286   2HD2  LEU  32          HD22      LEU  32   2.037  -0.531  -1.690
  287   3HD2  LEU  32          HD23      LEU  32   2.670   1.090  -1.977
  288    H    HIS  33           HN       HIS  33   3.747  -2.655  -7.127
  289    HA   HIS  33           HA       HIS  33   2.565  -5.192  -7.112
  290   1HB   HIS  33          HB1       HIS  33   3.070  -3.692  -9.087
  291   2HB   HIS  33          HB2       HIS  33   4.751  -4.197  -8.947
  292    HD2  HIS  33           HD2      HIS  33   1.543  -6.421  -8.785
  293    HE1  HIS  33           HE1      HIS  33   3.933  -7.799 -12.018
  294    HE2  HIS  33           HE2      HIS  33   1.849  -8.248 -10.633
  295    H    GLY  34           HN       GLY  34   3.319  -6.458  -5.432
  296   1HA   GLY  34          HA1       GLY  34   4.754  -8.430  -5.179
  297   2HA   GLY  34          HA2       GLY  34   6.114  -7.397  -5.566
  298    H    ILE  35           HN       ILE  35   3.950  -5.758  -3.446
  299    HA   ILE  35           HA       ILE  35   5.854  -5.673  -1.407
  300    HB   ILE  35           HB       ILE  35   4.161  -4.750   0.093
  301   1HG1  ILE  35          HG11      ILE  35   2.238  -5.529  -2.064
  302   2HG1  ILE  35          HG12      ILE  35   2.024  -5.518  -0.315
  303   1HG2  ILE  35          HG21      ILE  35   5.480  -3.314  -1.231
  304   2HG2  ILE  35          HG22      ILE  35   3.833  -2.688  -1.281
  305   3HG2  ILE  35          HG23      ILE  35   4.478  -3.582  -2.658
  306   1HD1  ILE  35          HD11      ILE  35   1.901  -3.040  -0.378
  307   2HD1  ILE  35          HD12      ILE  35   0.622  -3.816  -1.312
  308   3HD1  ILE  35          HD13      ILE  35   2.009  -3.108  -2.138
  309    H    PHE  36           HN       PHE  36   2.949  -7.779  -1.514
  310    HA   PHE  36           HA       PHE  36   3.162  -8.907   0.991
  311   1HB   PHE  36          HB1       PHE  36   2.136 -10.158  -1.561
  312   2HB   PHE  36          HB2       PHE  36   1.906 -10.844   0.047
  313    HD1  PHE  36           HD1      PHE  36   1.163  -8.765   1.783
  314    HD2  PHE  36           HD2      PHE  36   0.178  -9.207  -2.381
  315    HE1  PHE  36           HE1      PHE  36  -0.832  -7.316   2.109
  316    HE2  PHE  36           HE2      PHE  36  -1.819  -7.758  -2.059
  317    HZ   PHE  36           HZ       PHE  36  -2.319  -6.803   0.183
  318    H    GLY  37           HN       GLY  37   4.741  -9.858   1.926
  319   1HA   GLY  37          HA1       GLY  37   6.104 -11.760   2.330
  320   2HA   GLY  37          HA2       GLY  37   6.391 -11.895   0.606
  321    H    ARG  38           HN       ARG  38   6.782  -8.716   0.968
  322    HA   ARG  38           HA       ARG  38   9.670  -8.871   1.524
  323   1HB   ARG  38          HB1       ARG  38   7.990  -7.065  -0.223
  324   2HB   ARG  38          HB2       ARG  38   9.614  -6.603   0.263
  325   1HG   ARG  38          HG1       ARG  38  10.606  -8.330  -0.967
  326   2HG   ARG  38          HG2       ARG  38   9.095  -9.232  -1.090
  327   1HD   ARG  38          HD1       ARG  38   9.371  -8.295  -3.230
  328   2HD   ARG  38          HD2       ARG  38   8.225  -7.214  -2.436
  329    HE   ARG  38           HE       ARG  38  10.112  -6.465  -1.703
  330   1HH1  ARG  38          HH21      ARG  38   9.571  -7.253  -5.014
  331   2HH1  ARG  38          HH22      ARG  38  10.155  -5.786  -5.614
  332   1HH2  ARG  38          HH11      ARG  38  11.689  -4.494  -3.019
  333   2HH2  ARG  38          HH12      ARG  38  11.854  -4.931  -4.664
  334    H    HIS  39           HN       HIS  39  10.542  -6.732   2.378
  335    HA   HIS  39           HA       HIS  39   8.981  -6.017   4.746
  336   1HB   HIS  39          HB1       HIS  39  11.870  -5.310   4.186
  337   2HB   HIS  39          HB2       HIS  39  11.052  -5.382   5.749
  338    HD2  HIS  39           HD2      HIS  39  10.553  -7.829   6.797
  339    HE1  HIS  39           HE1      HIS  39  12.897 -10.061   4.035
  340    HE2  HIS  39           HE2      HIS  39  11.558 -10.167   6.191
  341    H    SER  40           HN       SER  40   9.018  -3.699   5.455
  342    HA   SER  40           HA       SER  40   8.208  -1.957   3.394
  343   1HB   SER  40          HB1       SER  40   9.076  -0.751   5.971
  344   2HB   SER  40          HB2       SER  40   7.653  -0.416   4.996
  345    HG   SER  40           HG       SER  40   6.932  -2.572   5.735
  346    H    GLY  41           HN       GLY  41   9.225  -0.463   2.227
  347   1HA   GLY  41          HA1       GLY  41  10.895   1.096   1.694
  348   2HA   GLY  41          HA2       GLY  41  11.899   0.443   2.966
  349    H    GLN  42           HN       GLN  42  10.531  -1.338   0.107
  350    HA   GLN  42           HA       GLN  42  13.308  -1.747  -0.746
  351   1HB   GLN  42          HB1       GLN  42  11.188  -3.881  -0.780
  352   2HB   GLN  42          HB2       GLN  42  12.851  -4.063  -1.326
  353   1HG   GLN  42          HG1       GLN  42  13.639  -3.554   0.962
  354   2HG   GLN  42          HG2       GLN  42  11.965  -3.441   1.497
  355   1HE2  GLN  42          HE21      GLN  42  14.093  -5.306   2.378
  356   2HE2  GLN  42          HE22      GLN  42  13.471  -6.887   2.078
  357    H    ALA  43           HN       ALA  43  10.939  -0.034  -1.992
  358    HA   ALA  43           HA       ALA  43  10.284  -0.952  -4.494
  359   1HB   ALA  43          HB1       ALA  43  10.938   1.912  -3.842
  360   2HB   ALA  43          HB2       ALA  43   9.438   1.098  -3.400
  361   3HB   ALA  43          HB3       ALA  43   9.851   1.322  -5.099
  362    H    GLU  44           HN       GLU  44  11.224  -1.289  -6.401
  363    HA   GLU  44           HA       GLU  44  14.044  -1.137  -6.715
  364   1HB   GLU  44          HB1       GLU  44  12.170  -1.940  -8.937
  365   2HB   GLU  44          HB2       GLU  44  13.795  -2.524  -8.592
  366   1HG   GLU  44          HG1       GLU  44  12.591  -4.311  -7.826
  367   2HG   GLU  44          HG2       GLU  44  12.686  -3.368  -6.352
  368    H    GLY  45           HN       GLY  45  14.201   1.212  -6.449
  369   1HA   GLY  45          HA1       GLY  45  15.359   2.793  -7.984
  370   2HA   GLY  45          HA2       GLY  45  13.928   2.704  -8.987
  371    H    TYR  46           HN       TYR  46  13.251   2.824  -5.618
  372    HA   TYR  46           HA       TYR  46  12.923   5.722  -5.587
  373   1HB   TYR  46          HB1       TYR  46  10.832   4.782  -6.375
  374   2HB   TYR  46          HB2       TYR  46  10.732   3.756  -4.951
  375    HD1  TYR  46           HD1      TYR  46  10.103   7.058  -6.339
  376    HD2  TYR  46           HD2      TYR  46  10.435   4.809  -2.695
  377    HE1  TYR  46           HE1      TYR  46   8.769   8.800  -5.158
  378    HE2  TYR  46           HE2      TYR  46   9.008   6.481  -1.521
  379    HH   TYR  46           HH       TYR  46   7.264   8.928  -3.234
  380    H    SER  47           HN       SER  47  13.322   6.729  -3.712
  381    HA   SER  47           HA       SER  47  14.405   5.221  -1.490
  382   1HB   SER  47          HB1       SER  47  14.477   7.992  -0.920
  383   2HB   SER  47          HB2       SER  47  15.814   6.947  -1.407
  384    HG   SER  47           HG       SER  47  15.776   7.853  -3.295
  385    H    TYR  48           HN       TYR  48  13.716   5.208   0.545
  386    HA   TYR  48           HA       TYR  48  11.062   6.175   1.300
  387   1HB   TYR  48          HB1       TYR  48  12.769   3.840   2.162
  388   2HB   TYR  48          HB2       TYR  48  11.292   4.301   3.004
  389    HD1  TYR  48           HD1      TYR  48   9.109   4.095   1.933
  390    HD2  TYR  48           HD2      TYR  48  12.693   2.792  -0.054
  391    HE1  TYR  48           HE1      TYR  48   7.742   2.684   0.410
  392    HE2  TYR  48           HE2      TYR  48  11.337   1.377  -1.582
  393    HH   TYR  48           HH       TYR  48   8.338   0.360  -0.871
  394    H    THR  49           HN       THR  49  10.778   6.836   3.663
  395    HA   THR  49           HA       THR  49  12.719   8.729   4.560
  396    HB   THR  49           HB       THR  49  11.197   8.702   6.676
  397    HG1  THR  49           HG1      THR  49   9.275   7.733   4.897
  398   1HG2  THR  49          HG21      THR  49   9.700  10.269   5.664
  399   2HG2  THR  49          HG22      THR  49  10.057   9.638   4.056
  400   3HG2  THR  49          HG23      THR  49  11.308  10.483   4.970
  401    H    ASP  50           HN       ASP  50  13.425   8.844   6.877
  402    HA   ASP  50           HA       ASP  50  15.157   6.799   7.584
  403   1HB   ASP  50          HB1       ASP  50  15.454   9.108   8.264
  404   2HB   ASP  50          HB2       ASP  50  13.983   9.050   9.231
  405    H    ALA  51           HN       ALA  51  11.821   7.302   8.571
  406    HA   ALA  51           HA       ALA  51  11.879   5.366  10.698
  407   1HB   ALA  51          HB1       ALA  51   9.456   6.780   9.618
  408   2HB   ALA  51          HB2       ALA  51  10.617   7.570  10.685
  409   3HB   ALA  51          HB3       ALA  51   9.731   6.152  11.244
  410    H    ASN  52           HN       ASN  52  10.667   5.364   7.325
  411    HA   ASN  52           HA       ASN  52   9.092   3.007   7.643
  412   1HB   ASN  52          HB1       ASN  52   8.360   4.325   5.894
  413   2HB   ASN  52          HB2       ASN  52   9.989   4.691   5.341
  414   1HD2  ASN  52          HD21      ASN  52   7.303   2.504   5.009
  415   2HD2  ASN  52          HD22      ASN  52   7.993   1.660   3.671
  416    H    ILE  53           HN       ILE  53  12.434   3.562   6.651
  417    HA   ILE  53           HA       ILE  53  13.015   0.902   5.878
  418    HB   ILE  53           HB       ILE  53  14.791   3.163   6.745
  419   1HG1  ILE  53          HG11      ILE  53  14.294   2.039   3.968
  420   2HG1  ILE  53          HG12      ILE  53  13.429   3.426   4.625
  421   1HG2  ILE  53          HG21      ILE  53  15.584   0.506   5.524
  422   2HG2  ILE  53          HG22      ILE  53  16.031   1.111   7.119
  423   3HG2  ILE  53          HG23      ILE  53  16.657   1.899   5.672
  424   1HD1  ILE  53          HD11      ILE  53  15.483   4.700   4.760
  425   2HD1  ILE  53          HD12      ILE  53  15.300   4.059   3.128
  426   3HD1  ILE  53          HD13      ILE  53  16.425   3.299   4.252
  427    H    LYS  54           HN       LYS  54  14.332   2.510   8.831
  428    HA   LYS  54           HA       LYS  54  14.970   0.457  10.419
  429   1HB   LYS  54          HB1       LYS  54  13.445   2.940  11.198
  430   2HB   LYS  54          HB2       LYS  54  14.230   1.859  12.352
  431   1HG   LYS  54          HG1       LYS  54  16.394   2.280  11.386
  432   2HG   LYS  54          HG2       LYS  54  15.675   3.201  10.062
  433   1HD   LYS  54          HD1       LYS  54  14.834   4.852  11.730
  434   2HD   LYS  54          HD2       LYS  54  15.700   3.961  12.991
  435   1HE   LYS  54          HE1       LYS  54  17.818   4.413  11.975
  436   2HE   LYS  54          HE2       LYS  54  17.050   5.044  10.515
  437   1HZ   LYS  54          HZ1       LYS  54  17.034   6.275  13.208
  438   2HZ   LYS  54          HZ2       LYS  54  16.090   6.821  11.909
  439   3HZ   LYS  54          HZ3       LYS  54  17.779   6.870  11.806
  440    H    LYS  55           HN       LYS  55  11.782   0.900   9.277
  441    HA   LYS  55           HA       LYS  55  10.448  -0.552  11.411
  442   1HB   LYS  55          HB1       LYS  55   9.448   1.420  10.350
  443   2HB   LYS  55          HB2       LYS  55   9.396   0.578   8.819
  444   1HG   LYS  55          HG1       LYS  55   7.219   0.508   9.578
  445   2HG   LYS  55          HG2       LYS  55   7.847  -1.082   9.972
  446   1HD   LYS  55          HD1       LYS  55   7.794   1.123  12.017
  447   2HD   LYS  55          HD2       LYS  55   6.366   0.142  11.694
  448   1HE   LYS  55          HE1       LYS  55   9.063  -0.860  12.629
  449   2HE   LYS  55          HE2       LYS  55   7.590  -0.759  13.595
  450   1HZ   LYS  55          HZ1       LYS  55   6.563  -2.332  11.985
  451   2HZ   LYS  55          HZ2       LYS  55   7.846  -2.993  12.862
  452   3HZ   LYS  55          HZ3       LYS  55   8.084  -2.521  11.258
  453    H    ASN  56           HN       ASN  56  11.413  -1.211   8.107
  454    HA   ASN  56           HA       ASN  56  10.996  -2.918   6.649
  455   1HB   ASN  56          HB1       ASN  56  13.093  -3.310   8.525
  456   2HB   ASN  56          HB2       ASN  56  12.436  -4.882   8.125
  457   1HD2  ASN  56          HD21      ASN  56  12.465  -2.353   5.644
  458   2HD2  ASN  56          HD22      ASN  56  13.527  -3.370   4.772
  459    H    VAL  57           HN       VAL  57   8.579  -2.880   7.870
  460    HA   VAL  57           HA       VAL  57   7.904  -5.343   9.141
  461    HB   VAL  57           HB       VAL  57   6.661  -2.891   8.839
  462   1HG1  VAL  57          HG11      VAL  57   4.863  -4.967   7.589
  463   2HG1  VAL  57          HG12      VAL  57   5.482  -3.523   6.788
  464   3HG1  VAL  57          HG13      VAL  57   4.369  -3.369   8.148
  465   1HG2  VAL  57          HG21      VAL  57   6.729  -4.370  10.768
  466   2HG2  VAL  57          HG22      VAL  57   5.598  -5.466   9.974
  467   3HG2  VAL  57          HG23      VAL  57   5.083  -3.840  10.419
  468    H    LEU  58           HN       LEU  58   7.199  -7.244   8.281
  469    HA   LEU  58           HA       LEU  58   7.483  -7.565   5.427
  470   1HB   LEU  58          HB1       LEU  58   8.371  -9.214   7.118
  471   2HB   LEU  58          HB2       LEU  58   6.706  -9.675   7.446
  472    HG   LEU  58           HG       LEU  58   7.572  -9.733   4.591
  473   1HD1  LEU  58          HD11      LEU  58   9.475 -10.732   5.866
  474   2HD1  LEU  58          HD12      LEU  58   8.655 -11.873   4.801
  475   3HD1  LEU  58          HD13      LEU  58   8.347 -11.913   6.537
  476   1HD2  LEU  58          HD21      LEU  58   5.909 -11.600   6.298
  477   2HD2  LEU  58          HD22      LEU  58   6.214 -11.798   4.573
  478   3HD2  LEU  58          HD23      LEU  58   5.294 -10.410   5.151
  479    H    TRP  59           HN       TRP  59   5.875  -6.674   4.318
  480    HA   TRP  59           HA       TRP  59   3.232  -6.318   5.071
  481   1HB   TRP  59          HB1       TRP  59   4.366  -6.622   2.291
  482   2HB   TRP  59          HB2       TRP  59   2.800  -5.935   2.677
  483    HD1  TRP  59           HD1      TRP  59   6.027  -4.858   1.666
  484    HE1  TRP  59           HE1      TRP  59   6.507  -2.423   2.366
  485    HE3  TRP  59           HE3      TRP  59   2.259  -4.156   5.052
  486    HZ2  TRP  59           HZ2      TRP  59   5.536  -0.488   4.235
  487    HZ3  TRP  59           HZ3      TRP  59   2.045  -2.009   6.244
  488    HH2  TRP  59           HH2      TRP  59   3.652  -0.176   5.854
  489    H    ASP  60           HN       ASP  60   1.776  -7.731   5.500
  490    HA   ASP  60           HA       ASP  60   1.422 -10.242   4.042
  491   1HB   ASP  60          HB1       ASP  60   1.954 -11.263   5.963
  492   2HB   ASP  60          HB2       ASP  60   1.983  -9.740   6.833
  493    H    GLU  61           HN       GLU  61  -0.967 -11.044   5.004
  494    HA   GLU  61           HA       GLU  61  -2.831  -9.424   3.607
  495   1HB   GLU  61          HB1       GLU  61  -2.800 -12.046   4.240
  496   2HB   GLU  61          HB2       GLU  61  -3.864 -11.462   5.516
  497   1HG   GLU  61          HG1       GLU  61  -5.448 -11.866   3.932
  498   2HG   GLU  61          HG2       GLU  61  -5.014 -10.227   3.439
  499    H    ASN  62           HN       ASN  62  -2.693 -10.249   7.096
  500    HA   ASN  62           HA       ASN  62  -4.508  -8.175   7.839
  501   1HB   ASN  62          HB1       ASN  62  -4.428 -10.229   9.081
  502   2HB   ASN  62          HB2       ASN  62  -2.721 -10.022   9.428
  503   1HD2  ASN  62          HD21      ASN  62  -2.106  -8.502  11.000
  504   2HD2  ASN  62          HD22      ASN  62  -3.245  -7.866  12.132
  505    H    ASN  63           HN       ASN  63  -0.929  -8.477   8.166
  506    HA   ASN  63           HA       ASN  63  -0.395  -6.130   9.493
  507   1HB   ASN  63          HB1       ASN  63   1.351  -7.639   9.264
  508   2HB   ASN  63          HB2       ASN  63   1.144  -7.782   7.529
  509   1HD2  ASN  63          HD21      ASN  63   2.349  -5.571  10.066
  510   2HD2  ASN  63          HD22      ASN  63   3.204  -4.663   8.869
  511    H    MET  64           HN       MET  64  -0.730  -6.342   5.880
  512    HA   MET  64           HA       MET  64  -0.069  -3.709   5.307
  513   1HB   MET  64          HB1       MET  64  -0.412  -5.422   3.608
  514   2HB   MET  64          HB2       MET  64  -2.137  -5.435   3.946
  515   1HG   MET  64          HG1       MET  64  -2.204  -3.031   3.266
  516   2HG   MET  64          HG2       MET  64  -0.531  -3.182   2.764
  517   1HE   MET  64          HE1       MET  64  -4.025  -5.469   0.778
  518   2HE   MET  64          HE2       MET  64  -4.287  -4.239   2.015
  519   3HE   MET  64          HE3       MET  64  -3.459  -5.741   2.428
  520    H    SER  65           HN       SER  65  -3.196  -4.898   6.523
  521    HA   SER  65           HA       SER  65  -4.573  -2.426   6.318
  522   1HB   SER  65          HB1       SER  65  -5.275  -4.571   8.302
  523   2HB   SER  65          HB2       SER  65  -6.343  -3.441   7.480
  524    HG   SER  65           HG       SER  65  -5.108  -5.764   6.499
  525    H    GLU  66           HN       GLU  66  -2.627  -3.825   8.916
  526    HA   GLU  66           HA       GLU  66  -3.266  -2.160  11.035
  527   1HB   GLU  66          HB1       GLU  66  -1.589  -3.282  12.056
  528   2HB   GLU  66          HB2       GLU  66  -1.486  -4.198  10.555
  529   1HG   GLU  66          HG1       GLU  66   0.200  -2.538   9.738
  530   2HG   GLU  66          HG2       GLU  66   0.181  -1.811  11.345
  531    H    TYR  67           HN       TYR  67  -1.079  -1.608   8.346
  532    HA   TYR  67           HA       TYR  67  -0.246   1.031   9.188
  533   1HB   TYR  67          HB1       TYR  67   1.453  -0.262   8.238
  534   2HB   TYR  67          HB2       TYR  67   0.429  -0.817   6.928
  535    HD1  TYR  67           HD1      TYR  67   0.270   0.402   4.863
  536    HD2  TYR  67           HD2      TYR  67   2.374   2.042   8.230
  537    HE1  TYR  67           HE1      TYR  67   1.376   2.051   3.360
  538    HE2  TYR  67           HE2      TYR  67   3.529   3.663   6.740
  539    HH   TYR  67           HH       TYR  67   2.675   4.023   3.362
  540    H    LEU  68           HN       LEU  68  -2.269  -0.314   6.507
  541    HA   LEU  68           HA       LEU  68  -2.637   2.089   5.147
  542   1HB   LEU  68          HB1       LEU  68  -4.426  -0.311   5.406
  543   2HB   LEU  68          HB2       LEU  68  -4.797   1.039   4.349
  544    HG   LEU  68           HG       LEU  68  -2.518  -0.925   4.122
  545   1HD1  LEU  68          HD11      LEU  68  -4.748   0.006   2.296
  546   2HD1  LEU  68          HD12      LEU  68  -4.702  -1.516   3.185
  547   3HD1  LEU  68          HD13      LEU  68  -3.541  -1.214   1.893
  548   1HD2  LEU  68          HD21      LEU  68  -1.623   1.384   3.695
  549   2HD2  LEU  68          HD22      LEU  68  -2.869   1.591   2.464
  550   3HD2  LEU  68          HD23      LEU  68  -1.627   0.356   2.261
  551    H    THR  69           HN       THR  69  -4.527   0.916   7.955
  552    HA   THR  69           HA       THR  69  -6.586   2.803   7.851
  553    HB   THR  69           HB       THR  69  -5.544   1.854  10.485
  554    HG1  THR  69           HG1      THR  69  -5.516  -0.013   9.349
  555   1HG2  THR  69          HG21      THR  69  -7.596   3.253  10.425
  556   2HG2  THR  69          HG22      THR  69  -7.912   1.619  11.009
  557   3HG2  THR  69          HG23      THR  69  -8.346   2.064   9.359
  558    H    ASN  70           HN       ASN  70  -3.289   3.195   8.996
  559    HA   ASN  70           HA       ASN  70  -3.512   6.020   8.915
  560   1HB   ASN  70          HB1       ASN  70  -4.547   5.364  11.186
  561   2HB   ASN  70          HB2       ASN  70  -2.897   5.012  11.686
  562   1HD2  ASN  70          HD21      ASN  70  -4.661   7.047  12.757
  563   2HD2  ASN  70          HD22      ASN  70  -3.663   8.448  12.590
  564    HA   PRO  71           HA       PRO  71   0.686   4.347   7.902
  565   1HB   PRO  71          HB1       PRO  71   1.226   6.419   6.170
  566   2HB   PRO  71          HB2       PRO  71   0.454   4.900   5.707
  567   1HG   PRO  71          HG1       PRO  71  -0.796   7.545   6.339
  568   2HG   PRO  71          HG2       PRO  71  -1.194   6.399   5.045
  569   1HD   PRO  71          HD1       PRO  71  -2.685   6.565   7.261
  570   2HD   PRO  71          HD2       PRO  71  -2.372   5.001   6.477
  571    H    LYS  72           HN       LYS  72  -0.073   7.802   8.355
  572    HA   LYS  72           HA       LYS  72   2.467   8.663   9.155
  573   1HB   LYS  72          HB1       LYS  72  -0.241   9.849   9.775
  574   2HB   LYS  72          HB2       LYS  72   1.288  10.659  10.070
  575   1HG   LYS  72          HG1       LYS  72   1.606  10.148   7.471
  576   2HG   LYS  72          HG2       LYS  72  -0.153  10.180   7.522
  577   1HD   LYS  72          HD1       LYS  72   0.178  12.390   7.129
  578   2HD   LYS  72          HD2       LYS  72   0.370  12.443   8.882
  579   1HE   LYS  72          HE1       LYS  72   2.186  13.660   7.932
  580   2HE   LYS  72          HE2       LYS  72   2.831  12.146   8.546
  581   1HZ   LYS  72          HZ1       LYS  72   3.004  11.297   6.353
  582   2HZ   LYS  72          HZ2       LYS  72   3.684  12.843   6.336
  583   3HZ   LYS  72          HZ3       LYS  72   2.138  12.605   5.703
  584    H    LYS  73           HN       LYS  73  -0.174   7.307  11.060
  585    HA   LYS  73           HA       LYS  73   1.056   7.918  13.574
  586   1HB   LYS  73          HB1       LYS  73  -1.364   7.688  13.412
  587   2HB   LYS  73          HB2       LYS  73  -1.193   6.004  12.941
  588   1HG   LYS  73          HG1       LYS  73  -1.843   6.240  15.297
  589   2HG   LYS  73          HG2       LYS  73  -0.287   5.440  15.122
  590   1HD   LYS  73          HD1       LYS  73   0.500   8.033  15.415
  591   2HD   LYS  73          HD2       LYS  73  -0.966   8.020  16.392
  592   1HE   LYS  73          HE1       LYS  73   0.605   7.425  17.966
  593   2HE   LYS  73          HE2       LYS  73   0.090   5.838  17.405
  594   1HZ   LYS  73          HZ1       LYS  73   2.412   5.780  17.458
  595   2HZ   LYS  73          HZ2       LYS  73   2.569   7.294  16.726
  596   3HZ   LYS  73          HZ3       LYS  73   2.027   5.976  15.819
  597    H    TYR  74           HN       TYR  74   1.029   5.040  11.508
  598    HA   TYR  74           HA       TYR  74   2.480   3.371  13.296
  599   1HB   TYR  74          HB1       TYR  74   1.022   2.582  11.442
  600   2HB   TYR  74          HB2       TYR  74   2.237   3.146  10.297
  601    HD1  TYR  74           HD1      TYR  74   3.612   1.440   9.421
  602    HD2  TYR  74           HD2      TYR  74   2.195   1.220  13.474
  603    HE1  TYR  74           HE1      TYR  74   4.776  -0.751   9.708
  604    HE2  TYR  74           HE2      TYR  74   3.338  -0.960  13.773
  605    HH   TYR  74           HH       TYR  74   4.043  -2.914  11.965
  606    H    ILE  75           HN       ILE  75   3.505   5.130  10.399
  607    HA   ILE  75           HA       ILE  75   6.324   4.925  11.210
  608    HB   ILE  75           HB       ILE  75   5.187   5.342   8.433
  609   1HG1  ILE  75          HG11      ILE  75   6.559   2.938   9.693
  610   2HG1  ILE  75          HG12      ILE  75   4.886   3.015   9.159
  611   1HG2  ILE  75          HG21      ILE  75   7.287   6.521   8.707
  612   2HG2  ILE  75          HG22      ILE  75   7.577   5.077   7.738
  613   3HG2  ILE  75          HG23      ILE  75   8.035   5.102   9.440
  614   1HD1  ILE  75          HD11      ILE  75   5.682   3.265   6.821
  615   2HD1  ILE  75          HD12      ILE  75   6.200   1.754   7.568
  616   3HD1  ILE  75          HD13      ILE  75   7.340   3.088   7.396
  617    HA   PRO  76           HA       PRO  76   5.349   9.266  12.160
  618   1HB   PRO  76          HB1       PRO  76   7.588   9.645  13.673
  619   2HB   PRO  76          HB2       PRO  76   6.098   8.925  14.292
  620   1HG   PRO  76          HG1       PRO  76   8.609   7.588  13.367
  621   2HG   PRO  76          HG2       PRO  76   7.589   7.211  14.768
  622   1HD   PRO  76          HD1       PRO  76   7.481   5.788  12.473
  623   2HD   PRO  76          HD2       PRO  76   6.055   6.049  13.497
  624    H    GLY  77           HN       GLY  77   5.706  10.620  10.497
  625   1HA   GLY  77          HA1       GLY  77   7.049  12.284   9.488
  626   2HA   GLY  77          HA2       GLY  77   8.462  11.283   9.755
  627    H    THR  78           HN       THR  78   6.142   9.258   8.509
  628    HA   THR  78           HA       THR  78   7.405   8.767   6.072
  629    HB   THR  78           HB       THR  78   5.782   7.336   7.493
  630    HG1  THR  78           HG1      THR  78   6.715   7.099   5.106
  631   1HG2  THR  78          HG21      THR  78   3.569   7.011   6.385
  632   2HG2  THR  78          HG22      THR  78   3.813   8.552   5.561
  633   3HG2  THR  78          HG23      THR  78   3.704   8.500   7.321
  634    H    LYS  79           HN       LYS  79   6.949   9.194   3.952
  635    HA   LYS  79           HA       LYS  79   5.857  11.732   3.298
  636   1HB   LYS  79          HB1       LYS  79   6.428   9.472   1.386
  637   2HB   LYS  79          HB2       LYS  79   6.402  11.191   1.030
  638   1HG   LYS  79          HG1       LYS  79   8.393  11.428   2.573
  639   2HG   LYS  79          HG2       LYS  79   8.473   9.658   2.592
  640   1HD   LYS  79          HD1       LYS  79   8.207  10.258  -0.105
  641   2HD   LYS  79          HD2       LYS  79   9.278  11.532   0.493
  642   1HE   LYS  79          HE1       LYS  79  10.814   9.878   0.001
  643   2HE   LYS  79          HE2       LYS  79  10.483   9.530   1.698
  644   1HZ   LYS  79          HZ1       LYS  79   8.824   8.223  -0.328
  645   2HZ   LYS  79          HZ2       LYS  79   9.320   7.660   1.185
  646   3HZ   LYS  79          HZ3       LYS  79  10.407   7.660  -0.107
  647    H    MET  80           HN       MET  80   4.318   8.540   3.375
  648    HA   MET  80           HA       MET  80   2.211   9.213   1.597
  649   1HB   MET  80          HB1       MET  80   2.506   6.945   1.648
  650   2HB   MET  80          HB2       MET  80   2.794   6.906   3.391
  651   1HG   MET  80          HG1       MET  80   0.559   7.002   3.912
  652   2HG   MET  80          HG2       MET  80   0.122   7.752   2.388
  653   1HE   MET  80          HE1       MET  80  -2.075   4.584   2.324
  654   2HE   MET  80          HE2       MET  80  -2.001   6.346   2.360
  655   3HE   MET  80          HE3       MET  80  -1.612   5.418   3.807
  656    H    ALA  81           HN       ALA  81   1.158  10.979   2.060
  657    HA   ALA  81           HA       ALA  81  -0.035  11.415   4.678
  658   1HB   ALA  81          HB1       ALA  81   1.462  13.126   3.832
  659   2HB   ALA  81          HB2       ALA  81  -0.173  13.746   4.059
  660   3HB   ALA  81          HB3       ALA  81   0.408  13.368   2.438
  661    H    PHE  82           HN       PHE  82  -1.242   9.621   2.866
  662    HA   PHE  82           HA       PHE  82  -3.590  10.525   1.638
  663   1HB   PHE  82          HB1       PHE  82  -2.574   8.601   0.772
  664   2HB   PHE  82          HB2       PHE  82  -2.507   7.817   2.345
  665    HD1  PHE  82           HD1      PHE  82  -4.921   9.029  -0.254
  666    HD2  PHE  82           HD2      PHE  82  -4.169   6.307   2.993
  667    HE1  PHE  82           HE1      PHE  82  -7.128   7.948  -0.646
  668    HE2  PHE  82           HE2      PHE  82  -6.378   5.237   2.610
  669    HZ   PHE  82           HZ       PHE  82  -7.866   6.071   0.803
  670    H    GLY  83           HN       GLY  83  -3.054  10.000   5.000
  671   1HA   GLY  83          HA1       GLY  83  -4.600  10.480   6.692
  672   2HA   GLY  83          HA2       GLY  83  -5.885  10.439   5.505
  673    H    GLY  84           HN       GLY  84  -5.441   7.783   4.534
  674   1HA   GLY  84          HA1       GLY  84  -5.511   5.517   5.078
  675   2HA   GLY  84          HA2       GLY  84  -5.533   5.937   6.781
  676    H    LEU  85           HN       LEU  85  -7.296   4.505   4.479
  677    HA   LEU  85           HA       LEU  85  -9.934   5.514   4.892
  678   1HB   LEU  85          HB1       LEU  85 -10.130   2.905   3.897
  679   2HB   LEU  85          HB2       LEU  85 -10.240   4.403   2.997
  680    HG   LEU  85           HG       LEU  85  -7.619   4.211   2.888
  681   1HD1  LEU  85          HD11      LEU  85  -6.740   2.020   3.058
  682   2HD1  LEU  85          HD12      LEU  85  -8.347   1.297   3.151
  683   3HD1  LEU  85          HD13      LEU  85  -7.723   2.236   4.507
  684   1HD2  LEU  85          HD21      LEU  85  -8.967   4.035   0.866
  685   2HD2  LEU  85          HD22      LEU  85  -9.427   2.385   1.283
  686   3HD2  LEU  85          HD23      LEU  85  -7.752   2.757   0.876
  687    H    LYS  86           HN       LYS  86 -10.625   5.463   6.849
  688    HA   LYS  86           HA       LYS  86 -10.262   3.540   8.868
  689   1HB   LYS  86          HB1       LYS  86 -12.395   5.674   8.734
  690   2HB   LYS  86          HB2       LYS  86 -11.731   4.918  10.177
  691   1HG   LYS  86          HG1       LYS  86 -10.018   6.524   8.286
  692   2HG   LYS  86          HG2       LYS  86 -10.904   7.268   9.619
  693   1HD   LYS  86          HD1       LYS  86  -9.726   5.821  11.218
  694   2HD   LYS  86          HD2       LYS  86  -8.855   5.053   9.893
  695   1HE   LYS  86          HE1       LYS  86  -8.701   8.018  10.419
  696   2HE   LYS  86          HE2       LYS  86  -7.617   6.869  11.198
  697   1HZ   LYS  86          HZ1       LYS  86  -7.923   7.102   8.257
  698   2HZ   LYS  86          HZ2       LYS  86  -6.750   6.224   9.100
  699   3HZ   LYS  86          HZ3       LYS  86  -6.729   7.913   9.146
  700    H    LYS  87           HN       LYS  87 -12.412   3.487   6.241
  701    HA   LYS  87           HA       LYS  87 -14.605   2.056   7.435
  702   1HB   LYS  87          HB1       LYS  87 -13.892   2.206   4.523
  703   2HB   LYS  87          HB2       LYS  87 -15.456   1.879   5.219
  704   1HG   LYS  87          HG1       LYS  87 -15.578   4.298   5.926
  705   2HG   LYS  87          HG2       LYS  87 -14.068   4.564   5.001
  706   1HD   LYS  87          HD1       LYS  87 -15.255   3.080   3.237
  707   2HD   LYS  87          HD2       LYS  87 -16.712   3.522   4.058
  708   1HE   LYS  87          HE1       LYS  87 -16.750   5.605   3.078
  709   2HE   LYS  87          HE2       LYS  87 -14.996   5.615   2.791
  710   1HZ   LYS  87          HZ1       LYS  87 -15.257   3.786   1.237
  711   2HZ   LYS  87          HZ2       LYS  87 -16.200   5.095   0.742
  712   3HZ   LYS  87          HZ3       LYS  87 -16.935   3.764   1.491
  713    H    GLU  88           HN       GLU  88 -14.376  -0.017   8.041
  714    HA   GLU  88           HA       GLU  88 -12.428  -1.843   7.313
  715   1HB   GLU  88          HB1       GLU  88 -13.899  -1.927   9.314
  716   2HB   GLU  88          HB2       GLU  88 -15.210  -2.483   8.278
  717   1HG   GLU  88          HG1       GLU  88 -14.481  -4.546   8.851
  718   2HG   GLU  88          HG2       GLU  88 -13.241  -4.256   7.623
  719    H    LYS  89           HN       LYS  89 -15.780  -1.770   6.010
  720    HA   LYS  89           HA       LYS  89 -15.588  -4.022   4.395
  721   1HB   LYS  89          HB1       LYS  89 -17.260  -1.658   3.604
  722   2HB   LYS  89          HB2       LYS  89 -17.634  -3.375   3.492
  723   1HG   LYS  89          HG1       LYS  89 -17.202  -2.136   6.177
  724   2HG   LYS  89          HG2       LYS  89 -18.741  -1.914   5.357
  725   1HD   LYS  89          HD1       LYS  89 -19.077  -3.784   6.749
  726   2HD   LYS  89          HD2       LYS  89 -18.773  -4.489   5.153
  727   1HE   LYS  89          HE1       LYS  89 -16.548  -5.060   5.702
  728   2HE   LYS  89          HE2       LYS  89 -16.535  -4.002   7.112
  729   1HZ   LYS  89          HZ1       LYS  89 -16.698  -6.332   7.735
  730   2HZ   LYS  89          HZ2       LYS  89 -18.124  -6.494   6.846
  731   3HZ   LYS  89          HZ3       LYS  89 -18.091  -5.485   8.200
  732    H    ASP  90           HN       ASP  90 -14.850  -0.716   3.686
  733    HA   ASP  90           HA       ASP  90 -14.190  -0.740   1.028
  734   1HB   ASP  90          HB1       ASP  90 -13.840   0.928   3.399
  735   2HB   ASP  90          HB2       ASP  90 -12.556   1.146   2.224
  736    H    ARG  91           HN       ARG  91 -11.965  -1.344   3.832
  737    HA   ARG  91           HA       ARG  91  -9.719  -1.879   2.147
  738   1HB   ARG  91          HB1       ARG  91  -9.901  -2.922   4.969
  739   2HB   ARG  91          HB2       ARG  91  -8.463  -2.502   4.045
  740   1HG   ARG  91          HG1       ARG  91  -8.851  -0.196   4.276
  741   2HG   ARG  91          HG2       ARG  91 -10.512  -0.438   4.789
  742   1HD   ARG  91          HD1       ARG  91  -8.052  -0.345   6.354
  743   2HD   ARG  91          HD2       ARG  91  -9.714  -0.069   6.850
  744    HE   ARG  91           HE       ARG  91  -8.375  -2.121   6.305
  745   1HH1  ARG  91          HH21      ARG  91 -10.697  -0.713   8.472
  746   2HH1  ARG  91          HH22      ARG  91 -11.137  -2.048   9.481
  747   1HH2  ARG  91          HH11      ARG  91  -9.049  -4.300   7.948
  748   2HH2  ARG  91          HH12      ARG  91 -10.265  -4.067   9.153
  749    H    ASN  92           HN       ASN  92 -12.191  -3.976   3.563
  750    HA   ASN  92           HA       ASN  92 -11.130  -6.460   3.285
  751   1HB   ASN  92          HB1       ASN  92 -13.937  -5.484   2.794
  752   2HB   ASN  92          HB2       ASN  92 -13.524  -7.190   2.722
  753   1HD2  ASN  92          HD21      ASN  92 -15.259  -7.057   4.441
  754   2HD2  ASN  92          HD22      ASN  92 -14.548  -7.070   6.017
  755    H    ASP  93           HN       ASP  93 -12.885  -4.827   0.602
  756    HA   ASP  93           HA       ASP  93 -12.164  -6.729  -1.367
  757   1HB   ASP  93          HB1       ASP  93 -13.842  -4.475  -1.231
  758   2HB   ASP  93          HB2       ASP  93 -12.695  -4.138  -2.518
  759    H    LEU  94           HN       LEU  94 -10.603  -3.623  -0.425
  760    HA   LEU  94           HA       LEU  94  -8.792  -3.344  -2.463
  761   1HB   LEU  94          HB1       LEU  94  -9.182  -2.327   0.251
  762   2HB   LEU  94          HB2       LEU  94  -7.530  -2.373  -0.241
  763    HG   LEU  94           HG       LEU  94  -9.604  -1.097  -1.994
  764   1HD1  LEU  94          HD11      LEU  94  -9.577  -0.185   0.385
  765   2HD1  LEU  94          HD12      LEU  94  -9.320   0.981  -0.915
  766   3HD1  LEU  94          HD13      LEU  94  -7.949   0.398   0.028
  767   1HD2  LEU  94          HD21      LEU  94  -7.268  -1.475  -2.905
  768   2HD2  LEU  94          HD22      LEU  94  -6.699  -0.338  -1.684
  769   3HD2  LEU  94          HD23      LEU  94  -7.833   0.197  -2.923
  770    H    ILE  95           HN       ILE  95  -8.467  -5.326   0.467
  771    HA   ILE  95           HA       ILE  95  -5.786  -6.115   0.141
  772    HB   ILE  95           HB       ILE  95  -8.054  -7.537   1.555
  773   1HG1  ILE  95          HG11      ILE  95  -5.901  -5.770   2.751
  774   2HG1  ILE  95          HG12      ILE  95  -7.480  -5.154   2.274
  775   1HG2  ILE  95          HG21      ILE  95  -6.209  -9.092   1.195
  776   2HG2  ILE  95          HG22      ILE  95  -6.276  -8.626   2.894
  777   3HG2  ILE  95          HG23      ILE  95  -5.061  -7.912   1.834
  778   1HD1  ILE  95          HD11      ILE  95  -7.397  -5.621   4.672
  779   2HD1  ILE  95          HD12      ILE  95  -6.983  -7.303   4.339
  780   3HD1  ILE  95          HD13      ILE  95  -8.560  -6.675   3.865
  781    H    THR  96           HN       THR  96  -8.809  -7.800  -0.813
  782    HA   THR  96           HA       THR  96  -7.620  -9.998  -2.078
  783    HB   THR  96           HB       THR  96 -10.257  -8.830  -2.957
  784    HG1  THR  96           HG1      THR  96  -9.566  -9.671  -0.499
  785   1HG2  THR  96          HG21      THR  96  -9.405 -10.779  -4.215
  786   2HG2  THR  96          HG22      THR  96 -10.852 -11.178  -3.289
  787   3HG2  THR  96          HG23      THR  96  -9.265 -11.677  -2.703
  788    H    TYR  97           HN       TYR  97  -8.470  -6.803  -3.446
  789    HA   TYR  97           HA       TYR  97  -7.813  -7.388  -6.112
  790   1HB   TYR  97          HB1       TYR  97  -9.048  -5.404  -5.632
  791   2HB   TYR  97          HB2       TYR  97  -7.761  -4.779  -4.609
  792    HD1  TYR  97           HD1      TYR  97  -6.770  -2.914  -5.516
  793    HD2  TYR  97           HD2      TYR  97  -7.859  -6.166  -8.110
  794    HE1  TYR  97           HE1      TYR  97  -5.767  -1.706  -7.444
  795    HE2  TYR  97           HE2      TYR  97  -6.969  -4.915 -10.067
  796    HH   TYR  97           HH       TYR  97  -4.880  -2.593  -9.979
  797    H    LEU  98           HN       LEU  98  -5.721  -5.699  -3.715
  798    HA   LEU  98           HA       LEU  98  -3.367  -5.703  -5.214
  799   1HB   LEU  98          HB1       LEU  98  -4.188  -4.937  -2.636
  800   2HB   LEU  98          HB2       LEU  98  -2.845  -6.052  -2.391
  801    HG   LEU  98           HG       LEU  98  -2.047  -3.712  -2.580
  802   1HD1  LEU  98          HD11      LEU  98  -1.287  -5.400  -4.974
  803   2HD1  LEU  98          HD12      LEU  98  -0.602  -5.567  -3.357
  804   3HD1  LEU  98          HD13      LEU  98  -0.337  -4.086  -4.278
  805   1HD2  LEU  98          HD21      LEU  98  -3.832  -2.903  -4.097
  806   2HD2  LEU  98          HD22      LEU  98  -3.127  -3.860  -5.400
  807   3HD2  LEU  98          HD23      LEU  98  -2.216  -2.525  -4.694
  808    H    LYS  99           HN       LYS  99  -4.518  -8.019  -2.828
  809    HA   LYS  99           HA       LYS  99  -2.477  -9.876  -2.840
  810   1HB   LYS  99          HB1       LYS  99  -3.857 -10.577  -1.226
  811   2HB   LYS  99          HB2       LYS  99  -5.235  -9.759  -1.944
  812   1HG   LYS  99          HG1       LYS  99  -5.628 -11.674  -3.408
  813   2HG   LYS  99          HG2       LYS  99  -4.220 -12.488  -2.755
  814   1HD   LYS  99          HD1       LYS  99  -6.158 -11.759  -0.691
  815   2HD   LYS  99          HD2       LYS  99  -6.838 -12.818  -1.929
  816   1HE   LYS  99          HE1       LYS  99  -5.709 -13.901   0.109
  817   2HE   LYS  99          HE2       LYS  99  -5.322 -14.523  -1.488
  818   1HZ   LYS  99          HZ1       LYS  99  -3.204 -13.986  -1.228
  819   2HZ   LYS  99          HZ2       LYS  99  -3.550 -13.762   0.417
  820   3HZ   LYS  99          HZ3       LYS  99  -3.574 -12.436  -0.633
  821    H    LYS 100           HN       LYS 100  -5.195  -9.603  -5.137
  822    HA   LYS 100           HA       LYS 100  -4.548 -11.945  -6.600
  823   1HB   LYS 100          HB1       LYS 100  -6.753 -10.436  -6.393
  824   2HB   LYS 100          HB2       LYS 100  -6.177  -9.921  -7.961
  825   1HG   LYS 100          HG1       LYS 100  -7.913 -11.842  -7.821
  826   2HG   LYS 100          HG2       LYS 100  -6.551 -12.018  -8.932
  827   1HD   LYS 100          HD1       LYS 100  -6.078 -12.973  -6.212
  828   2HD   LYS 100          HD2       LYS 100  -7.347 -13.824  -7.035
  829   1HE   LYS 100          HE1       LYS 100  -5.651 -15.236  -7.461
  830   2HE   LYS 100          HE2       LYS 100  -5.350 -14.135  -8.816
  831   1HZ   LYS 100          HZ1       LYS 100  -4.128 -13.686  -6.141
  832   2HZ   LYS 100          HZ2       LYS 100  -3.686 -13.007  -7.626
  833   3HZ   LYS 100          HZ3       LYS 100  -3.374 -14.643  -7.323
  834    H    ALA 101           HN       ALA 101  -3.525  -8.763  -6.920
  835    HA   ALA 101           HA       ALA 101  -2.290  -8.858  -9.488
  836   1HB   ALA 101          HB1       ALA 101  -3.329  -6.833  -8.608
  837   2HB   ALA 101          HB2       ALA 101  -1.615  -6.571  -8.931
  838   3HB   ALA 101          HB3       ALA 101  -2.175  -6.806  -7.275
  839    H    THR 102           HN       THR 102  -1.147  -9.161  -6.149
  840    HA   THR 102           HA       THR 102   1.652  -9.309  -6.783
  841    HB   THR 102           HB       THR 102   0.328 -10.056  -4.176
  842    HG1  THR 102           HG1      THR 102  -0.163  -7.883  -4.800
  843   1HG2  THR 102          HG21      THR 102   2.474  -9.475  -3.184
  844   2HG2  THR 102          HG22      THR 102   3.119  -9.056  -4.772
  845   3HG2  THR 102          HG23      THR 102   2.698 -10.729  -4.405
  846    H    GLU 103           HN       GLU 103  -0.907 -11.664  -5.987
  847    HA   GLU 103           HA       GLU 103   0.917 -13.809  -6.874
  848   1HB   GLU 103          HB1       GLU 103  -0.689 -15.225  -5.264
  849   2HB   GLU 103          HB2       GLU 103   0.798 -14.480  -4.701
  850   1HG   GLU 103          HG1       GLU 103  -0.404 -13.501  -3.126
  851   2HG   GLU 103          HG2       GLU 103  -1.110 -12.498  -4.388
  852    HHA  HEC 104           HA       HEC 104   5.228   3.453   1.544
  853    HHB  HEC 104           HB       HEC 104  -0.392   0.415   0.367
  854    HHC  HEC 104           HC       HEC 104  -3.053   6.084  -1.305
  855    HHD  HEC 104           HD       HEC 104   2.828   8.755  -1.311
  856   1HMA  HEC 104          HMA1      HEC 104   1.434  -0.920   2.203
  857   2HMA  HEC 104          HMA2      HEC 104   2.958  -1.270   1.387
  858   3HMA  HEC 104          HMA3      HEC 104   1.465  -1.150   0.455
  859   1HAA  HEC 104          HAA1      HEC 104   4.473  -0.216   2.281
  860   2HAA  HEC 104          HAA2      HEC 104   5.120   1.376   2.632
  861   1HBA  HEC 104          HBA1      HEC 104   5.979   1.508   0.306
  862   2HBA  HEC 104          HBA2      HEC 104   5.392  -0.122   0.021
  863   1HMB  HEC 104          HMB1      HEC 104  -2.264   0.051  -0.252
  864   2HMB  HEC 104          HMB2      HEC 104  -3.199   0.606  -1.640
  865   3HMB  HEC 104          HMB3      HEC 104  -3.864   0.756  -0.014
  866    HAB  HEC 104           HAB      HEC 104  -4.428   4.724  -1.330
  867   1HBB  HEC 104          HBB1      HEC 104  -4.732   3.533   0.978
  868   2HBB  HEC 104          HBB2      HEC 104  -5.705   2.425   0.013
  869   3HBB  HEC 104          HBB3      HEC 104  -6.097   4.145   0.044
  870   1HMC  HEC 104          HMC1      HEC 104  -3.164   8.646  -1.509
  871   2HMC  HEC 104          HMC2      HEC 104  -2.811   7.902  -3.069
  872   3HMC  HEC 104          HMC3      HEC 104  -2.237   9.532  -2.720
  873    HAC  HEC 104           HAC      HEC 104   1.607   9.758  -2.604
  874   1HBC  HEC 104          HBC1      HEC 104   0.785  11.157  -0.953
  875   2HBC  HEC 104          HBC2      HEC 104  -0.873  11.041  -1.541
  876   3HBC  HEC 104          HBC3      HEC 104   0.337  11.913  -2.482
  877   1HMD  HEC 104          HMD1      HEC 104   4.954   9.216  -0.409
  878   2HMD  HEC 104          HMD2      HEC 104   5.425   8.217  -1.784
  879   3HMD  HEC 104          HMD3      HEC 104   6.446   8.279  -0.347
  880   1HAD  HEC 104          HAD1      HEC 104   7.292   6.437   0.462
  881   2HAD  HEC 104          HAD2      HEC 104   6.874   4.897   1.203
  882   1HBD  HEC 104          HBD1      HEC 104   6.338   5.868   3.238
  883   2HBD  HEC 104          HBD2      HEC 104   5.982   7.425   2.522
  884    H2   4NL 105           H2       4NL 105  -0.376 -13.551  -1.194
  885    H6   4NL 105           H6       4NL 105   1.318 -13.893   4.019
  886    H3   4NL 105           H3       4NL 105  -1.576 -10.702   1.857
  887    H5   4NL 105           H5       4NL 105  -2.329 -10.643  -0.257
  888    H4   4NL 105           H4       4NL 105  -0.056 -11.829   3.506
  889    H1   4NL 105           H1       4NL 105   1.143 -14.677   0.455
  890    H7   4NL 105           H7       4NL 105   2.349 -14.448   2.678
  Start of MODEL   10
    1   1H    THR  -5          HT1       THR  -5 -12.796  -6.742  13.529
    2   2H    THR  -5          HT2       THR  -5 -12.258  -6.046  12.083
    3   3H    THR  -5          HT3       THR  -5 -11.234  -6.091  13.429
    4    HA   THR  -5           HA       THR  -5 -10.702  -7.772  11.712
    5    HB   THR  -5           HB       THR  -5 -11.562  -9.377  14.064
    6    HG1  THR  -5           HG1      THR  -5  -9.783  -8.268  15.249
    7   1HG2  THR  -5          HG21      THR  -5  -9.908 -10.231  12.493
    8   2HG2  THR  -5          HG22      THR  -5  -9.144  -9.936  14.055
    9   3HG2  THR  -5          HG23      THR  -5  -8.910  -8.796  12.729
   10    H    GLU  -4           HN       GLU  -4 -12.939  -7.332  10.492
   11    HA   GLU  -4           HA       GLU  -4 -14.442  -9.856  10.523
   12   1HB   GLU  -4          HB1       GLU  -4 -15.680  -7.792  11.581
   13   2HB   GLU  -4          HB2       GLU  -4 -15.816  -7.232   9.918
   14   1HG   GLU  -4          HG1       GLU  -4 -16.709  -9.998  10.643
   15   2HG   GLU  -4          HG2       GLU  -4 -17.747  -8.620  10.987
   16    H    PHE  -3           HN       PHE  -3 -12.532  -9.998   8.958
   17    HA   PHE  -3           HA       PHE  -3 -12.622  -8.521   6.530
   18   1HB   PHE  -3          HB1       PHE  -3 -10.473  -9.235   7.226
   19   2HB   PHE  -3          HB2       PHE  -3 -10.984 -10.914   7.344
   20    HD1  PHE  -3           HD1      PHE  -3 -10.190  -8.164   4.961
   21    HD2  PHE  -3           HD2      PHE  -3 -10.916 -12.375   5.453
   22    HE1  PHE  -3           HE1      PHE  -3  -9.514  -8.555   2.600
   23    HE2  PHE  -3           HE2      PHE  -3 -10.288 -12.761   3.077
   24    HZ   PHE  -3           HZ       PHE  -3  -9.616 -10.845   1.638
   25    H    LYS  -2           HN       LYS  -2 -13.906  -8.710   4.969
   26    HA   LYS  -2           HA       LYS  -2 -15.190 -11.250   4.252
   27   1HB   LYS  -2          HB1       LYS  -2 -16.196  -8.506   4.571
   28   2HB   LYS  -2          HB2       LYS  -2 -16.666  -9.246   3.044
   29   1HG   LYS  -2          HG1       LYS  -2 -17.503 -11.223   4.314
   30   2HG   LYS  -2          HG2       LYS  -2 -17.154 -10.360   5.810
   31   1HD   LYS  -2          HD1       LYS  -2 -18.712  -8.542   5.002
   32   2HD   LYS  -2          HD2       LYS  -2 -19.168  -9.616   3.681
   33   1HE   LYS  -2          HE1       LYS  -2 -20.831  -9.855   5.368
   34   2HE   LYS  -2          HE2       LYS  -2 -19.842 -11.310   5.421
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.615 -10.261   7.303
   36   2HZ   LYS  -2          HZ2       LYS  -2 -20.232 -10.618   7.637
   37   3HZ   LYS  -2          HZ3       LYS  -2 -19.780  -9.027   7.304
   38    H    ALA  -1           HN       ALA  -1 -14.444 -12.096   2.479
   39    HA   ALA  -1           HA       ALA  -1 -12.437 -11.141   0.860
   40   1HB   ALA  -1          HB1       ALA  -1 -13.096 -13.498   1.103
   41   2HB   ALA  -1          HB2       ALA  -1 -12.949 -13.021  -0.589
   42   3HB   ALA  -1          HB3       ALA  -1 -14.544 -13.182   0.146
   43    H    GLY   1           HN       GLY   1 -12.300 -10.169  -1.120
   44   1HA   GLY   1          HA1       GLY   1 -14.692  -8.800  -2.174
   45   2HA   GLY   1          HA2       GLY   1 -13.061  -8.149  -2.231
   46    H    SER   2           HN       SER   2 -12.884  -7.908  -4.376
   47    HA   SER   2           HA       SER   2 -12.318 -10.187  -6.032
   48   1HB   SER   2          HB1       SER   2 -14.426  -8.393  -7.172
   49   2HB   SER   2          HB2       SER   2 -14.044 -10.072  -7.572
   50    HG   SER   2           HG       SER   2 -14.750 -10.360  -5.198
   51    H    ALA   3           HN       ALA   3 -11.010  -9.632  -7.772
   52    HA   ALA   3           HA       ALA   3  -9.450  -7.381  -7.658
   53   1HB   ALA   3          HB1       ALA   3 -10.004  -9.029 -10.120
   54   2HB   ALA   3          HB2       ALA   3  -8.890  -9.470  -8.826
   55   3HB   ALA   3          HB3       ALA   3  -8.577  -8.040  -9.808
   56    H    LYS   4           HN       LYS   4 -12.429  -7.693  -9.656
   57    HA   LYS   4           HA       LYS   4 -12.016  -5.162 -10.904
   58   1HB   LYS   4          HB1       LYS   4 -13.241  -7.267 -11.810
   59   2HB   LYS   4          HB2       LYS   4 -14.652  -6.524 -11.056
   60   1HG   LYS   4          HG1       LYS   4 -13.652  -4.375 -12.333
   61   2HG   LYS   4          HG2       LYS   4 -13.077  -5.643 -13.408
   62   1HD   LYS   4          HD1       LYS   4 -15.175  -4.923 -14.269
   63   2HD   LYS   4          HD2       LYS   4 -15.474  -6.481 -13.489
   64   1HE   LYS   4          HE1       LYS   4 -17.194  -4.726 -12.963
   65   2HE   LYS   4          HE2       LYS   4 -16.399  -5.406 -11.542
   66   1HZ   LYS   4          HZ1       LYS   4 -16.658  -2.921 -11.597
   67   2HZ   LYS   4          HZ2       LYS   4 -15.493  -2.901 -12.820
   68   3HZ   LYS   4          HZ3       LYS   4 -15.093  -3.494 -11.289
   69    H    LYS   5           HN       LYS   5 -12.756  -5.522  -7.822
   70    HA   LYS   5           HA       LYS   5 -14.567  -3.191  -7.763
   71   1HB   LYS   5          HB1       LYS   5 -14.492  -5.622  -6.100
   72   2HB   LYS   5          HB2       LYS   5 -14.629  -4.124  -5.189
   73   1HG   LYS   5          HG1       LYS   5 -16.648  -3.518  -6.350
   74   2HG   LYS   5          HG2       LYS   5 -16.465  -4.871  -7.470
   75   1HD   LYS   5          HD1       LYS   5 -16.907  -5.121  -4.483
   76   2HD   LYS   5          HD2       LYS   5 -18.152  -5.332  -5.714
   77   1HE   LYS   5          HE1       LYS   5 -17.477  -7.428  -6.192
   78   2HE   LYS   5          HE2       LYS   5 -15.772  -6.978  -6.172
   79   1HZ   LYS   5          HZ1       LYS   5 -17.476  -7.665  -3.846
   80   2HZ   LYS   5          HZ2       LYS   5 -15.934  -6.971  -3.702
   81   3HZ   LYS   5          HZ3       LYS   5 -16.112  -8.494  -4.420
   82    H    GLY   6           HN       GLY   6 -11.854  -4.700  -5.976
   83   1HA   GLY   6          HA1       GLY   6 -11.101  -2.467  -4.468
   84   2HA   GLY   6          HA2       GLY   6 -10.018  -3.760  -4.957
   85    H    ALA   7           HN       ALA   7 -10.257  -3.292  -7.819
   86    HA   ALA   7           HA       ALA   7  -8.256  -1.403  -8.253
   87   1HB   ALA   7          HB1       ALA   7 -10.212  -2.657 -10.174
   88   2HB   ALA   7          HB2       ALA   7  -8.560  -3.170  -9.825
   89   3HB   ALA   7          HB3       ALA   7  -8.850  -1.651 -10.671
   90    H    THR   8           HN       THR   8 -11.829  -0.993  -8.747
   91    HA   THR   8           HA       THR   8 -11.637   1.595  -9.826
   92    HB   THR   8           HB       THR   8 -14.052   1.730  -8.594
   93    HG1  THR   8           HG1      THR   8 -13.825  -0.368  -7.727
   94   1HG2  THR   8          HG21      THR   8 -13.593   1.996 -11.005
   95   2HG2  THR   8          HG22      THR   8 -15.002   0.979 -10.699
   96   3HG2  THR   8          HG23      THR   8 -13.466   0.242 -11.157
   97    H    LEU   9           HN       LEU   9 -11.809   0.625  -6.431
   98    HA   LEU   9           HA       LEU   9 -12.123   3.202  -5.312
   99   1HB   LEU   9          HB1       LEU   9 -10.864   0.780  -3.991
  100   2HB   LEU   9          HB2       LEU   9 -11.617   2.158  -3.192
  101    HG   LEU   9           HG       LEU   9 -13.106   0.245  -5.006
  102   1HD1  LEU   9          HD11      LEU   9 -12.362  -0.912  -2.989
  103   2HD1  LEU   9          HD12      LEU   9 -14.100  -0.619  -2.922
  104   3HD1  LEU   9          HD13      LEU   9 -12.999   0.393  -1.988
  105   1HD2  LEU   9          HD21      LEU   9 -14.087   2.384  -3.099
  106   2HD2  LEU   9          HD22      LEU   9 -15.110   1.252  -3.983
  107   3HD2  LEU   9          HD23      LEU   9 -14.161   2.453  -4.862
  108    H    PHE  10           HN       PHE  10  -9.240   1.108  -5.559
  109    HA   PHE  10           HA       PHE  10  -7.292   2.885  -4.691
  110   1HB   PHE  10          HB1       PHE  10  -6.206   0.948  -4.900
  111   2HB   PHE  10          HB2       PHE  10  -7.437   0.312  -5.980
  112    HD1  PHE  10           HD1      PHE  10  -7.117   0.300  -8.397
  113    HD2  PHE  10           HD2      PHE  10  -4.182   2.010  -5.759
  114    HE1  PHE  10           HE1      PHE  10  -5.451   0.312 -10.250
  115    HE2  PHE  10           HE2      PHE  10  -2.565   2.140  -7.641
  116    HZ   PHE  10           HZ       PHE  10  -3.184   1.269  -9.882
  117    H    LYS  11           HN       LYS  11  -8.739   2.563  -7.891
  118    HA   LYS  11           HA       LYS  11  -6.882   4.005  -9.397
  119   1HB   LYS  11          HB1       LYS  11  -9.108   2.563  -9.964
  120   2HB   LYS  11          HB2       LYS  11  -9.671   4.198 -10.313
  121   1HG   LYS  11          HG1       LYS  11  -7.964   4.565 -11.912
  122   2HG   LYS  11          HG2       LYS  11  -7.063   3.145 -11.387
  123   1HD   LYS  11          HD1       LYS  11  -9.742   3.128 -12.794
  124   2HD   LYS  11          HD2       LYS  11  -8.185   2.749 -13.533
  125   1HE   LYS  11          HE1       LYS  11  -9.602   1.195 -11.356
  126   2HE   LYS  11          HE2       LYS  11  -9.332   0.682 -13.019
  127   1HZ   LYS  11          HZ1       LYS  11  -7.221   1.120 -10.971
  128   2HZ   LYS  11          HZ2       LYS  11  -6.948   0.646 -12.569
  129   3HZ   LYS  11          HZ3       LYS  11  -7.781  -0.384 -11.520
  130    H    THR  12           HN       THR  12  -9.043   5.296  -7.109
  131    HA   THR  12           HA       THR  12  -8.372   8.023  -7.869
  132    HB   THR  12           HB       THR  12 -10.502   7.611  -8.884
  133    HG1  THR  12           HG1      THR  12 -10.411   9.408  -6.730
  134   1HG2  THR  12          HG21      THR  12 -12.552   7.252  -7.718
  135   2HG2  THR  12          HG22      THR  12 -11.733   7.282  -6.155
  136   3HG2  THR  12          HG23      THR  12 -11.443   5.953  -7.278
  137    H    ARG  13           HN       ARG  13  -7.437   6.201  -5.841
  138    HA   ARG  13           HA       ARG  13  -7.618   7.916  -3.475
  139   1HB   ARG  13          HB1       ARG  13  -8.067   4.934  -3.501
  140   2HB   ARG  13          HB2       ARG  13  -7.651   5.817  -2.048
  141   1HG   ARG  13          HG1       ARG  13 -10.113   6.339  -3.700
  142   2HG   ARG  13          HG2       ARG  13 -10.064   5.274  -2.303
  143   1HD   ARG  13          HD1       ARG  13 -10.978   7.494  -1.755
  144   2HD   ARG  13          HD2       ARG  13  -9.489   7.160  -0.863
  145    HE   ARG  13           HE       ARG  13  -9.492   8.357  -3.379
  146   1HH1  ARG  13          HH11      ARG  13  -9.198   8.850   0.069
  147   2HH1  ARG  13          HH12      ARG  13  -8.096  10.178   0.073
  148   1HH2  ARG  13          HH21      ARG  13  -7.772  10.363  -3.328
  149   2HH2  ARG  13          HH22      ARG  13  -7.335  11.024  -1.792
  150    H    CYS  14           HN       CYS  14  -5.938   5.351  -5.191
  151    HA   CYS  14           HA       CYS  14  -3.453   5.958  -3.722
  152   1HB   CYS  14          HB1       CYS  14  -3.943   3.331  -5.060
  153   2HB   CYS  14          HB2       CYS  14  -2.848   3.712  -3.749
  154    H    LEU  15           HN       LEU  15  -4.848   5.116  -6.887
  155    HA   LEU  15           HA       LEU  15  -2.675   4.948  -8.505
  156   1HB   LEU  15          HB1       LEU  15  -5.104   4.700  -9.113
  157   2HB   LEU  15          HB2       LEU  15  -5.190   6.452  -9.227
  158    HG   LEU  15           HG       LEU  15  -3.362   6.365 -10.958
  159   1HD1  LEU  15          HD11      LEU  15  -2.648   4.375 -11.937
  160   2HD1  LEU  15          HD12      LEU  15  -3.978   3.446 -11.244
  161   3HD1  LEU  15          HD13      LEU  15  -2.656   3.996 -10.213
  162   1HD2  LEU  15          HD21      LEU  15  -5.405   6.684 -11.968
  163   2HD2  LEU  15          HD22      LEU  15  -6.062   5.162 -11.364
  164   3HD2  LEU  15          HD23      LEU  15  -4.913   5.159 -12.704
  165    H    GLN  16           HN       GLN  16  -4.113   7.993  -7.375
  166    HA   GLN  16           HA       GLN  16  -2.912   9.924  -8.798
  167   1HB   GLN  16          HB1       GLN  16  -2.908  11.253  -6.592
  168   2HB   GLN  16          HB2       GLN  16  -4.432  10.636  -7.210
  169   1HG   GLN  16          HG1       GLN  16  -4.149   8.668  -5.643
  170   2HG   GLN  16          HG2       GLN  16  -2.799   9.546  -4.920
  171   1HE2  GLN  16          HE21      GLN  16  -3.276  11.536  -3.788
  172   2HE2  GLN  16          HE22      GLN  16  -4.875  11.856  -3.228
  173    H    CYS  17           HN       CYS  17  -1.195   8.023  -6.347
  174    HA   CYS  17           HA       CYS  17   1.297   9.422  -7.046
  175   1HB   CYS  17          HB1       CYS  17   1.044   8.068  -4.407
  176   2HB   CYS  17          HB2       CYS  17   1.983   9.470  -4.890
  177    H    HIS  18           HN       HIS  18  -0.166   6.277  -6.497
  178    HA   HIS  18           HA       HIS  18   2.401   4.881  -6.691
  179   1HB   HIS  18          HB1       HIS  18  -0.303   4.153  -5.625
  180   2HB   HIS  18          HB2       HIS  18   0.882   2.912  -5.981
  181    HD1  HIS  18           HD1      HIS  18   3.360   3.479  -4.612
  182    HD2  HIS  18           HD2      HIS  18  -0.292   4.921  -3.159
  183    HE1  HIS  18           HE1      HIS  18   3.704   3.898  -2.134
  184    H    THR  19           HN       THR  19   1.945   2.557  -7.528
  185    HA   THR  19           HA       THR  19   0.375   2.401  -9.972
  186    HB   THR  19           HB       THR  19   2.632   1.193 -10.826
  187    HG1  THR  19           HG1      THR  19   4.260   2.913 -10.345
  188   1HG2  THR  19          HG21      THR  19   1.372   2.860 -12.098
  189   2HG2  THR  19          HG22      THR  19   3.101   3.203 -12.143
  190   3HG2  THR  19          HG23      THR  19   2.043   4.142 -11.091
  191    H    VAL  20           HN       VAL  20  -0.766   0.526  -9.926
  192    HA   VAL  20           HA       VAL  20  -0.337  -1.429  -7.879
  193    HB   VAL  20           HB       VAL  20  -2.493  -0.455  -9.093
  194   1HG1  VAL  20          HG11      VAL  20  -2.233  -1.587 -11.189
  195   2HG1  VAL  20          HG12      VAL  20  -3.650  -2.215 -10.345
  196   3HG1  VAL  20          HG13      VAL  20  -2.156  -3.153 -10.378
  197   1HG2  VAL  20          HG21      VAL  20  -2.390  -3.136  -7.725
  198   2HG2  VAL  20          HG22      VAL  20  -3.836  -2.159  -7.972
  199   3HG2  VAL  20          HG23      VAL  20  -2.535  -1.560  -6.946
  200    H    GLU  21           HN       GLU  21   0.395  -1.340 -11.248
  201    HA   GLU  21           HA       GLU  21   1.258  -4.154 -11.285
  202   1HB   GLU  21          HB1       GLU  21   1.327  -3.454 -13.892
  203   2HB   GLU  21          HB2       GLU  21  -0.107  -4.117 -13.132
  204   1HG   GLU  21          HG1       GLU  21  -0.511  -2.132 -14.609
  205   2HG   GLU  21          HG2       GLU  21  -1.126  -1.965 -12.968
  206    H    LYS  22           HN       LYS  22   3.286  -4.308 -13.030
  207    HA   LYS  22           HA       LYS  22   5.177  -2.317 -12.065
  208   1HB   LYS  22          HB1       LYS  22   5.337  -5.106 -12.516
  209   2HB   LYS  22          HB2       LYS  22   6.544  -4.311 -13.543
  210   1HG   LYS  22          HG1       LYS  22   7.687  -3.419 -11.775
  211   2HG   LYS  22          HG2       LYS  22   6.240  -3.275 -10.776
  212   1HD   LYS  22          HD1       LYS  22   6.270  -5.647 -10.326
  213   2HD   LYS  22          HD2       LYS  22   7.634  -5.868 -11.423
  214   1HE   LYS  22          HE1       LYS  22   8.445  -5.880  -9.144
  215   2HE   LYS  22          HE2       LYS  22   9.024  -4.438  -9.957
  216   1HZ   LYS  22          HZ1       LYS  22   6.891  -4.617  -7.887
  217   2HZ   LYS  22          HZ2       LYS  22   7.173  -3.221  -8.791
  218   3HZ   LYS  22          HZ3       LYS  22   8.380  -3.818  -7.774
  219    H    GLY  23           HN       GLY  23   3.318  -1.821 -14.488
  220   1HA   GLY  23          HA1       GLY  23   5.296  -1.357 -16.595
  221   2HA   GLY  23          HA2       GLY  23   3.563  -1.107 -16.724
  222    H    GLY  24           HN       GLY  24   3.549   0.495 -14.195
  223   1HA   GLY  24          HA1       GLY  24   4.181   3.088 -15.313
  224   2HA   GLY  24          HA2       GLY  24   3.290   2.762 -13.836
  225    HA   PRO  25           HA       PRO  25   8.122   3.257 -13.126
  226   1HB   PRO  25          HB1       PRO  25   8.508   5.962 -13.497
  227   2HB   PRO  25          HB2       PRO  25   8.953   4.720 -14.672
  228   1HG   PRO  25          HG1       PRO  25   6.532   6.472 -14.587
  229   2HG   PRO  25          HG2       PRO  25   7.507   5.972 -15.981
  230   1HD   PRO  25          HD1       PRO  25   5.136   4.830 -15.426
  231   2HD   PRO  25          HD2       PRO  25   6.484   3.899 -16.113
  232    H    HIS  26           HN       HIS  26   8.918   4.262 -11.178
  233    HA   HIS  26           HA       HIS  26   7.049   4.587  -9.133
  234   1HB   HIS  26          HB1       HIS  26   9.934   5.486  -9.315
  235   2HB   HIS  26          HB2       HIS  26   9.007   5.422  -7.826
  236    HD2  HIS  26           HD2      HIS  26  11.064   3.264 -10.182
  237    HE1  HIS  26           HE1      HIS  26   9.763   0.687  -7.068
  238    HE2  HIS  26           HE2      HIS  26  11.321   0.921  -9.059
  239    H    LYS  27           HN       LYS  27   5.701   6.284  -8.772
  240    HA   LYS  27           HA       LYS  27   6.354   8.921  -9.864
  241   1HB   LYS  27          HB1       LYS  27   4.253   7.624 -10.529
  242   2HB   LYS  27          HB2       LYS  27   3.632   8.026  -8.932
  243   1HG   LYS  27          HG1       LYS  27   3.820  10.409  -9.424
  244   2HG   LYS  27          HG2       LYS  27   4.524  10.044 -11.003
  245   1HD   LYS  27          HD1       LYS  27   1.898  10.527 -10.670
  246   2HD   LYS  27          HD2       LYS  27   2.510   9.424 -11.909
  247   1HE   LYS  27          HE1       LYS  27   2.088   7.512 -10.526
  248   2HE   LYS  27          HE2       LYS  27   1.740   8.527  -9.127
  249   1HZ   LYS  27          HZ1       LYS  27  -0.309   7.759 -10.028
  250   2HZ   LYS  27          HZ2       LYS  27   0.109   8.256 -11.588
  251   3HZ   LYS  27          HZ3       LYS  27  -0.185   9.412 -10.389
  252    H    VAL  28           HN       VAL  28   4.050   9.588  -7.669
  253    HA   VAL  28           HA       VAL  28   5.776  10.906  -5.849
  254    HB   VAL  28           HB       VAL  28   2.845  10.290  -5.456
  255   1HG1  VAL  28          HG11      VAL  28   4.127  11.138  -3.474
  256   2HG1  VAL  28          HG12      VAL  28   2.809  12.189  -3.990
  257   3HG1  VAL  28          HG13      VAL  28   4.476  12.601  -4.395
  258   1HG2  VAL  28          HG21      VAL  28   4.117  12.636  -6.884
  259   2HG2  VAL  28          HG22      VAL  28   2.432  12.576  -6.370
  260   3HG2  VAL  28          HG23      VAL  28   3.025  11.436  -7.577
  261    H    GLY  29           HN       GLY  29   4.479   7.733  -5.990
  262   1HA   GLY  29          HA1       GLY  29   5.636   7.000  -3.384
  263   2HA   GLY  29          HA2       GLY  29   4.045   6.426  -3.857
  264    HA   PRO  30           HA       PRO  30   7.576   3.564  -5.404
  265   1HB   PRO  30          HB1       PRO  30   7.251   1.525  -3.653
  266   2HB   PRO  30          HB2       PRO  30   8.338   2.886  -3.353
  267   1HG   PRO  30          HG1       PRO  30   5.549   2.436  -2.350
  268   2HG   PRO  30          HG2       PRO  30   6.979   2.994  -1.460
  269   1HD   PRO  30          HD1       PRO  30   5.090   4.700  -2.343
  270   2HD   PRO  30          HD2       PRO  30   6.808   5.146  -2.282
  271    H    ASN  31           HN       ASN  31   7.297   1.238  -6.135
  272    HA   ASN  31           HA       ASN  31   4.685   0.931  -7.330
  273   1HB   ASN  31          HB1       ASN  31   6.818   0.629  -8.585
  274   2HB   ASN  31          HB2       ASN  31   7.192  -0.767  -7.585
  275   1HD2  ASN  31          HD21      ASN  31   5.105   0.427 -10.151
  276   2HD2  ASN  31          HD22      ASN  31   4.581  -1.144 -10.661
  277    H    LEU  32           HN       LEU  32   3.106  -0.403  -6.608
  278    HA   LEU  32           HA       LEU  32   3.278  -1.767  -4.096
  279   1HB   LEU  32          HB1       LEU  32   0.961  -1.540  -6.020
  280   2HB   LEU  32          HB2       LEU  32   0.874  -1.994  -4.330
  281    HG   LEU  32           HG       LEU  32   1.906   0.716  -5.166
  282   1HD1  LEU  32          HD11      LEU  32  -0.317   1.623  -4.902
  283   2HD1  LEU  32          HD12      LEU  32  -0.962   0.032  -4.500
  284   3HD1  LEU  32          HD13      LEU  32  -0.364   0.353  -6.127
  285   1HD2  LEU  32          HD21      LEU  32   2.307   0.026  -2.831
  286   2HD2  LEU  32          HD22      LEU  32   0.576  -0.241  -2.623
  287   3HD2  LEU  32          HD23      LEU  32   1.186   1.384  -2.934
  288    H    HIS  33           HN       HIS  33   3.120  -2.792  -7.454
  289    HA   HIS  33           HA       HIS  33   2.303  -5.429  -7.302
  290   1HB   HIS  33          HB1       HIS  33   2.634  -3.924  -9.333
  291   2HB   HIS  33          HB2       HIS  33   4.344  -4.337  -9.241
  292    HD2  HIS  33           HD2      HIS  33   1.577  -6.961  -8.615
  293    HE1  HIS  33           HE1      HIS  33   3.391  -7.922 -12.336
  294    HE2  HIS  33           HE2      HIS  33   1.776  -8.719 -10.543
  295    H    GLY  34           HN       GLY  34   3.220  -6.567  -5.618
  296   1HA   GLY  34          HA1       GLY  34   4.782  -8.412  -5.351
  297   2HA   GLY  34          HA2       GLY  34   6.053  -7.338  -5.897
  298    H    ILE  35           HN       ILE  35   4.006  -5.669  -3.699
  299    HA   ILE  35           HA       ILE  35   6.082  -5.616  -1.765
  300    HB   ILE  35           HB       ILE  35   4.654  -4.316  -0.321
  301   1HG1  ILE  35          HG11      ILE  35   2.456  -5.081  -2.201
  302   2HG1  ILE  35          HG12      ILE  35   2.414  -4.848  -0.455
  303   1HG2  ILE  35          HG21      ILE  35   4.611  -3.354  -3.173
  304   2HG2  ILE  35          HG22      ILE  35   6.022  -3.357  -2.116
  305   3HG2  ILE  35          HG23      ILE  35   4.623  -2.362  -1.715
  306   1HD1  ILE  35          HD11      ILE  35   2.539  -2.654  -2.532
  307   2HD1  ILE  35          HD12      ILE  35   2.524  -2.409  -0.785
  308   3HD1  ILE  35          HD13      ILE  35   1.123  -3.117  -1.586
  309    H    PHE  36           HN       PHE  36   3.161  -7.593  -1.931
  310    HA   PHE  36           HA       PHE  36   3.055  -8.479   0.699
  311   1HB   PHE  36          HB1       PHE  36   2.080  -9.581  -1.899
  312   2HB   PHE  36          HB2       PHE  36   2.025 -10.606  -0.465
  313    HD1  PHE  36           HD1      PHE  36   1.487  -8.491   1.603
  314    HD2  PHE  36           HD2      PHE  36  -0.239  -9.189  -2.275
  315    HE1  PHE  36           HE1      PHE  36  -0.590  -7.327   2.326
  316    HE2  PHE  36           HE2      PHE  36  -2.317  -8.026  -1.556
  317    HZ   PHE  36           HZ       PHE  36  -2.490  -7.086   0.740
  318    H    GLY  37           HN       GLY  37   4.497  -9.401   1.856
  319   1HA   GLY  37          HA1       GLY  37   5.714 -11.325   2.537
  320   2HA   GLY  37          HA2       GLY  37   6.170 -11.602   0.867
  321    H    ARG  38           HN       ARG  38   6.721  -8.466   0.930
  322    HA   ARG  38           HA       ARG  38   9.533  -8.698   1.724
  323   1HB   ARG  38          HB1       ARG  38   7.984  -7.059  -0.227
  324   2HB   ARG  38          HB2       ARG  38   9.380  -6.287   0.512
  325   1HG   ARG  38          HG1       ARG  38  10.863  -7.574  -0.621
  326   2HG   ARG  38          HG2       ARG  38   9.826  -9.001  -0.573
  327   1HD   ARG  38          HD1       ARG  38   9.776  -8.458  -2.832
  328   2HD   ARG  38          HD2       ARG  38   8.334  -7.636  -2.234
  329    HE   ARG  38           HE       ARG  38  10.477  -6.529  -1.887
  330   1HH1  ARG  38          HH21      ARG  38   8.174  -7.003  -4.406
  331   2HH1  ARG  38          HH22      ARG  38   8.189  -5.395  -4.918
  332   1HH2  ARG  38          HH11      ARG  38  10.870  -4.187  -3.459
  333   2HH2  ARG  38          HH12      ARG  38  10.084  -4.402  -4.964
  334    H    HIS  39           HN       HIS  39  10.460  -6.602   2.620
  335    HA   HIS  39           HA       HIS  39   8.837  -5.806   4.918
  336   1HB   HIS  39          HB1       HIS  39  11.783  -5.291   4.411
  337   2HB   HIS  39          HB2       HIS  39  10.925  -5.143   5.947
  338    HD2  HIS  39           HD2      HIS  39  10.301  -7.394   7.269
  339    HE1  HIS  39           HE1      HIS  39  12.350 -10.120   4.725
  340    HE2  HIS  39           HE2      HIS  39  11.076  -9.866   6.907
  341    H    SER  40           HN       SER  40   8.780  -3.516   5.568
  342    HA   SER  40           HA       SER  40   8.092  -1.755   3.538
  343   1HB   SER  40          HB1       SER  40   9.124  -0.599   6.092
  344   2HB   SER  40          HB2       SER  40   7.740  -0.113   5.123
  345    HG   SER  40           HG       SER  40   6.798  -2.182   5.854
  346    H    GLY  41           HN       GLY  41   9.123  -0.322   2.305
  347   1HA   GLY  41          HA1       GLY  41  10.831   1.133   1.645
  348   2HA   GLY  41          HA2       GLY  41  11.849   0.502   2.917
  349    H    GLN  42           HN       GLN  42  10.371  -1.548   0.341
  350    HA   GLN  42           HA       GLN  42  13.104  -2.015  -0.619
  351   1HB   GLN  42          HB1       GLN  42  10.883  -4.010  -0.323
  352   2HB   GLN  42          HB2       GLN  42  12.365  -4.343  -1.212
  353   1HG   GLN  42          HG1       GLN  42  13.650  -3.773   0.869
  354   2HG   GLN  42          HG2       GLN  42  12.112  -3.676   1.723
  355   1HE2  GLN  42          HE21      GLN  42  12.914  -5.424   3.098
  356   2HE2  GLN  42          HE22      GLN  42  12.894  -7.050   2.523
  357    H    ALA  43           HN       ALA  43  11.124  -0.096  -1.932
  358    HA   ALA  43           HA       ALA  43  10.276  -1.127  -4.389
  359   1HB   ALA  43          HB1       ALA  43   9.638   1.048  -3.284
  360   2HB   ALA  43          HB2       ALA  43   9.866   1.096  -5.031
  361   3HB   ALA  43          HB3       ALA  43  11.120   1.721  -3.961
  362    H    GLU  44           HN       GLU  44  11.128  -1.373  -6.384
  363    HA   GLU  44           HA       GLU  44  13.945  -1.580  -6.693
  364   1HB   GLU  44          HB1       GLU  44  12.010  -1.989  -8.966
  365   2HB   GLU  44          HB2       GLU  44  13.527  -2.819  -8.635
  366   1HG   GLU  44          HG1       GLU  44  11.996  -4.437  -8.035
  367   2HG   GLU  44          HG2       GLU  44  12.318  -3.672  -6.491
  368    H    GLY  45           HN       GLY  45  14.222   0.796  -6.225
  369   1HA   GLY  45          HA1       GLY  45  15.636   2.348  -7.540
  370   2HA   GLY  45          HA2       GLY  45  14.344   2.379  -8.719
  371    H    TYR  46           HN       TYR  46  13.313   2.471  -5.425
  372    HA   TYR  46           HA       TYR  46  12.953   5.378  -5.506
  373   1HB   TYR  46          HB1       TYR  46  10.886   4.338  -6.133
  374   2HB   TYR  46          HB2       TYR  46  10.925   3.299  -4.715
  375    HD1  TYR  46           HD1      TYR  46  10.217   6.678  -5.981
  376    HD2  TYR  46           HD2      TYR  46  10.455   4.189  -2.488
  377    HE1  TYR  46           HE1      TYR  46   8.824   8.323  -4.732
  378    HE2  TYR  46           HE2      TYR  46   8.971   5.765  -1.254
  379    HH   TYR  46           HH       TYR  46   7.322   8.387  -2.876
  380    H    SER  47           HN       SER  47  12.965   6.528  -3.575
  381    HA   SER  47           HA       SER  47  14.291   5.226  -1.312
  382   1HB   SER  47          HB1       SER  47  14.191   8.114  -1.136
  383   2HB   SER  47          HB2       SER  47  15.590   7.039  -1.168
  384    HG   SER  47           HG       SER  47  15.229   6.938  -3.499
  385    H    TYR  48           HN       TYR  48  13.570   5.300   0.698
  386    HA   TYR  48           HA       TYR  48  10.911   6.307   1.384
  387   1HB   TYR  48          HB1       TYR  48  12.575   4.007   2.419
  388   2HB   TYR  48          HB2       TYR  48  11.027   4.484   3.109
  389    HD1  TYR  48           HD1      TYR  48   8.955   4.043   1.996
  390    HD2  TYR  48           HD2      TYR  48  12.689   3.023   0.124
  391    HE1  TYR  48           HE1      TYR  48   7.747   2.542   0.424
  392    HE2  TYR  48           HE2      TYR  48  11.493   1.519  -1.453
  393    HH   TYR  48           HH       TYR  48   8.448   0.348  -0.841
  394    H    THR  49           HN       THR  49  10.594   7.135   3.656
  395    HA   THR  49           HA       THR  49  12.498   9.025   4.543
  396    HB   THR  49           HB       THR  49  11.027   8.938   6.706
  397    HG1  THR  49           HG1      THR  49   9.022   8.030   5.034
  398   1HG2  THR  49          HG21      THR  49  11.058  10.745   5.037
  399   2HG2  THR  49          HG22      THR  49   9.456  10.464   5.720
  400   3HG2  THR  49          HG23      THR  49   9.842   9.871   4.104
  401    H    ASP  50           HN       ASP  50  13.406   9.203   6.723
  402    HA   ASP  50           HA       ASP  50  15.199   7.230   7.396
  403   1HB   ASP  50          HB1       ASP  50  15.450   9.560   8.024
  404   2HB   ASP  50          HB2       ASP  50  14.044   9.464   9.080
  405    H    ALA  51           HN       ALA  51  11.919   7.658   8.608
  406    HA   ALA  51           HA       ALA  51  12.161   5.662  10.672
  407   1HB   ALA  51          HB1       ALA  51  10.908   7.803  10.935
  408   2HB   ALA  51          HB2       ALA  51   9.976   6.361  11.337
  409   3HB   ALA  51          HB3       ALA  51   9.709   7.181   9.800
  410    H    ASN  52           HN       ASN  52  10.720   5.761   7.396
  411    HA   ASN  52           HA       ASN  52   9.162   3.397   7.748
  412   1HB   ASN  52          HB1       ASN  52   8.769   5.281   6.086
  413   2HB   ASN  52          HB2       ASN  52  10.052   4.575   5.114
  414   1HD2  ASN  52          HD21      ASN  52   8.525   4.129   3.387
  415   2HD2  ASN  52          HD22      ASN  52   7.520   2.733   3.534
  416    H    ILE  53           HN       ILE  53  12.418   3.978   6.490
  417    HA   ILE  53           HA       ILE  53  12.950   1.337   5.647
  418    HB   ILE  53           HB       ILE  53  14.782   3.580   6.438
  419   1HG1  ILE  53          HG11      ILE  53  14.075   2.518   3.681
  420   2HG1  ILE  53          HG12      ILE  53  13.287   3.905   4.427
  421   1HG2  ILE  53          HG21      ILE  53  15.582   1.097   4.905
  422   2HG2  ILE  53          HG22      ILE  53  15.880   1.316   6.630
  423   3HG2  ILE  53          HG23      ILE  53  16.632   2.401   5.462
  424   1HD1  ILE  53          HD11      ILE  53  15.492   5.051   4.524
  425   2HD1  ILE  53          HD12      ILE  53  14.969   4.682   2.881
  426   3HD1  ILE  53          HD13      ILE  53  16.200   3.687   3.658
  427    H    LYS  54           HN       LYS  54  14.465   2.888   8.532
  428    HA   LYS  54           HA       LYS  54  15.221   0.801  10.019
  429   1HB   LYS  54          HB1       LYS  54  13.745   3.241  11.004
  430   2HB   LYS  54          HB2       LYS  54  14.688   2.155  12.028
  431   1HG   LYS  54          HG1       LYS  54  16.712   2.659  10.805
  432   2HG   LYS  54          HG2       LYS  54  15.808   3.627   9.637
  433   1HD   LYS  54          HD1       LYS  54  15.166   5.178  11.469
  434   2HD   LYS  54          HD2       LYS  54  16.174   4.235  12.579
  435   1HE   LYS  54          HE1       LYS  54  18.163   4.808  11.432
  436   2HE   LYS  54          HE2       LYS  54  17.274   5.393  10.022
  437   1HZ   LYS  54          HZ1       LYS  54  16.364   7.160  11.500
  438   2HZ   LYS  54          HZ2       LYS  54  18.031   7.261  11.210
  439   3HZ   LYS  54          HZ3       LYS  54  17.467   6.656  12.687
  440    H    LYS  55           HN       LYS  55  11.960   1.255   9.125
  441    HA   LYS  55           HA       LYS  55  10.777  -0.196  11.343
  442   1HB   LYS  55          HB1       LYS  55   9.612   1.705  10.502
  443   2HB   LYS  55          HB2       LYS  55   9.657   1.093   8.865
  444   1HG   LYS  55          HG1       LYS  55   7.489   0.711   9.391
  445   2HG   LYS  55          HG2       LYS  55   8.192  -0.829   9.853
  446   1HD   LYS  55          HD1       LYS  55   7.567   1.424  11.770
  447   2HD   LYS  55          HD2       LYS  55   6.514   0.045  11.465
  448   1HE   LYS  55          HE1       LYS  55   9.315  -0.072  12.605
  449   2HE   LYS  55          HE2       LYS  55   7.817  -0.276  13.515
  450   1HZ   LYS  55          HZ1       LYS  55   8.805  -2.056  11.345
  451   2HZ   LYS  55          HZ2       LYS  55   7.326  -2.228  12.141
  452   3HZ   LYS  55          HZ3       LYS  55   8.767  -2.413  13.002
  453    H    ASN  56           HN       ASN  56  11.487  -0.857   7.972
  454    HA   ASN  56           HA       ASN  56  10.916  -2.552   6.551
  455   1HB   ASN  56          HB1       ASN  56  13.118  -3.122   8.365
  456   2HB   ASN  56          HB2       ASN  56  12.469  -4.572   7.632
  457   1HD2  ASN  56          HD21      ASN  56  13.974  -1.404   6.838
  458   2HD2  ASN  56          HD22      ASN  56  14.221  -1.969   5.243
  459    H    VAL  57           HN       VAL  57   8.606  -2.550   7.860
  460    HA   VAL  57           HA       VAL  57   8.034  -4.989   9.235
  461    HB   VAL  57           HB       VAL  57   6.742  -2.556   8.932
  462   1HG1  VAL  57          HG11      VAL  57   4.435  -3.061   8.380
  463   2HG1  VAL  57          HG12      VAL  57   4.882  -4.699   7.906
  464   3HG1  VAL  57          HG13      VAL  57   5.463  -3.321   6.971
  465   1HG2  VAL  57          HG21      VAL  57   5.887  -5.127  10.237
  466   2HG2  VAL  57          HG22      VAL  57   5.226  -3.535  10.605
  467   3HG2  VAL  57          HG23      VAL  57   6.925  -3.878  10.926
  468    H    LEU  58           HN       LEU  58   7.289  -6.913   8.459
  469    HA   LEU  58           HA       LEU  58   7.495  -7.333   5.622
  470   1HB   LEU  58          HB1       LEU  58   8.381  -8.974   7.250
  471   2HB   LEU  58          HB2       LEU  58   6.741  -9.295   7.799
  472    HG   LEU  58           HG       LEU  58   7.137  -9.586   4.880
  473   1HD1  LEU  58          HD11      LEU  58   8.431 -11.504   6.829
  474   2HD1  LEU  58          HD12      LEU  58   9.267 -10.485   5.658
  475   3HD1  LEU  58          HD13      LEU  58   8.220 -11.790   5.100
  476   1HD2  LEU  58          HD21      LEU  58   5.932 -11.432   6.955
  477   2HD2  LEU  58          HD22      LEU  58   5.818 -11.614   5.205
  478   3HD2  LEU  58          HD23      LEU  58   5.035 -10.250   6.001
  479    H    TRP  59           HN       TRP  59   5.911  -6.450   4.481
  480    HA   TRP  59           HA       TRP  59   3.255  -6.051   5.206
  481   1HB   TRP  59          HB1       TRP  59   4.453  -6.402   2.459
  482   2HB   TRP  59          HB2       TRP  59   2.858  -5.751   2.781
  483    HD1  TRP  59           HD1      TRP  59   5.929  -4.531   1.675
  484    HE1  TRP  59           HE1      TRP  59   6.376  -2.095   2.395
  485    HE3  TRP  59           HE3      TRP  59   2.398  -4.034   5.341
  486    HZ2  TRP  59           HZ2      TRP  59   5.481  -0.236   4.374
  487    HZ3  TRP  59           HZ3      TRP  59   2.200  -1.921   6.595
  488    HH2  TRP  59           HH2      TRP  59   3.711  -0.025   6.133
  489    H    ASP  60           HN       ASP  60   1.876  -7.511   5.743
  490    HA   ASP  60           HA       ASP  60   1.527 -10.047   4.323
  491   1HB   ASP  60          HB1       ASP  60   2.038 -10.995   6.287
  492   2HB   ASP  60          HB2       ASP  60   2.043  -9.442   7.102
  493    H    GLU  61           HN       GLU  61  -0.869 -10.839   5.276
  494    HA   GLU  61           HA       GLU  61  -2.706  -9.245   3.787
  495   1HB   GLU  61          HB1       GLU  61  -2.697 -11.836   4.184
  496   2HB   GLU  61          HB2       GLU  61  -3.596 -11.438   5.645
  497   1HG   GLU  61          HG1       GLU  61  -5.461 -11.416   4.423
  498   2HG   GLU  61          HG2       GLU  61  -4.840  -9.993   3.582
  499    H    ASN  62           HN       ASN  62  -2.598 -10.087   7.270
  500    HA   ASN  62           HA       ASN  62  -4.575  -8.185   8.013
  501   1HB   ASN  62          HB1       ASN  62  -4.304 -10.171   9.301
  502   2HB   ASN  62          HB2       ASN  62  -2.598  -9.855   9.567
  503   1HD2  ASN  62          HD21      ASN  62  -2.002  -8.509  11.224
  504   2HD2  ASN  62          HD22      ASN  62  -3.126  -7.835  12.349
  505    H    ASN  63           HN       ASN  63  -0.981  -8.114   8.375
  506    HA   ASN  63           HA       ASN  63  -0.705  -5.685   9.628
  507   1HB   ASN  63          HB1       ASN  63   1.227  -6.901   9.498
  508   2HB   ASN  63          HB2       ASN  63   0.994  -7.316   7.811
  509   1HD2  ASN  63          HD21      ASN  63   1.712  -4.416   9.826
  510   2HD2  ASN  63          HD22      ASN  63   2.620  -3.760   8.507
  511    H    MET  64           HN       MET  64  -0.969  -6.031   6.018
  512    HA   MET  64           HA       MET  64  -0.526  -3.367   5.382
  513   1HB   MET  64          HB1       MET  64  -0.683  -5.183   3.744
  514   2HB   MET  64          HB2       MET  64  -2.417  -5.281   4.013
  515   1HG   MET  64          HG1       MET  64  -2.578  -2.902   3.249
  516   2HG   MET  64          HG2       MET  64  -0.884  -2.990   2.807
  517   1HE   MET  64          HE1       MET  64  -3.773  -5.745   2.277
  518   2HE   MET  64          HE2       MET  64  -4.378  -5.167   0.723
  519   3HE   MET  64          HE3       MET  64  -4.497  -4.140   2.153
  520    H    SER  65           HN       SER  65  -3.592  -4.803   6.503
  521    HA   SER  65           HA       SER  65  -5.158  -2.459   6.248
  522   1HB   SER  65          HB1       SER  65  -5.784  -4.524   8.315
  523   2HB   SER  65          HB2       SER  65  -6.873  -3.622   7.270
  524    HG   SER  65           HG       SER  65  -5.636  -6.015   6.867
  525    H    GLU  66           HN       GLU  66  -3.259  -3.704   8.978
  526    HA   GLU  66           HA       GLU  66  -3.999  -1.873  10.944
  527   1HB   GLU  66          HB1       GLU  66  -2.709  -3.441  11.938
  528   2HB   GLU  66          HB2       GLU  66  -1.833  -3.785  10.450
  529   1HG   GLU  66          HG1       GLU  66  -0.646  -1.515  10.926
  530   2HG   GLU  66          HG2       GLU  66  -1.227  -1.764  12.572
  531    H    TYR  67           HN       TYR  67  -1.491  -1.662   8.472
  532    HA   TYR  67           HA       TYR  67  -0.516   0.932   9.134
  533   1HB   TYR  67          HB1       TYR  67   0.934  -0.685   8.139
  534   2HB   TYR  67          HB2       TYR  67  -0.145  -0.899   6.774
  535    HD1  TYR  67           HD1      TYR  67   0.236   0.278   4.780
  536    HD2  TYR  67           HD2      TYR  67   1.998   1.653   8.448
  537    HE1  TYR  67           HE1      TYR  67   1.675   1.850   3.492
  538    HE2  TYR  67           HE2      TYR  67   3.483   3.191   7.178
  539    HH   TYR  67           HH       TYR  67   4.452   3.292   4.897
  540    H    LEU  68           HN       LEU  68  -2.779  -0.235   6.568
  541    HA   LEU  68           HA       LEU  68  -2.976   2.201   5.211
  542   1HB   LEU  68          HB1       LEU  68  -4.897  -0.082   5.514
  543   2HB   LEU  68          HB2       LEU  68  -5.279   1.324   4.536
  544    HG   LEU  68           HG       LEU  68  -3.025  -0.644   4.086
  545   1HD1  LEU  68          HD11      LEU  68  -5.291  -1.344   3.448
  546   2HD1  LEU  68          HD12      LEU  68  -4.294  -1.067   2.020
  547   3HD1  LEU  68          HD13      LEU  68  -5.490   0.134   2.508
  548   1HD2  LEU  68          HD21      LEU  68  -2.595   0.647   1.989
  549   2HD2  LEU  68          HD22      LEU  68  -2.169   1.549   3.443
  550   3HD2  LEU  68          HD23      LEU  68  -3.666   1.916   2.587
  551    H    THR  69           HN       THR  69  -4.845   1.171   8.086
  552    HA   THR  69           HA       THR  69  -6.736   3.221   8.102
  553    HB   THR  69           HB       THR  69  -5.622   2.239  10.689
  554    HG1  THR  69           HG1      THR  69  -5.724   0.376   9.488
  555   1HG2  THR  69          HG21      THR  69  -8.001   2.094  11.285
  556   2HG2  THR  69          HG22      THR  69  -8.445   2.619   9.661
  557   3HG2  THR  69          HG23      THR  69  -7.589   3.720  10.740
  558    H    ASN  70           HN       ASN  70  -3.360   3.337   9.108
  559    HA   ASN  70           HA       ASN  70  -3.330   6.170   9.026
  560   1HB   ASN  70          HB1       ASN  70  -4.391   5.759  11.274
  561   2HB   ASN  70          HB2       ASN  70  -2.879   5.017  11.785
  562   1HD2  ASN  70          HD21      ASN  70  -4.067   7.324  12.978
  563   2HD2  ASN  70          HD22      ASN  70  -2.802   8.490  12.816
  564    HA   PRO  71           HA       PRO  71   0.711   4.198   7.951
  565   1HB   PRO  71          HB1       PRO  71   1.389   6.243   6.233
  566   2HB   PRO  71          HB2       PRO  71   0.510   4.786   5.762
  567   1HG   PRO  71          HG1       PRO  71  -0.541   7.511   6.402
  568   2HG   PRO  71          HG2       PRO  71  -1.040   6.389   5.123
  569   1HD   PRO  71          HD1       PRO  71  -2.475   6.690   7.372
  570   2HD   PRO  71          HD2       PRO  71  -2.322   5.112   6.571
  571    H    LYS  72           HN       LYS  72   0.138   7.664   8.534
  572    HA   LYS  72           HA       LYS  72   2.725   8.403   9.300
  573   1HB   LYS  72          HB1       LYS  72   0.021   9.594   9.858
  574   2HB   LYS  72          HB2       LYS  72   1.480  10.300  10.532
  575   1HG   LYS  72          HG1       LYS  72   1.458   9.806   7.610
  576   2HG   LYS  72          HG2       LYS  72   0.409  11.083   8.214
  577   1HD   LYS  72          HD1       LYS  72   2.462  12.021   9.390
  578   2HD   LYS  72          HD2       LYS  72   3.409  10.879   8.436
  579   1HE   LYS  72          HE1       LYS  72   2.125  11.930   6.419
  580   2HE   LYS  72          HE2       LYS  72   1.827  13.258   7.530
  581   1HZ   LYS  72          HZ1       LYS  72   4.298  13.357   7.830
  582   2HZ   LYS  72          HZ2       LYS  72   3.740  13.792   6.296
  583   3HZ   LYS  72          HZ3       LYS  72   4.432  12.270   6.532
  584    H    LYS  73           HN       LYS  73   0.123   6.980  11.204
  585    HA   LYS  73           HA       LYS  73   1.438   7.417  13.712
  586   1HB   LYS  73          HB1       LYS  73  -0.983   7.226  13.629
  587   2HB   LYS  73          HB2       LYS  73  -0.859   5.582  13.018
  588   1HG   LYS  73          HG1       LYS  73  -1.392   5.421  15.327
  589   2HG   LYS  73          HG2       LYS  73   0.297   4.959  15.162
  590   1HD   LYS  73          HD1       LYS  73   0.522   7.636  15.672
  591   2HD   LYS  73          HD2       LYS  73  -0.918   7.228  16.602
  592   1HE   LYS  73          HE1       LYS  73   0.920   6.975  18.080
  593   2HE   LYS  73          HE2       LYS  73   0.424   5.346  17.634
  594   1HZ   LYS  73          HZ1       LYS  73   2.723   5.319  17.474
  595   2HZ   LYS  73          HZ2       LYS  73   2.806   6.847  16.758
  596   3HZ   LYS  73          HZ3       LYS  73   2.230   5.533  15.866
  597    H    TYR  74           HN       TYR  74   1.327   4.685  11.462
  598    HA   TYR  74           HA       TYR  74   2.806   2.886  13.095
  599   1HB   TYR  74          HB1       TYR  74   1.267   2.482  11.022
  600   2HB   TYR  74          HB2       TYR  74   2.761   2.702  10.111
  601    HD1  TYR  74           HD1      TYR  74   3.299   0.504   9.324
  602    HD2  TYR  74           HD2      TYR  74   2.283   1.196  13.444
  603    HE1  TYR  74           HE1      TYR  74   3.889  -1.862   9.866
  604    HE2  TYR  74           HE2      TYR  74   2.858  -1.152  13.997
  605    HH   TYR  74           HH       TYR  74   2.869  -3.416  12.554
  606    H    ILE  75           HN       ILE  75   3.759   5.084  10.517
  607    HA   ILE  75           HA       ILE  75   6.591   4.769  11.237
  608    HB   ILE  75           HB       ILE  75   5.337   5.050   8.510
  609   1HG1  ILE  75          HG11      ILE  75   7.301   3.288   8.145
  610   2HG1  ILE  75          HG12      ILE  75   7.145   3.078   9.883
  611   1HG2  ILE  75          HG21      ILE  75   7.655   5.484   7.656
  612   2HG2  ILE  75          HG22      ILE  75   8.184   5.691   9.325
  613   3HG2  ILE  75          HG23      ILE  75   7.003   6.801   8.632
  614   1HD1  ILE  75          HD11      ILE  75   5.858   1.381   8.760
  615   2HD1  ILE  75          HD12      ILE  75   5.007   2.594   7.804
  616   3HD1  ILE  75          HD13      ILE  75   4.743   2.501   9.545
  617    HA   PRO  76           HA       PRO  76   5.524   9.024  12.442
  618   1HB   PRO  76          HB1       PRO  76   7.792   9.373  13.929
  619   2HB   PRO  76          HB2       PRO  76   6.328   8.595  14.537
  620   1HG   PRO  76          HG1       PRO  76   8.842   7.353  13.497
  621   2HG   PRO  76          HG2       PRO  76   7.855   6.884  14.893
  622   1HD   PRO  76          HD1       PRO  76   7.728   5.577  12.535
  623   2HD   PRO  76          HD2       PRO  76   6.312   5.770  13.588
  624    H    GLY  77           HN       GLY  77   5.792  10.000  10.416
  625   1HA   GLY  77          HA1       GLY  77   7.143  11.929   9.633
  626   2HA   GLY  77          HA2       GLY  77   8.531  10.863   9.729
  627    H    THR  78           HN       THR  78   6.087   8.964   8.566
  628    HA   THR  78           HA       THR  78   7.100   8.466   6.067
  629    HB   THR  78           HB       THR  78   5.178   7.373   7.557
  630    HG1  THR  78           HG1      THR  78   6.315   6.833   5.280
  631   1HG2  THR  78          HG21      THR  78   3.089   7.246   6.197
  632   2HG2  THR  78          HG22      THR  78   3.647   8.658   5.300
  633   3HG2  THR  78          HG23      THR  78   3.324   8.783   7.029
  634    H    LYS  79           HN       LYS  79   6.573   8.974   3.956
  635    HA   LYS  79           HA       LYS  79   5.752  11.695   3.470
  636   1HB   LYS  79          HB1       LYS  79   6.398   9.518   1.481
  637   2HB   LYS  79          HB2       LYS  79   6.339  11.243   1.162
  638   1HG   LYS  79          HG1       LYS  79   8.255  11.484   2.811
  639   2HG   LYS  79          HG2       LYS  79   8.392   9.720   2.753
  640   1HD   LYS  79          HD1       LYS  79   8.183  10.556   0.070
  641   2HD   LYS  79          HD2       LYS  79   9.319  11.677   0.833
  642   1HE   LYS  79          HE1       LYS  79  10.729   9.952   0.178
  643   2HE   LYS  79          HE2       LYS  79  10.363   9.509   1.845
  644   1HZ   LYS  79          HZ1       LYS  79   8.602   8.475  -0.243
  645   2HZ   LYS  79          HZ2       LYS  79   9.103   7.756   1.202
  646   3HZ   LYS  79          HZ3       LYS  79  10.151   7.799  -0.120
  647    H    MET  80           HN       MET  80   3.984   8.697   3.521
  648    HA   MET  80           HA       MET  80   2.064   9.474   1.544
  649   1HB   MET  80          HB1       MET  80   2.230   7.193   1.571
  650   2HB   MET  80          HB2       MET  80   2.408   7.112   3.327
  651   1HG   MET  80          HG1       MET  80   0.167   7.245   3.717
  652   2HG   MET  80          HG2       MET  80  -0.150   8.156   2.252
  653   1HE   MET  80          HE1       MET  80   1.662   4.765   2.913
  654   2HE   MET  80          HE2       MET  80   0.415   3.586   2.509
  655   3HE   MET  80          HE3       MET  80   0.215   4.634   3.913
  656    H    ALA  81           HN       ALA  81   0.966  11.211   1.907
  657    HA   ALA  81           HA       ALA  81  -0.279  11.783   4.461
  658   1HB   ALA  81          HB1       ALA  81  -0.442  14.026   3.745
  659   2HB   ALA  81          HB2       ALA  81  -0.112  13.588   2.070
  660   3HB   ALA  81          HB3       ALA  81   1.157  13.439   3.285
  661    H    PHE  82           HN       PHE  82  -1.313   9.884   2.397
  662    HA   PHE  82           HA       PHE  82  -3.654  10.484   1.170
  663   1HB   PHE  82          HB1       PHE  82  -2.651   8.484   0.599
  664   2HB   PHE  82          HB2       PHE  82  -2.487   7.963   2.271
  665    HD1  PHE  82           HD1      PHE  82  -5.003   8.545  -0.435
  666    HD2  PHE  82           HD2      PHE  82  -4.076   6.543   3.259
  667    HE1  PHE  82           HE1      PHE  82  -7.150   7.292  -0.572
  668    HE2  PHE  82           HE2      PHE  82  -6.224   5.303   3.129
  669    HZ   PHE  82           HZ       PHE  82  -7.770   5.693   1.223
  670    H    GLY  83           HN       GLY  83  -3.326  10.146   4.646
  671   1HA   GLY  83          HA1       GLY  83  -5.056  10.993   6.079
  672   2HA   GLY  83          HA2       GLY  83  -6.237  10.542   4.869
  673    H    GLY  84           HN       GLY  84  -5.252   7.809   4.551
  674   1HA   GLY  84          HA1       GLY  84  -5.078   5.739   5.607
  675   2HA   GLY  84          HA2       GLY  84  -5.406   6.509   7.148
  676    H    LEU  85           HN       LEU  85  -6.597   4.347   5.042
  677    HA   LEU  85           HA       LEU  85  -9.394   4.961   4.984
  678   1HB   LEU  85          HB1       LEU  85  -7.723   2.618   4.144
  679   2HB   LEU  85          HB2       LEU  85  -9.465   2.465   4.231
  680    HG   LEU  85           HG       LEU  85  -7.947   4.408   2.470
  681   1HD1  LEU  85          HD11      LEU  85  -7.854   1.997   1.824
  682   2HD1  LEU  85          HD12      LEU  85  -8.698   3.007   0.650
  683   3HD1  LEU  85          HD13      LEU  85  -9.618   1.989   1.758
  684   1HD2  LEU  85          HD21      LEU  85 -10.921   3.837   2.563
  685   2HD2  LEU  85          HD22      LEU  85 -10.096   4.904   1.427
  686   3HD2  LEU  85          HD23      LEU  85 -10.159   5.319   3.140
  687    H    LYS  86           HN       LYS  86 -10.300   5.103   6.848
  688    HA   LYS  86           HA       LYS  86  -9.889   3.509   9.163
  689   1HB   LYS  86          HB1       LYS  86 -12.125   5.468   8.637
  690   2HB   LYS  86          HB2       LYS  86 -11.508   4.945  10.198
  691   1HG   LYS  86          HG1       LYS  86  -9.779   6.412   8.211
  692   2HG   LYS  86          HG2       LYS  86 -10.787   7.256   9.389
  693   1HD   LYS  86          HD1       LYS  86  -9.630   6.039  11.214
  694   2HD   LYS  86          HD2       LYS  86  -8.592   5.264  10.018
  695   1HE   LYS  86          HE1       LYS  86  -8.772   8.252  10.454
  696   2HE   LYS  86          HE2       LYS  86  -7.532   7.216  11.156
  697   1HZ   LYS  86          HZ1       LYS  86  -8.000   7.448   8.238
  698   2HZ   LYS  86          HZ2       LYS  86  -6.688   6.720   9.016
  699   3HZ   LYS  86          HZ3       LYS  86  -6.879   8.398   9.082
  700    H    LYS  87           HN       LYS  87 -12.182   3.320   6.542
  701    HA   LYS  87           HA       LYS  87 -14.146   1.700   7.888
  702   1HB   LYS  87          HB1       LYS  87 -13.725   2.179   4.948
  703   2HB   LYS  87          HB2       LYS  87 -15.149   1.496   5.683
  704   1HG   LYS  87          HG1       LYS  87 -15.450   3.836   6.790
  705   2HG   LYS  87          HG2       LYS  87 -14.304   4.377   5.525
  706   1HD   LYS  87          HD1       LYS  87 -15.790   2.599   4.165
  707   2HD   LYS  87          HD2       LYS  87 -16.992   3.162   5.276
  708   1HE   LYS  87          HE1       LYS  87 -17.341   5.064   4.091
  709   2HE   LYS  87          HE2       LYS  87 -15.655   5.160   3.533
  710   1HZ   LYS  87          HZ1       LYS  87 -17.555   3.027   2.706
  711   2HZ   LYS  87          HZ2       LYS  87 -15.996   3.269   2.109
  712   3HZ   LYS  87          HZ3       LYS  87 -17.214   4.399   1.767
  713    H    GLU  88           HN       GLU  88 -13.646  -0.360   8.389
  714    HA   GLU  88           HA       GLU  88 -11.726  -2.016   7.253
  715   1HB   GLU  88          HB1       GLU  88 -12.858  -2.216   9.492
  716   2HB   GLU  88          HB2       GLU  88 -14.221  -2.952   8.652
  717   1HG   GLU  88          HG1       GLU  88 -12.502  -4.625   7.710
  718   2HG   GLU  88          HG2       GLU  88 -11.427  -4.021   8.978
  719    H    LYS  89           HN       LYS  89 -15.242  -2.045   6.532
  720    HA   LYS  89           HA       LYS  89 -15.293  -4.273   4.881
  721   1HB   LYS  89          HB1       LYS  89 -17.063  -1.918   4.332
  722   2HB   LYS  89          HB2       LYS  89 -17.452  -3.637   4.322
  723   1HG   LYS  89          HG1       LYS  89 -16.601  -2.344   6.879
  724   2HG   LYS  89          HG2       LYS  89 -18.246  -2.111   6.301
  725   1HD   LYS  89          HD1       LYS  89 -18.403  -3.948   7.759
  726   2HD   LYS  89          HD2       LYS  89 -18.331  -4.695   6.154
  727   1HE   LYS  89          HE1       LYS  89 -16.230  -5.529   6.479
  728   2HE   LYS  89          HE2       LYS  89 -15.728  -4.162   7.474
  729   1HZ   LYS  89          HZ1       LYS  89 -17.158  -6.608   8.267
  730   2HZ   LYS  89          HZ2       LYS  89 -17.344  -5.198   9.179
  731   3HZ   LYS  89          HZ3       LYS  89 -15.807  -5.870   8.982
  732    H    ASP  90           HN       ASP  90 -14.629  -0.968   4.107
  733    HA   ASP  90           HA       ASP  90 -14.326  -1.037   1.359
  734   1HB   ASP  90          HB1       ASP  90 -13.496   0.701   3.635
  735   2HB   ASP  90          HB2       ASP  90 -12.793   1.016   2.060
  736    H    ARG  91           HN       ARG  91 -11.792  -1.474   3.920
  737    HA   ARG  91           HA       ARG  91  -9.719  -1.944   2.002
  738   1HB   ARG  91          HB1       ARG  91  -9.580  -2.802   4.896
  739   2HB   ARG  91          HB2       ARG  91  -8.238  -2.522   3.792
  740   1HG   ARG  91          HG1       ARG  91  -8.675  -0.161   3.763
  741   2HG   ARG  91          HG2       ARG  91 -10.154  -0.373   4.684
  742   1HD   ARG  91          HD1       ARG  91  -7.314  -0.710   5.644
  743   2HD   ARG  91          HD2       ARG  91  -8.470   0.516   6.136
  744    HE   ARG  91           HE       ARG  91  -8.432  -1.991   6.261
  745   1HH1  ARG  91          HH21      ARG  91  -9.181   0.948   7.957
  746   2HH1  ARG  91          HH22      ARG  91  -9.917   0.372   9.412
  747   1HH2  ARG  91          HH11      ARG  91  -9.607  -2.956   8.626
  748   2HH2  ARG  91          HH12      ARG  91 -10.189  -1.805   9.775
  749    H    ASN  92           HN       ASN  92 -11.861  -4.117   3.799
  750    HA   ASN  92           HA       ASN  92 -10.733  -6.553   3.449
  751   1HB   ASN  92          HB1       ASN  92 -13.617  -5.710   3.281
  752   2HB   ASN  92          HB2       ASN  92 -13.148  -7.399   3.168
  753   1HD2  ASN  92          HD21      ASN  92 -14.831  -6.576   5.131
  754   2HD2  ASN  92          HD22      ASN  92 -13.953  -6.887   6.589
  755    H    ASP  93           HN       ASP  93 -12.836  -5.060   0.941
  756    HA   ASP  93           HA       ASP  93 -12.289  -6.961  -1.068
  757   1HB   ASP  93          HB1       ASP  93 -14.112  -5.015  -0.848
  758   2HB   ASP  93          HB2       ASP  93 -12.959  -4.179  -1.875
  759    H    LEU  94           HN       LEU  94 -10.661  -3.815  -0.368
  760    HA   LEU  94           HA       LEU  94  -9.014  -3.645  -2.557
  761   1HB   LEU  94          HB1       LEU  94  -9.204  -2.469   0.118
  762   2HB   LEU  94          HB2       LEU  94  -7.600  -2.524  -0.511
  763    HG   LEU  94           HG       LEU  94  -9.842  -1.380  -2.144
  764   1HD1  LEU  94          HD11      LEU  94  -9.627  -0.317   0.153
  765   2HD1  LEU  94          HD12      LEU  94  -9.470   0.771  -1.229
  766   3HD1  LEU  94          HD13      LEU  94  -8.031   0.238  -0.361
  767   1HD2  LEU  94          HD21      LEU  94  -8.160  -0.087  -3.269
  768   2HD2  LEU  94          HD22      LEU  94  -7.642  -1.772  -3.287
  769   3HD2  LEU  94          HD23      LEU  94  -6.912  -0.638  -2.152
  770    H    ILE  95           HN       ILE  95  -8.503  -5.503   0.416
  771    HA   ILE  95           HA       ILE  95  -5.833  -6.279  -0.013
  772    HB   ILE  95           HB       ILE  95  -7.981  -7.764   1.517
  773   1HG1  ILE  95          HG11      ILE  95  -6.012  -5.702   2.560
  774   2HG1  ILE  95          HG12      ILE  95  -7.687  -5.335   2.159
  775   1HG2  ILE  95          HG21      ILE  95  -4.969  -7.811   1.851
  776   2HG2  ILE  95          HG22      ILE  95  -5.940  -9.106   1.153
  777   3HG2  ILE  95          HG23      ILE  95  -6.140  -8.675   2.851
  778   1HD1  ILE  95          HD11      ILE  95  -7.472  -5.666   4.546
  779   2HD1  ILE  95          HD12      ILE  95  -6.735  -7.249   4.294
  780   3HD1  ILE  95          HD13      ILE  95  -8.422  -6.983   3.857
  781    H    THR  96           HN       THR  96  -8.899  -7.933  -0.853
  782    HA   THR  96           HA       THR  96  -7.847 -10.204  -2.075
  783    HB   THR  96           HB       THR  96 -10.365  -8.842  -3.032
  784    HG1  THR  96           HG1      THR  96  -9.916  -9.461  -0.573
  785   1HG2  THR  96          HG21      THR  96  -9.636 -11.766  -2.760
  786   2HG2  THR  96          HG22      THR  96  -9.584 -10.857  -4.271
  787   3HG2  THR  96          HG23      THR  96 -11.123 -11.110  -3.447
  788    H    TYR  97           HN       TYR  97  -8.404  -6.981  -3.524
  789    HA   TYR  97           HA       TYR  97  -7.710  -7.705  -6.159
  790   1HB   TYR  97          HB1       TYR  97  -8.889  -5.650  -5.743
  791   2HB   TYR  97          HB2       TYR  97  -7.555  -5.030  -4.779
  792    HD1  TYR  97           HD1      TYR  97  -6.466  -3.286  -5.804
  793    HD2  TYR  97           HD2      TYR  97  -7.815  -6.593  -8.197
  794    HE1  TYR  97           HE1      TYR  97  -5.444  -2.240  -7.815
  795    HE2  TYR  97           HE2      TYR  97  -6.904  -5.499 -10.238
  796    HH   TYR  97           HH       TYR  97  -4.676  -3.287 -10.307
  797    H    LEU  98           HN       LEU  98  -5.643  -6.113  -3.681
  798    HA   LEU  98           HA       LEU  98  -3.244  -6.203  -5.142
  799   1HB   LEU  98          HB1       LEU  98  -4.115  -5.336  -2.603
  800   2HB   LEU  98          HB2       LEU  98  -2.789  -6.456  -2.305
  801    HG   LEU  98           HG       LEU  98  -2.004  -4.098  -2.566
  802   1HD1  LEU  98          HD11      LEU  98  -0.241  -4.577  -4.236
  803   2HD1  LEU  98          HD12      LEU  98  -1.131  -6.015  -4.739
  804   3HD1  LEU  98          HD13      LEU  98  -0.466  -5.914  -3.108
  805   1HD2  LEU  98          HD21      LEU  98  -2.892  -4.427  -5.436
  806   2HD2  LEU  98          HD22      LEU  98  -2.082  -3.028  -4.731
  807   3HD2  LEU  98          HD23      LEU  98  -3.727  -3.434  -4.241
  808    H    LYS  99           HN       LYS  99  -4.637  -8.433  -2.822
  809    HA   LYS  99           HA       LYS  99  -2.604 -10.339  -2.689
  810   1HB   LYS  99          HB1       LYS  99  -4.020 -10.892  -1.043
  811   2HB   LYS  99          HB2       LYS  99  -5.378 -10.108  -1.832
  812   1HG   LYS  99          HG1       LYS  99  -5.897 -12.071  -3.079
  813   2HG   LYS  99          HG2       LYS  99  -4.392 -12.846  -2.623
  814   1HD   LYS  99          HD1       LYS  99  -6.114 -12.166  -0.342
  815   2HD   LYS  99          HD2       LYS  99  -6.840 -13.309  -1.476
  816   1HE   LYS  99          HE1       LYS  99  -5.626 -14.510   0.238
  817   2HE   LYS  99          HE2       LYS  99  -4.840 -14.722  -1.318
  818   1HZ   LYS  99          HZ1       LYS  99  -3.555 -12.601  -0.264
  819   2HZ   LYS  99          HZ2       LYS  99  -3.005 -14.203  -0.216
  820   3HZ   LYS  99          HZ3       LYS  99  -3.863 -13.566   1.100
  821    H    LYS 100           HN       LYS 100  -5.253  -9.998  -5.039
  822    HA   LYS 100           HA       LYS 100  -4.742 -12.417  -6.420
  823   1HB   LYS 100          HB1       LYS 100  -6.911 -11.197  -6.330
  824   2HB   LYS 100          HB2       LYS 100  -6.260 -10.072  -7.498
  825   1HG   LYS 100          HG1       LYS 100  -7.750 -11.719  -8.547
  826   2HG   LYS 100          HG2       LYS 100  -6.105 -11.867  -9.170
  827   1HD   LYS 100          HD1       LYS 100  -6.379 -13.506  -6.875
  828   2HD   LYS 100          HD2       LYS 100  -7.747 -13.813  -7.897
  829   1HE   LYS 100          HE1       LYS 100  -6.192 -15.524  -8.282
  830   2HE   LYS 100          HE2       LYS 100  -6.061 -14.457  -9.690
  831   1HZ   LYS 100          HZ1       LYS 100  -4.135 -13.388  -8.678
  832   2HZ   LYS 100          HZ2       LYS 100  -3.870 -15.051  -8.816
  833   3HZ   LYS 100          HZ3       LYS 100  -4.266 -14.385  -7.311
  834    H    ALA 101           HN       ALA 101  -3.551  -9.287  -6.873
  835    HA   ALA 101           HA       ALA 101  -2.253  -9.534  -9.376
  836   1HB   ALA 101          HB1       ALA 101  -3.153  -7.432  -8.444
  837   2HB   ALA 101          HB2       ALA 101  -1.451  -7.302  -8.887
  838   3HB   ALA 101          HB3       ALA 101  -1.911  -7.475  -7.193
  839    H    THR 102           HN       THR 102  -1.162  -9.899  -6.025
  840    HA   THR 102           HA       THR 102   1.605 -10.408  -6.716
  841    HB   THR 102           HB       THR 102   0.544 -10.921  -3.975
  842    HG1  THR 102           HG1      THR 102  -0.388  -8.912  -4.615
  843   1HG2  THR 102          HG21      THR 102   2.933 -11.224  -4.396
  844   2HG2  THR 102          HG22      THR 102   2.664  -9.851  -3.322
  845   3HG2  THR 102          HG23      THR 102   3.044  -9.579  -5.023
  846    H    GLU 103           HN       GLU 103  -1.228 -12.292  -5.652
  847    HA   GLU 103           HA       GLU 103   0.161 -14.710  -6.560
  848   1HB   GLU 103          HB1       GLU 103  -0.934 -15.943  -4.593
  849   2HB   GLU 103          HB2       GLU 103   0.486 -14.967  -4.257
  850   1HG   GLU 103          HG1       GLU 103  -1.000 -13.151  -3.476
  851   2HG   GLU 103          HG2       GLU 103  -2.379 -14.220  -3.722
  852    HHA  HEC 104           HA       HEC 104   5.028   3.508   1.380
  853    HHB  HEC 104           HB       HEC 104  -0.620   0.606   0.010
  854    HHC  HEC 104           HC       HEC 104  -3.175   6.378  -1.464
  855    HHD  HEC 104           HD       HEC 104   2.744   8.957  -1.287
  856   1HMA  HEC 104          HMA1      HEC 104   1.161  -0.829   1.814
  857   2HMA  HEC 104          HMA2      HEC 104   2.691  -1.170   1.003
  858   3HMA  HEC 104          HMA3      HEC 104   1.212  -0.989   0.058
  859   1HAA  HEC 104          HAA1      HEC 104   4.209  -0.175   1.959
  860   2HAA  HEC 104          HAA2      HEC 104   4.875   1.391   2.383
  861   1HBA  HEC 104          HBA1      HEC 104   5.766   1.604   0.075
  862   2HBA  HEC 104          HBA2      HEC 104   5.159  -0.005  -0.284
  863   1HMB  HEC 104          HMB1      HEC 104  -2.489   0.296  -0.646
  864   2HMB  HEC 104          HMB2      HEC 104  -3.397   0.921  -2.023
  865   3HMB  HEC 104          HMB3      HEC 104  -4.081   1.015  -0.400
  866    HAB  HEC 104           HAB      HEC 104  -4.570   5.041  -1.561
  867   1HBB  HEC 104          HBB1      HEC 104  -4.921   3.763   0.692
  868   2HBB  HEC 104          HBB2      HEC 104  -5.898   2.709  -0.330
  869   3HBB  HEC 104          HBB3      HEC 104  -6.265   4.433  -0.233
  870   1HMC  HEC 104          HMC1      HEC 104  -3.246   8.947  -1.566
  871   2HMC  HEC 104          HMC2      HEC 104  -2.883   8.261  -3.149
  872   3HMC  HEC 104          HMC3      HEC 104  -2.290   9.868  -2.727
  873    HAC  HEC 104           HAC      HEC 104   1.555  10.030  -2.553
  874   1HBC  HEC 104          HBC1      HEC 104   0.732  11.374  -0.859
  875   2HBC  HEC 104          HBC2      HEC 104  -0.920  11.307  -1.471
  876   3HBC  HEC 104          HBC3      HEC 104   0.315  12.198  -2.361
  877   1HMD  HEC 104          HMD1      HEC 104   4.864   9.349  -0.340
  878   2HMD  HEC 104          HMD2      HEC 104   5.339   8.399  -1.748
  879   3HMD  HEC 104          HMD3      HEC 104   6.342   8.388  -0.298
  880   1HAD  HEC 104          HAD1      HEC 104   7.150   6.502   0.446
  881   2HAD  HEC 104          HAD2      HEC 104   6.699   4.940   1.120
  882   1HBD  HEC 104          HBD1      HEC 104   6.150   5.836   3.185
  883   2HBD  HEC 104          HBD2      HEC 104   5.827   7.426   2.528
  884    H2   4NL 105           H2       4NL 105   0.631 -12.658  -1.137
  885    H6   4NL 105           H6       4NL 105   2.642 -13.320   3.496
  886    H3   4NL 105           H3       4NL 105  -1.873 -11.092   2.048
  887    H5   4NL 105           H5       4NL 105  -1.513 -12.052  -1.429
  888    H4   4NL 105           H4       4NL 105   0.002 -11.420   3.682
  889    H1   4NL 105           H1       4NL 105   2.506 -12.985   0.497
  890    H7   4NL 105           H7       4NL 105   3.002 -11.578   3.407
  Start of MODEL   11
    1   1H    THR  -5          HT1       THR  -5 -11.206  -6.588  11.172
    2   2H    THR  -5          HT2       THR  -5 -10.416  -8.037  10.798
    3   3H    THR  -5          HT3       THR  -5  -9.707  -6.948  11.880
    4    HA   THR  -5           HA       THR  -5 -10.640  -8.755  13.112
    5    HB   THR  -5           HB       THR  -5 -12.656  -6.558  13.508
    6    HG1  THR  -5           HG1      THR  -5 -11.107  -5.222  14.327
    7   1HG2  THR  -5          HG21      THR  -5 -10.903  -8.239  15.306
    8   2HG2  THR  -5          HG22      THR  -5 -12.654  -8.338  15.127
    9   3HG2  THR  -5          HG23      THR  -5 -11.924  -6.921  15.883
   10    H    GLU  -4           HN       GLU  -4 -13.053  -7.070  11.092
   11    HA   GLU  -4           HA       GLU  -4 -14.686  -9.524  11.050
   12   1HB   GLU  -4          HB1       GLU  -4 -15.590  -7.199  12.038
   13   2HB   GLU  -4          HB2       GLU  -4 -15.869  -6.859  10.334
   14   1HG   GLU  -4          HG1       GLU  -4 -16.899  -9.350  11.680
   15   2HG   GLU  -4          HG2       GLU  -4 -17.814  -7.848  11.637
   16    H    PHE  -3           HN       PHE  -3 -12.658  -9.660   9.459
   17    HA   PHE  -3           HA       PHE  -3 -12.829  -8.365   6.960
   18   1HB   PHE  -3          HB1       PHE  -3 -10.699  -9.204   7.683
   19   2HB   PHE  -3          HB2       PHE  -3 -11.313 -10.852   7.747
   20    HD1  PHE  -3           HD1      PHE  -3 -10.457  -8.053   5.429
   21    HD2  PHE  -3           HD2      PHE  -3 -11.281 -12.255   5.828
   22    HE1  PHE  -3           HE1      PHE  -3  -9.837  -8.399   3.046
   23    HE2  PHE  -3           HE2      PHE  -3 -10.708 -12.595   3.432
   24    HZ   PHE  -3           HZ       PHE  -3 -10.014 -10.661   2.030
   25    H    LYS  -2           HN       LYS  -2 -13.353  -9.134   4.958
   26    HA   LYS  -2           HA       LYS  -2 -14.888 -11.535   4.532
   27   1HB   LYS  -2          HB1       LYS  -2 -16.365  -9.443   5.360
   28   2HB   LYS  -2          HB2       LYS  -2 -16.268  -9.042   3.646
   29   1HG   LYS  -2          HG1       LYS  -2 -18.260 -10.350   4.029
   30   2HG   LYS  -2          HG2       LYS  -2 -17.113 -11.307   3.095
   31   1HD   LYS  -2          HD1       LYS  -2 -17.950 -12.811   4.692
   32   2HD   LYS  -2          HD2       LYS  -2 -16.394 -12.311   5.350
   33   1HE   LYS  -2          HE1       LYS  -2 -19.010 -11.029   6.144
   34   2HE   LYS  -2          HE2       LYS  -2 -18.330 -12.415   6.990
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.710 -10.477   8.173
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.186  -9.689   6.775
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.316 -11.009   7.363
   38    H    ALA  -1           HN       ALA  -1 -14.365 -12.278   2.615
   39    HA   ALA  -1           HA       ALA  -1 -12.402 -11.161   0.986
   40   1HB   ALA  -1          HB1       ALA  -1 -12.744 -13.539   1.149
   41   2HB   ALA  -1          HB2       ALA  -1 -12.945 -13.045  -0.534
   42   3HB   ALA  -1          HB3       ALA  -1 -14.362 -13.395   0.459
   43    H    GLY   1           HN       GLY   1 -12.414 -10.146  -0.973
   44   1HA   GLY   1          HA1       GLY   1 -14.940  -8.952  -1.915
   45   2HA   GLY   1          HA2       GLY   1 -13.368  -8.173  -2.013
   46    H    SER   2           HN       SER   2 -13.293  -7.875  -4.157
   47    HA   SER   2           HA       SER   2 -12.595 -10.101  -5.856
   48   1HB   SER   2          HB1       SER   2 -14.695  -8.380  -7.066
   49   2HB   SER   2          HB2       SER   2 -14.356 -10.097  -7.317
   50    HG   SER   2           HG       SER   2 -15.136 -10.287  -5.024
   51    H    ALA   3           HN       ALA   3 -11.123  -9.471  -7.366
   52    HA   ALA   3           HA       ALA   3  -9.749  -7.123  -7.227
   53   1HB   ALA   3          HB1       ALA   3 -10.048  -9.010  -9.554
   54   2HB   ALA   3          HB2       ALA   3  -8.820  -9.037  -8.288
   55   3HB   ALA   3          HB3       ALA   3  -8.837  -7.729  -9.469
   56    H    LYS   4           HN       LYS   4 -12.527  -7.663  -9.462
   57    HA   LYS   4           HA       LYS   4 -12.222  -5.191 -10.782
   58   1HB   LYS   4          HB1       LYS   4 -13.422  -7.346 -11.551
   59   2HB   LYS   4          HB2       LYS   4 -14.834  -6.616 -10.788
   60   1HG   LYS   4          HG1       LYS   4 -13.884  -4.505 -12.212
   61   2HG   LYS   4          HG2       LYS   4 -13.408  -5.841 -13.252
   62   1HD   LYS   4          HD1       LYS   4 -15.543  -5.153 -14.016
   63   2HD   LYS   4          HD2       LYS   4 -15.828  -6.632 -13.092
   64   1HE   LYS   4          HE1       LYS   4 -17.484  -4.882 -12.544
   65   2HE   LYS   4          HE2       LYS   4 -16.501  -5.312 -11.144
   66   1HZ   LYS   4          HZ1       LYS   4 -16.869  -2.877 -11.528
   67   2HZ   LYS   4          HZ2       LYS   4 -15.876  -3.008 -12.888
   68   3HZ   LYS   4          HZ3       LYS   4 -15.251  -3.352 -11.355
   69    H    LYS   5           HN       LYS   5 -12.978  -5.396  -7.668
   70    HA   LYS   5           HA       LYS   5 -14.726  -3.018  -7.748
   71   1HB   LYS   5          HB1       LYS   5 -14.514  -5.190  -5.668
   72   2HB   LYS   5          HB2       LYS   5 -15.186  -3.611  -5.283
   73   1HG   LYS   5          HG1       LYS   5 -16.796  -3.990  -7.235
   74   2HG   LYS   5          HG2       LYS   5 -16.258  -5.671  -7.200
   75   1HD   LYS   5          HD1       LYS   5 -17.020  -4.579  -4.573
   76   2HD   LYS   5          HD2       LYS   5 -18.344  -4.668  -5.735
   77   1HE   LYS   5          HE1       LYS   5 -18.260  -6.716  -4.430
   78   2HE   LYS   5          HE2       LYS   5 -17.823  -7.062  -6.103
   79   1HZ   LYS   5          HZ1       LYS   5 -16.107  -7.016  -3.714
   80   2HZ   LYS   5          HZ2       LYS   5 -15.433  -6.690  -5.235
   81   3HZ   LYS   5          HZ3       LYS   5 -16.204  -8.170  -4.955
   82    H    GLY   6           HN       GLY   6 -11.992  -4.511  -6.003
   83   1HA   GLY   6          HA1       GLY   6 -11.230  -2.219  -4.543
   84   2HA   GLY   6          HA2       GLY   6 -10.181  -3.569  -4.944
   85    H    ALA   7           HN       ALA   7 -10.360  -3.266  -7.827
   86    HA   ALA   7           HA       ALA   7  -8.315  -1.442  -8.341
   87   1HB   ALA   7          HB1       ALA   7  -8.776  -3.388  -9.757
   88   2HB   ALA   7          HB2       ALA   7  -8.710  -1.899 -10.700
   89   3HB   ALA   7          HB3       ALA   7 -10.267  -2.627 -10.314
   90    H    THR   8           HN       THR   8 -11.876  -0.978  -8.752
   91    HA   THR   8           HA       THR   8 -11.631   1.562  -9.982
   92    HB   THR   8           HB       THR   8 -14.041   1.806  -8.791
   93    HG1  THR   8           HG1      THR   8 -13.842  -0.245  -7.783
   94   1HG2  THR   8          HG21      THR   8 -13.500   0.117 -11.236
   95   2HG2  THR   8          HG22      THR   8 -13.548   1.881 -11.216
   96   3HG2  THR   8          HG23      THR   8 -15.003   0.955 -10.845
   97    H    LEU   9           HN       LEU   9 -11.771   0.692  -6.564
   98    HA   LEU   9           HA       LEU   9 -12.037   3.333  -5.545
   99   1HB   LEU   9          HB1       LEU   9 -10.976   0.861  -4.141
  100   2HB   LEU   9          HB2       LEU   9 -11.565   2.332  -3.370
  101    HG   LEU   9           HG       LEU   9 -13.274   0.539  -5.111
  102   1HD1  LEU   9          HD11      LEU   9 -14.352  -0.068  -2.936
  103   2HD1  LEU   9          HD12      LEU   9 -13.023   0.743  -2.107
  104   3HD1  LEU   9          HD13      LEU   9 -12.704  -0.672  -3.109
  105   1HD2  LEU   9          HD21      LEU   9 -14.025   2.804  -3.246
  106   2HD2  LEU   9          HD22      LEU   9 -15.148   1.790  -4.151
  107   3HD2  LEU   9          HD23      LEU   9 -14.055   2.878  -5.010
  108    H    PHE  10           HN       PHE  10  -9.261   1.100  -5.738
  109    HA   PHE  10           HA       PHE  10  -7.226   2.764  -4.858
  110   1HB   PHE  10          HB1       PHE  10  -6.223   0.789  -5.108
  111   2HB   PHE  10          HB2       PHE  10  -7.502   0.220  -6.169
  112    HD1  PHE  10           HD1      PHE  10  -7.244   0.262  -8.604
  113    HD2  PHE  10           HD2      PHE  10  -4.153   1.707  -5.986
  114    HE1  PHE  10           HE1      PHE  10  -5.614   0.207 -10.490
  115    HE2  PHE  10           HE2      PHE  10  -2.565   1.773  -7.896
  116    HZ   PHE  10           HZ       PHE  10  -3.282   1.000 -10.144
  117    H    LYS  11           HN       LYS  11  -8.688   2.565  -8.061
  118    HA   LYS  11           HA       LYS  11  -6.791   3.947  -9.557
  119   1HB   LYS  11          HB1       LYS  11  -9.145   2.677 -10.095
  120   2HB   LYS  11          HB2       LYS  11  -9.557   4.357 -10.438
  121   1HG   LYS  11          HG1       LYS  11  -7.822   4.568 -12.041
  122   2HG   LYS  11          HG2       LYS  11  -7.067   3.060 -11.530
  123   1HD   LYS  11          HD1       LYS  11  -9.723   3.346 -12.952
  124   2HD   LYS  11          HD2       LYS  11  -8.216   2.759 -13.660
  125   1HE   LYS  11          HE1       LYS  11  -9.913   1.430 -11.542
  126   2HE   LYS  11          HE2       LYS  11  -9.556   0.841 -13.162
  127   1HZ   LYS  11          HZ1       LYS  11  -7.134   0.842 -12.340
  128   2HZ   LYS  11          HZ2       LYS  11  -8.160  -0.397 -11.823
  129   3HZ   LYS  11          HZ3       LYS  11  -7.812   0.891 -10.786
  130    H    THR  12           HN       THR  12  -8.832   5.301  -7.193
  131    HA   THR  12           HA       THR  12  -8.020   8.005  -7.902
  132    HB   THR  12           HB       THR  12 -10.453   7.242  -8.596
  133    HG1  THR  12           HG1      THR  12  -9.325   9.265  -8.911
  134   1HG2  THR  12          HG21      THR  12 -12.130   8.267  -7.105
  135   2HG2  THR  12          HG22      THR  12 -10.892   8.424  -5.858
  136   3HG2  THR  12          HG23      THR  12 -11.386   6.824  -6.414
  137    H    ARG  13           HN       ARG  13  -7.403   5.888  -5.861
  138    HA   ARG  13           HA       ARG  13  -7.389   7.574  -3.445
  139   1HB   ARG  13          HB1       ARG  13  -8.019   4.646  -3.694
  140   2HB   ARG  13          HB2       ARG  13  -7.400   5.308  -2.197
  141   1HG   ARG  13          HG1       ARG  13  -9.958   6.140  -3.552
  142   2HG   ARG  13          HG2       ARG  13  -9.834   5.032  -2.193
  143   1HD   ARG  13          HD1       ARG  13 -10.482   7.122  -1.287
  144   2HD   ARG  13          HD2       ARG  13  -8.763   6.950  -0.909
  145    HE   ARG  13           HE       ARG  13  -9.492   8.015  -3.340
  146   1HH1  ARG  13          HH11      ARG  13  -8.733   8.795  -0.018
  147   2HH1  ARG  13          HH12      ARG  13  -7.941  10.310  -0.256
  148   1HH2  ARG  13          HH21      ARG  13  -8.252  10.325  -3.663
  149   2HH2  ARG  13          HH22      ARG  13  -7.692  11.156  -2.254
  150    H    CYS  14           HN       CYS  14  -5.753   5.166  -5.383
  151    HA   CYS  14           HA       CYS  14  -3.244   5.637  -3.907
  152   1HB   CYS  14          HB1       CYS  14  -3.765   3.074  -5.346
  153   2HB   CYS  14          HB2       CYS  14  -2.669   3.394  -4.019
  154    H    LEU  15           HN       LEU  15  -4.713   4.956  -7.079
  155    HA   LEU  15           HA       LEU  15  -2.539   4.837  -8.724
  156   1HB   LEU  15          HB1       LEU  15  -5.014   4.590  -9.269
  157   2HB   LEU  15          HB2       LEU  15  -5.050   6.340  -9.442
  158    HG   LEU  15           HG       LEU  15  -3.216   6.130 -11.168
  159   1HD1  LEU  15          HD11      LEU  15  -2.854   3.975 -12.229
  160   2HD1  LEU  15          HD12      LEU  15  -3.933   3.200 -11.069
  161   3HD1  LEU  15          HD13      LEU  15  -2.405   3.894 -10.525
  162   1HD2  LEU  15          HD21      LEU  15  -5.963   5.021 -11.548
  163   2HD2  LEU  15          HD22      LEU  15  -4.816   4.972 -12.887
  164   3HD2  LEU  15          HD23      LEU  15  -5.263   6.518 -12.164
  165    H    GLN  16           HN       GLN  16  -3.998   7.811  -7.460
  166    HA   GLN  16           HA       GLN  16  -2.859   9.810  -8.853
  167   1HB   GLN  16          HB1       GLN  16  -2.817  11.039  -6.564
  168   2HB   GLN  16          HB2       GLN  16  -4.343  10.494  -7.240
  169   1HG   GLN  16          HG1       GLN  16  -4.137   8.434  -5.790
  170   2HG   GLN  16          HG2       GLN  16  -2.769   9.224  -5.001
  171   1HE2  GLN  16          HE21      GLN  16  -3.197  11.141  -3.739
  172   2HE2  GLN  16          HE22      GLN  16  -4.795  11.497  -3.197
  173    H    CYS  17           HN       CYS  17  -1.077   7.864  -6.480
  174    HA   CYS  17           HA       CYS  17   1.379   9.337  -7.155
  175   1HB   CYS  17          HB1       CYS  17   1.189   7.921  -4.548
  176   2HB   CYS  17          HB2       CYS  17   2.063   9.373  -5.004
  177    H    HIS  18           HN       HIS  18   0.015   6.138  -6.557
  178    HA   HIS  18           HA       HIS  18   2.604   4.811  -6.817
  179   1HB   HIS  18          HB1       HIS  18  -0.102   3.991  -5.826
  180   2HB   HIS  18          HB2       HIS  18   1.113   2.788  -6.203
  181    HD1  HIS  18           HD1      HIS  18   3.544   3.313  -4.761
  182    HD2  HIS  18           HD2      HIS  18  -0.137   4.720  -3.347
  183    HE1  HIS  18           HE1      HIS  18   3.838   3.670  -2.267
  184    H    THR  19           HN       THR  19   2.265   2.528  -7.757
  185    HA   THR  19           HA       THR  19   0.728   2.416 -10.232
  186    HB   THR  19           HB       THR  19   3.019   1.222 -11.030
  187    HG1  THR  19           HG1      THR  19   4.471   3.217 -10.416
  188   1HG2  THR  19          HG21      THR  19   2.404   4.166 -11.292
  189   2HG2  THR  19          HG22      THR  19   1.784   2.884 -12.332
  190   3HG2  THR  19          HG23      THR  19   3.509   3.249 -12.315
  191    H    VAL  20           HN       VAL  20  -0.443   0.566 -10.212
  192    HA   VAL  20           HA       VAL  20  -0.032  -1.472  -8.245
  193    HB   VAL  20           HB       VAL  20  -2.178  -0.446  -9.430
  194   1HG1  VAL  20          HG11      VAL  20  -1.864  -1.518 -11.572
  195   2HG1  VAL  20          HG12      VAL  20  -3.331  -2.102 -10.785
  196   3HG1  VAL  20          HG13      VAL  20  -1.881  -3.107 -10.802
  197   1HG2  VAL  20          HG21      VAL  20  -2.017  -3.148  -8.116
  198   2HG2  VAL  20          HG22      VAL  20  -3.518  -2.281  -8.436
  199   3HG2  VAL  20          HG23      VAL  20  -2.318  -1.589  -7.347
  200    H    GLU  21           HN       GLU  21   0.729  -1.254 -11.601
  201    HA   GLU  21           HA       GLU  21   1.563  -4.073 -11.748
  202   1HB   GLU  21          HB1       GLU  21   1.612  -3.320 -14.326
  203   2HB   GLU  21          HB2       GLU  21   0.157  -3.938 -13.569
  204   1HG   GLU  21          HG1       GLU  21  -0.176  -1.912 -15.007
  205   2HG   GLU  21          HG2       GLU  21  -0.772  -1.748 -13.358
  206    H    LYS  22           HN       LYS  22   3.545  -4.108 -13.619
  207    HA   LYS  22           HA       LYS  22   5.464  -2.184 -12.562
  208   1HB   LYS  22          HB1       LYS  22   5.610  -4.958 -13.124
  209   2HB   LYS  22          HB2       LYS  22   6.816  -4.123 -14.116
  210   1HG   LYS  22          HG1       LYS  22   8.004  -3.398 -12.325
  211   2HG   LYS  22          HG2       LYS  22   6.558  -3.128 -11.351
  212   1HD   LYS  22          HD1       LYS  22   6.384  -5.531 -10.944
  213   2HD   LYS  22          HD2       LYS  22   7.825  -5.802 -11.923
  214   1HE   LYS  22          HE1       LYS  22   8.543  -5.856  -9.658
  215   2HE   LYS  22          HE2       LYS  22   9.084  -4.321 -10.313
  216   1HZ   LYS  22          HZ1       LYS  22   6.860  -4.798  -8.395
  217   2HZ   LYS  22          HZ2       LYS  22   7.069  -3.324  -9.187
  218   3HZ   LYS  22          HZ3       LYS  22   8.272  -3.895  -8.150
  219    H    GLY  23           HN       GLY  23   3.590  -1.540 -14.905
  220   1HA   GLY  23          HA1       GLY  23   5.531  -1.056 -17.047
  221   2HA   GLY  23          HA2       GLY  23   3.800  -0.771 -17.131
  222    H    GLY  24           HN       GLY  24   3.868   0.747 -14.551
  223   1HA   GLY  24          HA1       GLY  24   4.571   3.358 -15.613
  224   2HA   GLY  24          HA2       GLY  24   3.603   3.025 -14.186
  225    HA   PRO  25           HA       PRO  25   8.386   3.429 -13.221
  226   1HB   PRO  25          HB1       PRO  25   8.814   6.138 -13.450
  227   2HB   PRO  25          HB2       PRO  25   9.289   4.952 -14.669
  228   1HG   PRO  25          HG1       PRO  25   6.885   6.727 -14.586
  229   2HG   PRO  25          HG2       PRO  25   7.909   6.290 -15.966
  230   1HD   PRO  25          HD1       PRO  25   5.505   5.146 -15.556
  231   2HD   PRO  25          HD2       PRO  25   6.867   4.243 -16.251
  232    H    HIS  26           HN       HIS  26   9.096   4.371 -11.199
  233    HA   HIS  26           HA       HIS  26   7.125   4.610  -9.234
  234   1HB   HIS  26          HB1       HIS  26  10.029   5.463  -9.257
  235   2HB   HIS  26          HB2       HIS  26   9.035   5.413  -7.811
  236    HD2  HIS  26           HD2      HIS  26  11.190   3.240 -10.040
  237    HE1  HIS  26           HE1      HIS  26   9.591   0.639  -7.090
  238    HE2  HIS  26           HE2      HIS  26  11.306   0.873  -8.946
  239    H    LYS  27           HN       LYS  27   5.737   6.291  -8.952
  240    HA   LYS  27           HA       LYS  27   6.442   8.960  -9.903
  241   1HB   LYS  27          HB1       LYS  27   4.355   7.721 -10.651
  242   2HB   LYS  27          HB2       LYS  27   3.711   8.012  -9.040
  243   1HG   LYS  27          HG1       LYS  27   3.863  10.419  -9.372
  244   2HG   LYS  27          HG2       LYS  27   4.607  10.174 -10.956
  245   1HD   LYS  27          HD1       LYS  27   2.001  10.630 -10.731
  246   2HD   LYS  27          HD2       LYS  27   2.623   9.495 -11.935
  247   1HE   LYS  27          HE1       LYS  27   2.088   7.614 -10.579
  248   2HE   LYS  27          HE2       LYS  27   1.802   8.626  -9.164
  249   1HZ   LYS  27          HZ1       LYS  27  -0.271   7.879 -10.147
  250   2HZ   LYS  27          HZ2       LYS  27   0.144   8.587 -11.624
  251   3HZ   LYS  27          HZ3       LYS  27  -0.129   9.565 -10.273
  252    H    VAL  28           HN       VAL  28   4.129   9.633  -7.745
  253    HA   VAL  28           HA       VAL  28   5.834  10.876  -5.862
  254    HB   VAL  28           HB       VAL  28   2.918  10.275  -5.401
  255   1HG1  VAL  28          HG11      VAL  28   4.679  12.583  -4.554
  256   2HG1  VAL  28          HG12      VAL  28   4.120  11.270  -3.519
  257   3HG1  VAL  28          HG13      VAL  28   2.961  12.415  -4.195
  258   1HG2  VAL  28          HG21      VAL  28   3.961  12.686  -6.898
  259   2HG2  VAL  28          HG22      VAL  28   2.279  12.262  -6.581
  260   3HG2  VAL  28          HG23      VAL  28   3.241  11.282  -7.688
  261    H    GLY  29           HN       GLY  29   4.473   7.726  -6.080
  262   1HA   GLY  29          HA1       GLY  29   5.616   6.921  -3.487
  263   2HA   GLY  29          HA2       GLY  29   4.036   6.352  -4.002
  264    HA   PRO  30           HA       PRO  30   7.626   3.571  -5.588
  265   1HB   PRO  30          HB1       PRO  30   7.298   1.480  -3.887
  266   2HB   PRO  30          HB2       PRO  30   8.396   2.827  -3.568
  267   1HG   PRO  30          HG1       PRO  30   5.615   2.370  -2.548
  268   2HG   PRO  30          HG2       PRO  30   7.055   2.907  -1.663
  269   1HD   PRO  30          HD1       PRO  30   5.166   4.637  -2.486
  270   2HD   PRO  30          HD2       PRO  30   6.887   5.075  -2.452
  271    H    ASN  31           HN       ASN  31   7.368   1.237  -6.343
  272    HA   ASN  31           HA       ASN  31   4.796   0.949  -7.609
  273   1HB   ASN  31          HB1       ASN  31   7.028   0.601  -8.729
  274   2HB   ASN  31          HB2       ASN  31   7.235  -0.854  -7.763
  275   1HD2  ASN  31          HD21      ASN  31   5.332   0.591 -10.362
  276   2HD2  ASN  31          HD22      ASN  31   4.769  -0.924 -10.988
  277    H    LEU  32           HN       LEU  32   3.227  -0.552  -7.119
  278    HA   LEU  32           HA       LEU  32   3.256  -1.868  -4.545
  279   1HB   LEU  32          HB1       LEU  32   1.011  -1.561  -6.541
  280   2HB   LEU  32          HB2       LEU  32   0.859  -2.037  -4.862
  281    HG   LEU  32           HG       LEU  32   1.939   0.670  -5.665
  282   1HD1  LEU  32          HD11      LEU  32  -0.372   1.502  -5.112
  283   2HD1  LEU  32          HD12      LEU  32  -0.919  -0.173  -5.178
  284   3HD1  LEU  32          HD13      LEU  32  -0.252   0.592  -6.619
  285   1HD2  LEU  32          HD21      LEU  32   1.346   1.335  -3.428
  286   2HD2  LEU  32          HD22      LEU  32   2.340  -0.118  -3.327
  287   3HD2  LEU  32          HD23      LEU  32   0.593  -0.228  -3.112
  288    H    HIS  33           HN       HIS  33   3.366  -2.823  -7.897
  289    HA   HIS  33           HA       HIS  33   2.417  -5.417  -7.924
  290   1HB   HIS  33          HB1       HIS  33   3.144  -3.820  -9.827
  291   2HB   HIS  33          HB2       HIS  33   4.755  -4.485  -9.575
  292    HD2  HIS  33           HD2      HIS  33   1.475  -6.567  -9.493
  293    HE1  HIS  33           HE1      HIS  33   3.729  -7.861 -12.855
  294    HE2  HIS  33           HE2      HIS  33   1.684  -8.324 -11.420
  295    H    GLY  34           HN       GLY  34   3.059  -6.656  -6.191
  296   1HA   GLY  34          HA1       GLY  34   4.366  -8.521  -5.564
  297   2HA   GLY  34          HA2       GLY  34   5.771  -7.756  -6.277
  298    H    ILE  35           HN       ILE  35   3.680  -5.993  -3.973
  299    HA   ILE  35           HA       ILE  35   5.969  -5.675  -2.265
  300    HB   ILE  35           HB       ILE  35   4.505  -4.384  -0.751
  301   1HG1  ILE  35          HG11      ILE  35   2.380  -5.129  -2.714
  302   2HG1  ILE  35          HG12      ILE  35   2.263  -4.843  -0.979
  303   1HG2  ILE  35          HG21      ILE  35   4.846  -3.576  -3.624
  304   2HG2  ILE  35          HG22      ILE  35   5.939  -3.297  -2.269
  305   3HG2  ILE  35          HG23      ILE  35   4.392  -2.454  -2.341
  306   1HD1  ILE  35          HD11      ILE  35   2.387  -2.436  -1.337
  307   2HD1  ILE  35          HD12      ILE  35   1.072  -3.129  -2.288
  308   3HD1  ILE  35          HD13      ILE  35   2.587  -2.686  -3.073
  309    H    PHE  36           HN       PHE  36   2.990  -7.598  -1.985
  310    HA   PHE  36           HA       PHE  36   3.248  -8.361   0.679
  311   1HB   PHE  36          HB1       PHE  36   1.933  -9.737  -1.659
  312   2HB   PHE  36          HB2       PHE  36   1.854 -10.367  -0.014
  313    HD1  PHE  36           HD1      PHE  36   1.288  -8.360   1.772
  314    HD2  PHE  36           HD2      PHE  36   0.043  -8.572  -2.341
  315    HE1  PHE  36           HE1      PHE  36  -0.598  -6.817   2.271
  316    HE2  PHE  36           HE2      PHE  36  -1.845  -7.029  -1.845
  317    HZ   PHE  36           HZ       PHE  36  -2.160  -6.142   0.458
  318    H    GLY  37           HN       GLY  37   4.834  -9.285   1.631
  319   1HA   GLY  37          HA1       GLY  37   6.046 -11.344   2.090
  320   2HA   GLY  37          HA2       GLY  37   6.407 -11.441   0.377
  321    H    ARG  38           HN       ARG  38   6.813  -8.273   0.851
  322    HA   ARG  38           HA       ARG  38   9.666  -8.468   1.553
  323   1HB   ARG  38          HB1       ARG  38   8.095  -6.540  -0.174
  324   2HB   ARG  38          HB2       ARG  38   9.727  -6.180   0.371
  325   1HG   ARG  38          HG1       ARG  38  10.673  -7.589  -1.114
  326   2HG   ARG  38          HG2       ARG  38   9.410  -8.806  -0.920
  327   1HD   ARG  38          HD1       ARG  38   8.989  -8.123  -3.083
  328   2HD   ARG  38          HD2       ARG  38   7.946  -7.012  -2.195
  329    HE   ARG  38           HE       ARG  38  10.234  -6.366  -2.182
  330   1HH1  ARG  38          HH21      ARG  38   7.743  -6.521  -4.559
  331   2HH1  ARG  38          HH22      ARG  38   8.036  -4.978  -5.179
  332   1HH2  ARG  38          HH11      ARG  38  10.940  -4.193  -3.881
  333   2HH2  ARG  38          HH12      ARG  38  10.073  -4.351  -5.349
  334    H    HIS  39           HN       HIS  39  10.557  -6.605   2.716
  335    HA   HIS  39           HA       HIS  39   8.825  -5.816   4.913
  336   1HB   HIS  39          HB1       HIS  39  11.788  -5.293   4.515
  337   2HB   HIS  39          HB2       HIS  39  10.880  -5.125   6.021
  338    HD2  HIS  39           HD2      HIS  39  10.111  -7.387   7.287
  339    HE1  HIS  39           HE1      HIS  39  12.347 -10.110   4.903
  340    HE2  HIS  39           HE2      HIS  39  10.910  -9.859   6.982
  341    H    SER  40           HN       SER  40   8.786  -3.530   5.651
  342    HA   SER  40           HA       SER  40   8.072  -1.713   3.701
  343   1HB   SER  40          HB1       SER  40   9.227  -0.714   6.286
  344   2HB   SER  40          HB2       SER  40   7.914  -0.042   5.331
  345    HG   SER  40           HG       SER  40   6.755  -2.034   5.937
  346    H    GLY  41           HN       GLY  41   9.083  -0.360   2.387
  347   1HA   GLY  41          HA1       GLY  41  10.774   1.038   1.596
  348   2HA   GLY  41          HA2       GLY  41  11.814   0.498   2.891
  349    H    GLN  42           HN       GLN  42  10.295  -1.480   0.238
  350    HA   GLN  42           HA       GLN  42  13.031  -2.127  -0.597
  351   1HB   GLN  42          HB1       GLN  42  10.758  -4.048  -0.233
  352   2HB   GLN  42          HB2       GLN  42  12.223  -4.457  -1.118
  353   1HG   GLN  42          HG1       GLN  42  13.506  -3.758   0.973
  354   2HG   GLN  42          HG2       GLN  42  11.952  -3.762   1.801
  355   1HE2  GLN  42          HE21      GLN  42  12.893  -5.470   3.166
  356   2HE2  GLN  42          HE22      GLN  42  12.971  -7.089   2.574
  357    H    ALA  43           HN       ALA  43  11.192  -0.188  -2.017
  358    HA   ALA  43           HA       ALA  43  10.317  -1.316  -4.439
  359   1HB   ALA  43          HB1       ALA  43   9.478   0.788  -3.680
  360   2HB   ALA  43          HB2       ALA  43  10.252   1.024  -5.246
  361   3HB   ALA  43          HB3       ALA  43  11.081   1.516  -3.770
  362    H    GLU  44           HN       GLU  44  11.116  -1.132  -6.585
  363    HA   GLU  44           HA       GLU  44  13.840  -1.802  -6.921
  364   1HB   GLU  44          HB1       GLU  44  11.814  -1.299  -9.120
  365   2HB   GLU  44          HB2       GLU  44  13.294  -2.246  -9.230
  366   1HG   GLU  44          HG1       GLU  44  11.682  -3.895  -8.996
  367   2HG   GLU  44          HG2       GLU  44  12.263  -3.701  -7.354
  368    H    GLY  45           HN       GLY  45  14.725   0.186  -5.966
  369   1HA   GLY  45          HA1       GLY  45  16.404   1.746  -6.624
  370   2HA   GLY  45          HA2       GLY  45  15.445   2.155  -8.030
  371    H    TYR  46           HN       TYR  46  13.112   2.254  -5.852
  372    HA   TYR  46           HA       TYR  46  13.210   5.098  -5.501
  373   1HB   TYR  46          HB1       TYR  46  11.178   4.059  -6.228
  374   2HB   TYR  46          HB2       TYR  46  11.133   3.038  -4.797
  375    HD1  TYR  46           HD1      TYR  46  10.412   6.348  -6.179
  376    HD2  TYR  46           HD2      TYR  46  10.640   4.015  -2.580
  377    HE1  TYR  46           HE1      TYR  46   8.957   8.009  -5.026
  378    HE2  TYR  46           HE2      TYR  46   9.094   5.604  -1.441
  379    HH   TYR  46           HH       TYR  46   7.461   8.166  -3.211
  380    H    SER  47           HN       SER  47  13.240   6.290  -3.631
  381    HA   SER  47           HA       SER  47  14.444   5.036  -1.288
  382   1HB   SER  47          HB1       SER  47  14.238   7.956  -1.264
  383   2HB   SER  47          HB2       SER  47  15.644   6.917  -1.020
  384    HG   SER  47           HG       SER  47  15.604   6.612  -3.357
  385    H    TYR  48           HN       TYR  48  13.701   5.207   0.728
  386    HA   TYR  48           HA       TYR  48  11.001   6.182   1.315
  387   1HB   TYR  48          HB1       TYR  48  12.590   3.835   2.362
  388   2HB   TYR  48          HB2       TYR  48  11.038   4.337   3.026
  389    HD1  TYR  48           HD1      TYR  48   8.981   3.956   1.864
  390    HD2  TYR  48           HD2      TYR  48  12.731   2.883   0.055
  391    HE1  TYR  48           HE1      TYR  48   7.775   2.504   0.245
  392    HE2  TYR  48           HE2      TYR  48  11.537   1.429  -1.568
  393    HH   TYR  48           HH       TYR  48   8.473   0.302  -1.037
  394    H    THR  49           HN       THR  49  10.627   6.974   3.594
  395    HA   THR  49           HA       THR  49  12.539   8.862   4.499
  396    HB   THR  49           HB       THR  49  10.991   8.933   6.575
  397    HG1  THR  49           HG1      THR  49   9.055   7.844   4.909
  398   1HG2  THR  49          HG21      THR  49  10.067   9.695   3.819
  399   2HG2  THR  49          HG22      THR  49  10.967  10.685   4.968
  400   3HG2  THR  49          HG23      THR  49   9.294  10.238   5.309
  401    H    ASP  50           HN       ASP  50  13.268   9.074   6.776
  402    HA   ASP  50           HA       ASP  50  14.966   7.060   7.616
  403   1HB   ASP  50          HB1       ASP  50  15.257   9.401   8.187
  404   2HB   ASP  50          HB2       ASP  50  13.777   9.388   9.142
  405    H    ALA  51           HN       ALA  51  11.617   7.616   8.524
  406    HA   ALA  51           HA       ALA  51  11.620   5.730  10.699
  407   1HB   ALA  51          HB1       ALA  51   9.470   7.454   9.480
  408   2HB   ALA  51          HB2       ALA  51  10.367   7.744  10.970
  409   3HB   ALA  51          HB3       ALA  51   9.223   6.406  10.878
  410    H    ASN  52           HN       ASN  52  10.527   5.650   7.293
  411    HA   ASN  52           HA       ASN  52   8.936   3.296   7.623
  412   1HB   ASN  52          HB1       ASN  52   8.256   4.631   5.847
  413   2HB   ASN  52          HB2       ASN  52   9.899   4.907   5.285
  414   1HD2  ASN  52          HD21      ASN  52   7.078   3.054   4.787
  415   2HD2  ASN  52          HD22      ASN  52   7.778   2.034   3.583
  416    H    ILE  53           HN       ILE  53  12.280   3.854   6.597
  417    HA   ILE  53           HA       ILE  53  12.888   1.179   5.924
  418    HB   ILE  53           HB       ILE  53  14.662   3.461   6.740
  419   1HG1  ILE  53          HG11      ILE  53  14.118   2.330   3.974
  420   2HG1  ILE  53          HG12      ILE  53  13.269   3.722   4.641
  421   1HG2  ILE  53          HG21      ILE  53  15.495   0.884   5.383
  422   2HG2  ILE  53          HG22      ILE  53  15.802   1.276   7.074
  423   3HG2  ILE  53          HG23      ILE  53  16.546   2.239   5.799
  424   1HD1  ILE  53          HD11      ILE  53  16.248   3.559   4.155
  425   2HD1  ILE  53          HD12      ILE  53  15.376   4.958   4.780
  426   3HD1  ILE  53          HD13      ILE  53  15.081   4.399   3.134
  427    H    LYS  54           HN       LYS  54  14.154   2.898   8.838
  428    HA   LYS  54           HA       LYS  54  14.811   0.898  10.491
  429   1HB   LYS  54          HB1       LYS  54  13.248   3.384  11.180
  430   2HB   LYS  54          HB2       LYS  54  14.034   2.348  12.374
  431   1HG   LYS  54          HG1       LYS  54  16.205   2.725  11.305
  432   2HG   LYS  54          HG2       LYS  54  15.435   3.743  10.084
  433   1HD   LYS  54          HD1       LYS  54  14.676   5.267  11.911
  434   2HD   LYS  54          HD2       LYS  54  15.607   4.288  13.055
  435   1HE   LYS  54          HE1       LYS  54  17.662   4.878  12.069
  436   2HE   LYS  54          HE2       LYS  54  16.886   5.447  10.589
  437   1HZ   LYS  54          HZ1       LYS  54  15.982   7.306  11.797
  438   2HZ   LYS  54          HZ2       LYS  54  17.665   7.259  11.989
  439   3HZ   LYS  54          HZ3       LYS  54  16.658   6.737  13.245
  440    H    LYS  55           HN       LYS  55  11.625   1.273   9.310
  441    HA   LYS  55           HA       LYS  55  10.270  -0.074  11.491
  442   1HB   LYS  55          HB1       LYS  55   9.289   1.824  10.269
  443   2HB   LYS  55          HB2       LYS  55   9.247   0.861   8.811
  444   1HG   LYS  55          HG1       LYS  55   7.058   0.939   9.642
  445   2HG   LYS  55          HG2       LYS  55   7.656  -0.677   9.971
  446   1HD   LYS  55          HD1       LYS  55   8.206   0.803  12.288
  447   2HD   LYS  55          HD2       LYS  55   6.597   1.311  11.781
  448   1HE   LYS  55          HE1       LYS  55   6.307  -0.537  13.262
  449   2HE   LYS  55          HE2       LYS  55   5.987  -1.136  11.633
  450   1HZ   LYS  55          HZ1       LYS  55   8.477  -1.517  13.211
  451   2HZ   LYS  55          HZ2       LYS  55   8.310  -1.953  11.589
  452   3HZ   LYS  55          HZ3       LYS  55   7.356  -2.708  12.761
  453    H    ASN  56           HN       ASN  56  11.287  -0.930   8.245
  454    HA   ASN  56           HA       ASN  56  10.979  -2.730   6.903
  455   1HB   ASN  56          HB1       ASN  56  12.900  -3.120   9.027
  456   2HB   ASN  56          HB2       ASN  56  12.327  -4.654   8.413
  457   1HD2  ASN  56          HD21      ASN  56  13.765  -1.546   7.238
  458   2HD2  ASN  56          HD22      ASN  56  14.267  -2.388   5.837
  459    H    VAL  57           HN       VAL  57   8.495  -2.617   7.952
  460    HA   VAL  57           HA       VAL  57   7.762  -5.077   9.245
  461    HB   VAL  57           HB       VAL  57   6.477  -2.572   8.648
  462   1HG1  VAL  57          HG11      VAL  57   4.724  -4.992   8.229
  463   2HG1  VAL  57          HG12      VAL  57   5.052  -3.723   7.048
  464   3HG1  VAL  57          HG13      VAL  57   4.152  -3.348   8.518
  465   1HG2  VAL  57          HG21      VAL  57   5.214  -3.207  10.646
  466   2HG2  VAL  57          HG22      VAL  57   6.949  -3.458  10.842
  467   3HG2  VAL  57          HG23      VAL  57   5.887  -4.834  10.544
  468    H    LEU  58           HN       LEU  58   7.312  -6.979   8.303
  469    HA   LEU  58           HA       LEU  58   7.580  -7.244   5.474
  470   1HB   LEU  58          HB1       LEU  58   8.365  -8.944   7.145
  471   2HB   LEU  58          HB2       LEU  58   6.681  -9.352   7.448
  472    HG   LEU  58           HG       LEU  58   7.753  -9.459   4.636
  473   1HD1  LEU  58          HD11      LEU  58   9.333 -10.765   5.958
  474   2HD1  LEU  58          HD12      LEU  58   8.312 -11.833   4.996
  475   3HD1  LEU  58          HD13      LEU  58   8.002 -11.637   6.721
  476   1HD2  LEU  58          HD21      LEU  58   6.072 -11.197   4.349
  477   2HD2  LEU  58          HD22      LEU  58   5.318  -9.740   4.996
  478   3HD2  LEU  58          HD23      LEU  58   5.650 -11.105   6.060
  479    H    TRP  59           HN       TRP  59   6.049  -6.324   4.290
  480    HA   TRP  59           HA       TRP  59   3.380  -5.909   4.919
  481   1HB   TRP  59          HB1       TRP  59   4.729  -6.178   2.236
  482   2HB   TRP  59          HB2       TRP  59   3.089  -5.599   2.452
  483    HD1  TRP  59           HD1      TRP  59   6.092  -4.189   1.515
  484    HE1  TRP  59           HE1      TRP  59   6.417  -1.771   2.351
  485    HE3  TRP  59           HE3      TRP  59   2.486  -4.021   5.137
  486    HZ2  TRP  59           HZ2      TRP  59   5.406  -0.048   4.397
  487    HZ3  TRP  59           HZ3      TRP  59   2.172  -1.979   6.482
  488    HH2  TRP  59           HH2      TRP  59   3.602   0.003   6.133
  489    H    ASP  60           HN       ASP  60   2.209  -7.542   5.596
  490    HA   ASP  60           HA       ASP  60   1.619  -9.856   3.904
  491   1HB   ASP  60          HB1       ASP  60   2.010 -11.250   5.633
  492   2HB   ASP  60          HB2       ASP  60   2.897  -9.902   6.321
  493    H    GLU  61           HN       GLU  61  -0.570 -10.784   5.338
  494    HA   GLU  61           HA       GLU  61  -2.685  -9.154   4.389
  495   1HB   GLU  61          HB1       GLU  61  -2.431 -11.811   5.234
  496   2HB   GLU  61          HB2       GLU  61  -3.534 -11.084   6.399
  497   1HG   GLU  61          HG1       GLU  61  -4.959 -11.883   4.731
  498   2HG   GLU  61          HG2       GLU  61  -4.788 -10.172   4.332
  499    H    ASN  62           HN       ASN  62  -1.360  -9.718   7.642
  500    HA   ASN  62           HA       ASN  62  -3.221  -7.902   8.889
  501   1HB   ASN  62          HB1       ASN  62  -2.620  -9.826  10.132
  502   2HB   ASN  62          HB2       ASN  62  -0.903  -9.560   9.870
  503   1HD2  ASN  62          HD21      ASN  62   0.136  -7.910  11.071
  504   2HD2  ASN  62          HD22      ASN  62  -0.570  -7.279  12.516
  505    H    ASN  63           HN       ASN  63   0.360  -7.811   8.367
  506    HA   ASN  63           HA       ASN  63   0.806  -5.277   9.402
  507   1HB   ASN  63          HB1       ASN  63   2.231  -7.086   7.524
  508   2HB   ASN  63          HB2       ASN  63   2.805  -5.435   7.650
  509   1HD2  ASN  63          HD21      ASN  63   1.872  -5.624  10.650
  510   2HD2  ASN  63          HD22      ASN  63   3.398  -6.234  11.189
  511    H    MET  64           HN       MET  64  -0.050  -5.981   5.945
  512    HA   MET  64           HA       MET  64   0.170  -3.301   5.097
  513   1HB   MET  64          HB1       MET  64   0.134  -4.872   3.390
  514   2HB   MET  64          HB2       MET  64  -1.273  -5.701   4.042
  515   1HG   MET  64          HG1       MET  64  -1.610  -2.899   3.136
  516   2HG   MET  64          HG2       MET  64  -1.385  -4.128   1.907
  517   1HE   MET  64          HE1       MET  64  -4.462  -6.496   3.247
  518   2HE   MET  64          HE2       MET  64  -2.896  -6.374   4.051
  519   3HE   MET  64          HE3       MET  64  -2.975  -6.552   2.298
  520    H    SER  65           HN       SER  65  -2.607  -4.986   6.560
  521    HA   SER  65           HA       SER  65  -4.492  -2.914   6.231
  522   1HB   SER  65          HB1       SER  65  -4.493  -4.996   8.415
  523   2HB   SER  65          HB2       SER  65  -5.875  -4.100   7.799
  524    HG   SER  65           HG       SER  65  -4.445  -6.209   6.633
  525    H    GLU  66           HN       GLU  66  -2.216  -3.552   8.877
  526    HA   GLU  66           HA       GLU  66  -3.070  -1.677  10.740
  527   1HB   GLU  66          HB1       GLU  66  -0.242  -2.561  10.095
  528   2HB   GLU  66          HB2       GLU  66  -0.757  -1.799  11.596
  529   1HG   GLU  66          HG1       GLU  66  -2.134  -3.689  12.160
  530   2HG   GLU  66          HG2       GLU  66  -1.839  -4.429  10.587
  531    H    TYR  67           HN       TYR  67  -0.795  -1.277   8.061
  532    HA   TYR  67           HA       TYR  67  -0.225   1.472   8.399
  533   1HB   TYR  67          HB1       TYR  67   1.287  -0.091   7.321
  534   2HB   TYR  67          HB2       TYR  67   0.117  -0.384   6.049
  535    HD1  TYR  67           HD1      TYR  67   0.132   0.913   4.076
  536    HD2  TYR  67           HD2      TYR  67   2.262   2.256   7.556
  537    HE1  TYR  67           HE1      TYR  67   1.312   2.614   2.690
  538    HE2  TYR  67           HE2      TYR  67   3.490   3.925   6.182
  539    HH   TYR  67           HH       TYR  67   2.719   4.451   2.773
  540    H    LEU  68           HN       LEU  68  -2.520  -0.196   6.149
  541    HA   LEU  68           HA       LEU  68  -3.298   2.135   4.793
  542   1HB   LEU  68          HB1       LEU  68  -4.738  -0.453   5.290
  543   2HB   LEU  68          HB2       LEU  68  -5.418   0.829   4.305
  544    HG   LEU  68           HG       LEU  68  -2.913  -0.772   3.747
  545   1HD1  LEU  68          HD11      LEU  68  -5.545  -0.388   2.299
  546   2HD1  LEU  68          HD12      LEU  68  -5.091  -1.802   3.250
  547   3HD1  LEU  68          HD13      LEU  68  -4.218  -1.420   1.767
  548   1HD2  LEU  68          HD21      LEU  68  -2.757   0.522   1.632
  549   2HD2  LEU  68          HD22      LEU  68  -2.450   1.534   3.043
  550   3HD2  LEU  68          HD23      LEU  68  -4.010   1.614   2.224
  551    H    THR  69           HN       THR  69  -4.650   0.809   7.832
  552    HA   THR  69           HA       THR  69  -6.863   2.544   7.997
  553    HB   THR  69           HB       THR  69  -5.442   1.484  10.416
  554    HG1  THR  69           HG1      THR  69  -5.659  -0.310   9.201
  555   1HG2  THR  69          HG21      THR  69  -7.409   2.902  10.841
  556   2HG2  THR  69          HG22      THR  69  -7.730   1.223  11.274
  557   3HG2  THR  69          HG23      THR  69  -8.373   1.883   9.771
  558    H    ASN  70           HN       ASN  70  -3.527   2.982   9.170
  559    HA   ASN  70           HA       ASN  70  -3.838   5.826   9.118
  560   1HB   ASN  70          HB1       ASN  70  -4.791   5.094  11.375
  561   2HB   ASN  70          HB2       ASN  70  -3.139   4.679  11.820
  562   1HD2  ASN  70          HD21      ASN  70  -4.794   6.669  13.079
  563   2HD2  ASN  70          HD22      ASN  70  -3.791   8.069  12.942
  564    HA   PRO  71           HA       PRO  71   0.389   4.444   7.885
  565   1HB   PRO  71          HB1       PRO  71   0.811   6.706   6.362
  566   2HB   PRO  71          HB2       PRO  71   0.104   5.204   5.760
  567   1HG   PRO  71          HG1       PRO  71  -1.251   7.719   6.643
  568   2HG   PRO  71          HG2       PRO  71  -1.631   6.662   5.271
  569   1HD   PRO  71          HD1       PRO  71  -3.066   6.594   7.539
  570   2HD   PRO  71          HD2       PRO  71  -2.735   5.119   6.605
  571    H    LYS  72           HN       LYS  72  -0.595   7.710   8.874
  572    HA   LYS  72           HA       LYS  72   1.923   8.672   9.671
  573   1HB   LYS  72          HB1       LYS  72  -0.885   9.496  10.366
  574   2HB   LYS  72          HB2       LYS  72   0.507  10.298  11.075
  575   1HG   LYS  72          HG1       LYS  72   1.280  10.936   8.836
  576   2HG   LYS  72          HG2       LYS  72  -0.116  10.131   8.127
  577   1HD   LYS  72          HD1       LYS  72  -0.260  12.471  10.038
  578   2HD   LYS  72          HD2       LYS  72  -0.366  12.599   8.282
  579   1HE   LYS  72          HE1       LYS  72  -2.375  11.213   8.289
  580   2HE   LYS  72          HE2       LYS  72  -2.255  11.017  10.031
  581   1HZ   LYS  72          HZ1       LYS  72  -3.911  12.666   9.382
  582   2HZ   LYS  72          HZ2       LYS  72  -2.713  13.593   8.635
  583   3HZ   LYS  72          HZ3       LYS  72  -2.668  13.361  10.306
  584    H    LYS  73           HN       LYS  73  -0.527   6.862  11.459
  585    HA   LYS  73           HA       LYS  73   0.873   7.148  13.959
  586   1HB   LYS  73          HB1       LYS  73  -1.525   6.962  14.031
  587   2HB   LYS  73          HB2       LYS  73  -1.479   5.418  13.193
  588   1HG   LYS  73          HG1       LYS  73  -1.901   5.059  15.547
  589   2HG   LYS  73          HG2       LYS  73  -0.322   4.411  15.123
  590   1HD   LYS  73          HD1       LYS  73   0.401   6.883  15.942
  591   2HD   LYS  73          HD2       LYS  73  -1.041   6.653  16.927
  592   1HE   LYS  73          HE1       LYS  73   0.675   5.842  18.285
  593   2HE   LYS  73          HE2       LYS  73   0.007   4.382  17.562
  594   1HZ   LYS  73          HZ1       LYS  73   1.838   4.701  15.829
  595   2HZ   LYS  73          HZ2       LYS  73   2.281   4.122  17.353
  596   3HZ   LYS  73          HZ3       LYS  73   2.549   5.743  16.961
  597    H    TYR  74           HN       TYR  74   0.637   4.584  11.522
  598    HA   TYR  74           HA       TYR  74   2.162   2.662  12.953
  599   1HB   TYR  74          HB1       TYR  74   0.525   2.362  10.978
  600   2HB   TYR  74          HB2       TYR  74   1.919   2.736   9.964
  601    HD1  TYR  74           HD1      TYR  74   3.050   0.852   9.103
  602    HD2  TYR  74           HD2      TYR  74   1.215   0.695  12.988
  603    HE1  TYR  74           HE1      TYR  74   3.751  -1.534   9.337
  604    HE2  TYR  74           HE2      TYR  74   1.898  -1.676  13.233
  605    HH   TYR  74           HH       TYR  74   2.398  -3.625  11.451
  606    H    ILE  75           HN       ILE  75   3.036   4.983  10.450
  607    HA   ILE  75           HA       ILE  75   5.886   4.648  11.070
  608    HB   ILE  75           HB       ILE  75   4.725   5.118   8.311
  609   1HG1  ILE  75          HG11      ILE  75   6.073   2.680   9.527
  610   2HG1  ILE  75          HG12      ILE  75   4.421   2.777   8.937
  611   1HG2  ILE  75          HG21      ILE  75   6.854   6.286   8.708
  612   2HG2  ILE  75          HG22      ILE  75   7.070   4.960   7.566
  613   3HG2  ILE  75          HG23      ILE  75   7.592   4.774   9.240
  614   1HD1  ILE  75          HD11      ILE  75   5.246   3.017   6.643
  615   2HD1  ILE  75          HD12      ILE  75   5.869   1.547   7.391
  616   3HD1  ILE  75          HD13      ILE  75   6.908   2.962   7.228
  617    HA   PRO  76           HA       PRO  76   4.639   8.962  12.040
  618   1HB   PRO  76          HB1       PRO  76   6.588   9.304  13.918
  619   2HB   PRO  76          HB2       PRO  76   5.016   8.576  14.264
  620   1HG   PRO  76          HG1       PRO  76   7.648   7.250  13.753
  621   2HG   PRO  76          HG2       PRO  76   6.405   6.849  14.952
  622   1HD   PRO  76          HD1       PRO  76   6.694   5.473  12.641
  623   2HD   PRO  76          HD2       PRO  76   5.117   5.708  13.420
  624    H    GLY  77           HN       GLY  77   5.289  10.032  10.207
  625   1HA   GLY  77          HA1       GLY  77   6.850  11.795   9.566
  626   2HA   GLY  77          HA2       GLY  77   8.154  10.693   9.959
  627    H    THR  78           HN       THR  78   5.699   9.018   8.350
  628    HA   THR  78           HA       THR  78   7.250   8.571   6.000
  629    HB   THR  78           HB       THR  78   5.348   7.174   7.354
  630    HG1  THR  78           HG1      THR  78   6.862   6.826   5.157
  631   1HG2  THR  78          HG21      THR  78   3.452   8.297   6.268
  632   2HG2  THR  78          HG22      THR  78   3.551   6.590   5.834
  633   3HG2  THR  78          HG23      THR  78   4.085   7.823   4.691
  634    H    LYS  79           HN       LYS  79   6.769   8.985   3.851
  635    HA   LYS  79           HA       LYS  79   5.671  11.551   3.274
  636   1HB   LYS  79          HB1       LYS  79   6.250   9.443   1.214
  637   2HB   LYS  79          HB2       LYS  79   6.384  11.187   1.063
  638   1HG   LYS  79          HG1       LYS  79   8.323  11.115   2.636
  639   2HG   LYS  79          HG2       LYS  79   8.227   9.347   2.589
  640   1HD   LYS  79          HD1       LYS  79   8.157  10.021  -0.086
  641   2HD   LYS  79          HD2       LYS  79   9.276  11.217   0.580
  642   1HE   LYS  79          HE1       LYS  79  10.777   9.534   0.225
  643   2HE   LYS  79          HE2       LYS  79  10.214   9.041   1.822
  644   1HZ   LYS  79          HZ1       LYS  79  10.242   7.427  -0.287
  645   2HZ   LYS  79          HZ2       LYS  79   8.678   8.048  -0.433
  646   3HZ   LYS  79          HZ3       LYS  79   9.140   7.267   0.991
  647    H    MET  80           HN       MET  80   4.107   8.429   3.416
  648    HA   MET  80           HA       MET  80   2.089   9.053   1.489
  649   1HB   MET  80          HB1       MET  80   2.426   6.786   1.550
  650   2HB   MET  80          HB2       MET  80   2.616   6.747   3.307
  651   1HG   MET  80          HG1       MET  80   0.371   6.750   3.705
  652   2HG   MET  80          HG2       MET  80  -0.008   7.598   2.217
  653   1HE   MET  80          HE1       MET  80  -1.872   3.997   2.553
  654   2HE   MET  80          HE2       MET  80  -2.169   5.735   2.588
  655   3HE   MET  80          HE3       MET  80  -1.246   4.973   3.882
  656    H    ALA  81           HN       ALA  81   1.281  10.987   2.107
  657    HA   ALA  81           HA       ALA  81  -0.003  11.421   4.627
  658   1HB   ALA  81          HB1       ALA  81  -0.227  13.675   3.941
  659   2HB   ALA  81          HB2       ALA  81   0.058  13.256   2.253
  660   3HB   ALA  81          HB3       ALA  81   1.364  13.109   3.428
  661    H    PHE  82           HN       PHE  82  -1.123   9.530   2.622
  662    HA   PHE  82           HA       PHE  82  -3.519  10.163   1.490
  663   1HB   PHE  82          HB1       PHE  82  -2.392   8.193   0.868
  664   2HB   PHE  82          HB2       PHE  82  -2.399   7.571   2.513
  665    HD1  PHE  82           HD1      PHE  82  -4.739   8.534  -0.261
  666    HD2  PHE  82           HD2      PHE  82  -4.018   6.032   3.164
  667    HE1  PHE  82           HE1      PHE  82  -6.903   7.369  -0.654
  668    HE2  PHE  82           HE2      PHE  82  -6.184   4.879   2.780
  669    HZ   PHE  82           HZ       PHE  82  -7.636   5.561   0.883
  670    H    GLY  83           HN       GLY  83  -3.041   9.986   4.901
  671   1HA   GLY  83          HA1       GLY  83  -4.655  10.590   6.497
  672   2HA   GLY  83          HA2       GLY  83  -5.908  10.330   5.304
  673    H    GLY  84           HN       GLY  84  -5.587   7.682   4.634
  674   1HA   GLY  84          HA1       GLY  84  -5.386   5.464   5.467
  675   2HA   GLY  84          HA2       GLY  84  -5.552   6.086   7.098
  676    H    LEU  85           HN       LEU  85  -7.063   4.285   4.866
  677    HA   LEU  85           HA       LEU  85  -9.781   5.183   5.033
  678   1HB   LEU  85          HB1       LEU  85  -8.490   2.702   3.913
  679   2HB   LEU  85          HB2       LEU  85 -10.226   2.926   3.936
  680    HG   LEU  85           HG       LEU  85  -8.262   4.714   2.477
  681   1HD1  LEU  85          HD11      LEU  85  -9.212   3.678   0.460
  682   2HD1  LEU  85          HD12      LEU  85 -10.199   2.619   1.467
  683   3HD1  LEU  85          HD13      LEU  85  -8.441   2.473   1.493
  684   1HD2  LEU  85          HD21      LEU  85 -10.257   5.987   3.042
  685   2HD2  LEU  85          HD22      LEU  85 -11.291   4.674   2.480
  686   3HD2  LEU  85          HD23      LEU  85 -10.301   5.570   1.329
  687    H    LYS  86           HN       LYS  86 -10.199   5.290   7.149
  688    HA   LYS  86           HA       LYS  86  -9.881   3.493   9.214
  689   1HB   LYS  86          HB1       LYS  86 -12.120   5.501   8.936
  690   2HB   LYS  86          HB2       LYS  86 -11.443   4.865  10.430
  691   1HG   LYS  86          HG1       LYS  86  -9.773   6.428   8.467
  692   2HG   LYS  86          HG2       LYS  86 -10.718   7.214   9.733
  693   1HD   LYS  86          HD1       LYS  86  -9.501   5.983  11.450
  694   2HD   LYS  86          HD2       LYS  86  -8.611   5.092  10.217
  695   1HE   LYS  86          HE1       LYS  86  -8.491   8.095  10.546
  696   2HE   LYS  86          HE2       LYS  86  -7.337   6.983  11.276
  697   1HZ   LYS  86          HZ1       LYS  86  -7.846   7.249   8.363
  698   2HZ   LYS  86          HZ2       LYS  86  -6.700   6.238   9.084
  699   3HZ   LYS  86          HZ3       LYS  86  -6.527   7.915   9.193
  700    H    LYS  87           HN       LYS  87 -12.415   3.518   6.797
  701    HA   LYS  87           HA       LYS  87 -14.277   1.805   8.124
  702   1HB   LYS  87          HB1       LYS  87 -14.469   1.609   5.291
  703   2HB   LYS  87          HB2       LYS  87 -15.564   2.368   6.415
  704   1HG   LYS  87          HG1       LYS  87 -13.449   4.232   5.896
  705   2HG   LYS  87          HG2       LYS  87 -14.076   3.598   4.342
  706   1HD   LYS  87          HD1       LYS  87 -15.687   4.561   6.686
  707   2HD   LYS  87          HD2       LYS  87 -15.468   5.433   5.207
  708   1HE   LYS  87          HE1       LYS  87 -17.164   2.979   5.622
  709   2HE   LYS  87          HE2       LYS  87 -17.717   4.657   5.418
  710   1HZ   LYS  87          HZ1       LYS  87 -16.227   4.531   3.298
  711   2HZ   LYS  87          HZ2       LYS  87 -17.802   3.932   3.251
  712   3HZ   LYS  87          HZ3       LYS  87 -16.500   2.860   3.425
  713    H    GLU  88           HN       GLU  88 -13.514  -0.196   8.674
  714    HA   GLU  88           HA       GLU  88 -11.741  -1.856   7.371
  715   1HB   GLU  88          HB1       GLU  88 -12.743  -2.029   9.701
  716   2HB   GLU  88          HB2       GLU  88 -14.097  -2.861   8.942
  717   1HG   GLU  88          HG1       GLU  88 -12.174  -4.354   7.901
  718   2HG   GLU  88          HG2       GLU  88 -11.282  -3.778   9.317
  719    H    LYS  89           HN       LYS  89 -15.289  -1.832   6.882
  720    HA   LYS  89           HA       LYS  89 -15.498  -4.085   5.273
  721   1HB   LYS  89          HB1       LYS  89 -17.236  -1.683   4.817
  722   2HB   LYS  89          HB2       LYS  89 -17.670  -3.391   4.824
  723   1HG   LYS  89          HG1       LYS  89 -16.637  -2.149   7.334
  724   2HG   LYS  89          HG2       LYS  89 -18.300  -1.844   6.852
  725   1HD   LYS  89          HD1       LYS  89 -18.354  -3.693   8.355
  726   2HD   LYS  89          HD2       LYS  89 -18.584  -4.373   6.735
  727   1HE   LYS  89          HE1       LYS  89 -16.582  -5.441   6.755
  728   2HE   LYS  89          HE2       LYS  89 -15.771  -4.113   7.583
  729   1HZ   LYS  89          HZ1       LYS  89 -15.726  -5.609   9.246
  730   2HZ   LYS  89          HZ2       LYS  89 -17.068  -6.470   8.682
  731   3HZ   LYS  89          HZ3       LYS  89 -17.293  -5.034   9.542
  732    H    ASP  90           HN       ASP  90 -14.809  -0.803   4.409
  733    HA   ASP  90           HA       ASP  90 -14.670  -0.935   1.649
  734   1HB   ASP  90          HB1       ASP  90 -13.558   0.846   3.796
  735   2HB   ASP  90          HB2       ASP  90 -13.200   1.149   2.110
  736    H    ARG  91           HN       ARG  91 -12.012  -1.354   4.083
  737    HA   ARG  91           HA       ARG  91 -10.040  -1.893   2.085
  738   1HB   ARG  91          HB1       ARG  91  -9.828  -2.728   4.984
  739   2HB   ARG  91          HB2       ARG  91  -8.514  -2.550   3.827
  740   1HG   ARG  91          HG1       ARG  91  -8.924  -0.145   3.718
  741   2HG   ARG  91          HG2       ARG  91 -10.261  -0.310   4.843
  742   1HD   ARG  91          HD1       ARG  91  -7.322  -0.716   5.396
  743   2HD   ARG  91          HD2       ARG  91  -8.358   0.557   6.019
  744    HE   ARG  91           HE       ARG  91  -8.101  -1.896   6.292
  745   1HH1  ARG  91          HH21      ARG  91  -9.540   0.950   7.672
  746   2HH1  ARG  91          HH22      ARG  91 -10.182   0.365   9.168
  747   1HH2  ARG  91          HH11      ARG  91  -9.163  -2.880   8.702
  748   2HH2  ARG  91          HH12      ARG  91 -10.020  -1.782   9.723
  749    H    ASN  92           HN       ASN  92 -12.154  -4.013   3.980
  750    HA   ASN  92           HA       ASN  92 -11.113  -6.472   3.627
  751   1HB   ASN  92          HB1       ASN  92 -13.967  -5.539   3.511
  752   2HB   ASN  92          HB2       ASN  92 -13.570  -7.243   3.355
  753   1HD2  ASN  92          HD21      ASN  92 -15.173  -6.280   5.378
  754   2HD2  ASN  92          HD22      ASN  92 -14.296  -6.702   6.807
  755    H    ASP  93           HN       ASP  93 -13.109  -4.875   1.104
  756    HA   ASP  93           HA       ASP  93 -12.617  -6.882  -0.863
  757   1HB   ASP  93          HB1       ASP  93 -14.500  -4.975  -0.631
  758   2HB   ASP  93          HB2       ASP  93 -13.414  -4.165  -1.748
  759    H    LEU  94           HN       LEU  94 -11.106  -3.652  -0.280
  760    HA   LEU  94           HA       LEU  94  -9.492  -3.505  -2.503
  761   1HB   LEU  94          HB1       LEU  94  -9.720  -2.211   0.114
  762   2HB   LEU  94          HB2       LEU  94  -8.118  -2.223  -0.526
  763    HG   LEU  94           HG       LEU  94 -10.419  -1.266  -2.197
  764   1HD1  LEU  94          HD11      LEU  94 -10.286  -0.077   0.026
  765   2HD1  LEU  94          HD12      LEU  94 -10.117   0.954  -1.397
  766   3HD1  LEU  94          HD13      LEU  94  -8.691   0.498  -0.467
  767   1HD2  LEU  94          HD21      LEU  94  -8.797   0.068  -3.375
  768   2HD2  LEU  94          HD22      LEU  94  -8.219  -1.597  -3.341
  769   3HD2  LEU  94          HD23      LEU  94  -7.523  -0.400  -2.250
  770    H    ILE  95           HN       ILE  95  -8.858  -5.151   0.576
  771    HA   ILE  95           HA       ILE  95  -6.163  -5.827   0.168
  772    HB   ILE  95           HB       ILE  95  -8.302  -7.186   1.820
  773   1HG1  ILE  95          HG11      ILE  95  -6.045  -5.378   2.731
  774   2HG1  ILE  95          HG12      ILE  95  -7.648  -4.769   2.330
  775   1HG2  ILE  95          HG21      ILE  95  -6.524  -8.800   1.449
  776   2HG2  ILE  95          HG22      ILE  95  -6.423  -8.193   3.101
  777   3HG2  ILE  95          HG23      ILE  95  -5.303  -7.599   1.876
  778   1HD1  ILE  95          HD11      ILE  95  -7.171  -6.889   4.422
  779   2HD1  ILE  95          HD12      ILE  95  -8.647  -5.969   4.131
  780   3HD1  ILE  95          HD13      ILE  95  -7.221  -5.162   4.780
  781    H    THR  96           HN       THR  96  -9.122  -7.740  -0.515
  782    HA   THR  96           HA       THR  96  -7.940  -9.986  -1.643
  783    HB   THR  96           HB       THR  96 -10.527  -8.934  -2.746
  784    HG1  THR  96           HG1      THR  96 -10.704  -8.693  -0.494
  785   1HG2  THR  96          HG21      THR  96  -9.604 -11.102  -3.556
  786   2HG2  THR  96          HG22      THR  96 -11.150 -11.279  -2.723
  787   3HG2  THR  96          HG23      THR  96  -9.649 -11.701  -1.897
  788    H    TYR  97           HN       TYR  97  -8.696  -6.881  -3.238
  789    HA   TYR  97           HA       TYR  97  -8.084  -7.703  -5.860
  790   1HB   TYR  97          HB1       TYR  97  -9.283  -5.696  -5.662
  791   2HB   TYR  97          HB2       TYR  97  -8.116  -5.007  -4.541
  792    HD1  TYR  97           HD1      TYR  97  -6.883  -3.259  -5.373
  793    HD2  TYR  97           HD2      TYR  97  -8.012  -6.454  -8.020
  794    HE1  TYR  97           HE1      TYR  97  -5.701  -2.122  -7.242
  795    HE2  TYR  97           HE2      TYR  97  -6.938  -5.267  -9.925
  796    HH   TYR  97           HH       TYR  97  -4.721  -2.975  -9.656
  797    H    LEU  98           HN       LEU  98  -5.964  -5.841  -3.624
  798    HA   LEU  98           HA       LEU  98  -3.652  -5.960  -5.215
  799   1HB   LEU  98          HB1       LEU  98  -4.367  -4.682  -2.926
  800   2HB   LEU  98          HB2       LEU  98  -3.285  -5.914  -2.282
  801    HG   LEU  98           HG       LEU  98  -1.493  -5.176  -3.799
  802   1HD1  LEU  98          HD11      LEU  98  -3.428  -3.014  -4.658
  803   2HD1  LEU  98          HD12      LEU  98  -2.969  -4.401  -5.645
  804   3HD1  LEU  98          HD13      LEU  98  -1.757  -3.201  -5.191
  805   1HD2  LEU  98          HD21      LEU  98  -1.044  -2.997  -2.814
  806   2HD2  LEU  98          HD22      LEU  98  -1.723  -4.073  -1.593
  807   3HD2  LEU  98          HD23      LEU  98  -2.736  -2.838  -2.340
  808    H    LYS  99           HN       LYS  99  -4.668  -7.940  -2.488
  809    HA   LYS  99           HA       LYS  99  -2.579  -9.737  -2.315
  810   1HB   LYS  99          HB1       LYS  99  -3.875 -10.237  -0.564
  811   2HB   LYS  99          HB2       LYS  99  -5.295  -9.541  -1.324
  812   1HG   LYS  99          HG1       LYS  99  -5.884 -11.590  -2.343
  813   2HG   LYS  99          HG2       LYS  99  -4.314 -12.298  -2.021
  814   1HD   LYS  99          HD1       LYS  99  -5.691 -11.562   0.436
  815   2HD   LYS  99          HD2       LYS  99  -6.648 -12.668  -0.554
  816   1HE   LYS  99          HE1       LYS  99  -5.141 -13.809   1.062
  817   2HE   LYS  99          HE2       LYS  99  -4.874 -14.266  -0.613
  818   1HZ   LYS  99          HZ1       LYS  99  -3.160 -12.181  -0.125
  819   2HZ   LYS  99          HZ2       LYS  99  -2.760 -13.821  -0.268
  820   3HZ   LYS  99          HZ3       LYS  99  -3.086 -13.163   1.260
  821    H    LYS 100           HN       LYS 100  -5.377  -9.841  -4.524
  822    HA   LYS 100           HA       LYS 100  -4.721 -12.377  -5.633
  823   1HB   LYS 100          HB1       LYS 100  -7.003 -11.179  -5.454
  824   2HB   LYS 100          HB2       LYS 100  -6.570 -10.495  -7.003
  825   1HG   LYS 100          HG1       LYS 100  -8.077 -12.538  -7.049
  826   2HG   LYS 100          HG2       LYS 100  -6.642 -12.622  -8.075
  827   1HD   LYS 100          HD1       LYS 100  -6.274 -13.594  -5.348
  828   2HD   LYS 100          HD2       LYS 100  -7.455 -14.495  -6.246
  829   1HE   LYS 100          HE1       LYS 100  -5.633 -15.806  -6.532
  830   2HE   LYS 100          HE2       LYS 100  -5.404 -14.741  -7.929
  831   1HZ   LYS 100          HZ1       LYS 100  -4.197 -14.247  -5.243
  832   2HZ   LYS 100          HZ2       LYS 100  -3.920 -13.364  -6.659
  833   3HZ   LYS 100          HZ3       LYS 100  -3.375 -14.964  -6.544
  834    H    ALA 101           HN       ALA 101  -3.853  -9.253  -6.481
  835    HA   ALA 101           HA       ALA 101  -2.828  -9.671  -9.108
  836   1HB   ALA 101          HB1       ALA 101  -2.623  -7.316  -7.228
  837   2HB   ALA 101          HB2       ALA 101  -3.894  -7.580  -8.422
  838   3HB   ALA 101          HB3       ALA 101  -2.233  -7.307  -8.948
  839    H    THR 102           HN       THR 102  -1.409  -9.456  -5.872
  840    HA   THR 102           HA       THR 102   1.336  -9.587  -6.698
  841    HB   THR 102           HB       THR 102   0.247 -10.109  -3.932
  842    HG1  THR 102           HG1      THR 102  -0.368  -8.020  -4.873
  843   1HG2  THR 102          HG21      THR 102   2.891  -8.887  -4.699
  844   2HG2  THR 102          HG22      THR 102   2.689 -10.625  -4.476
  845   3HG2  THR 102          HG23      THR 102   2.392  -9.524  -3.131
  846    H    GLU 103           HN       GLU 103  -1.062 -11.951  -5.534
  847    HA   GLU 103           HA       GLU 103   0.838 -14.088  -6.271
  848   1HB   GLU 103          HB1       GLU 103  -0.749 -15.397  -4.520
  849   2HB   GLU 103          HB2       GLU 103   0.763 -14.624  -4.071
  850   1HG   GLU 103          HG1       GLU 103  -0.342 -13.429  -2.584
  851   2HG   GLU 103          HG2       GLU 103  -1.192 -12.630  -3.902
  852    HHA  HEC 104           HA       HEC 104   5.123   3.287   1.260
  853    HHB  HEC 104           HB       HEC 104  -0.442   0.299  -0.255
  854    HHC  HEC 104           HC       HEC 104  -3.088   6.043  -1.673
  855    HHD  HEC 104           HD       HEC 104   2.775   8.736  -1.351
  856   1HMA  HEC 104          HMA1      HEC 104   1.337  -1.133   1.553
  857   2HMA  HEC 104          HMA2      HEC 104   2.887  -1.429   0.763
  858   3HMA  HEC 104          HMA3      HEC 104   1.421  -1.261  -0.204
  859   1HAA  HEC 104          HAA1      HEC 104   4.369  -0.422   1.761
  860   2HAA  HEC 104          HAA2      HEC 104   4.996   1.150   2.223
  861   1HBA  HEC 104          HBA1      HEC 104   5.921   1.421  -0.066
  862   2HBA  HEC 104          HBA2      HEC 104   5.352  -0.193  -0.462
  863   1HMB  HEC 104          HMB1      HEC 104  -2.294  -0.037  -0.948
  864   2HMB  HEC 104          HMB2      HEC 104  -3.191   0.594  -2.329
  865   3HMB  HEC 104          HMB3      HEC 104  -3.904   0.646  -0.717
  866    HAB  HEC 104           HAB      HEC 104  -4.454   4.682  -1.816
  867   1HBB  HEC 104          HBB1      HEC 104  -4.817   3.357   0.409
  868   2HBB  HEC 104          HBB2      HEC 104  -5.755   2.303  -0.648
  869   3HBB  HEC 104          HBB3      HEC 104  -6.158   4.017  -0.528
  870   1HMC  HEC 104          HMC1      HEC 104  -3.208   8.613  -1.731
  871   2HMC  HEC 104          HMC2      HEC 104  -2.806   7.962  -3.320
  872   3HMC  HEC 104          HMC3      HEC 104  -2.252   9.572  -2.860
  873    HAC  HEC 104           HAC      HEC 104   1.586   9.807  -2.618
  874   1HBC  HEC 104          HBC1      HEC 104   0.708  11.104  -0.915
  875   2HBC  HEC 104          HBC2      HEC 104  -0.932  11.016  -1.557
  876   3HBC  HEC 104          HBC3      HEC 104   0.300  11.946  -2.410
  877   1HMD  HEC 104          HMD1      HEC 104   4.870   9.153  -0.362
  878   2HMD  HEC 104          HMD2      HEC 104   5.387   8.238  -1.778
  879   3HMD  HEC 104          HMD3      HEC 104   6.366   8.220  -0.311
  880   1HAD  HEC 104          HAD1      HEC 104   7.200   6.338   0.414
  881   2HAD  HEC 104          HAD2      HEC 104   6.769   4.756   1.052
  882   1HBD  HEC 104          HBD1      HEC 104   6.168   5.604   3.123
  883   2HBD  HEC 104          HBD2      HEC 104   5.825   7.199   2.488
  884    H2   4NL 105           H2       4NL 105  -0.141 -12.559  -1.025
  885    H6   4NL 105           H6       4NL 105   2.238 -14.368   2.804
  886    H3   4NL 105           H3       4NL 105  -1.387 -10.302   2.470
  887    H5   4NL 105           H5       4NL 105  -2.339 -10.080   0.450
  888    H4   4NL 105           H4       4NL 105   0.323 -11.505   3.857
  889    H1   4NL 105           H1       4NL 105   1.569 -13.762   0.362
  890    H7   4NL 105           H7       4NL 105   2.534 -12.871   3.722
  Start of MODEL   12
    1   1H    THR  -5          HT1       THR  -5 -11.063  -4.344  11.888
    2   2H    THR  -5          HT2       THR  -5  -9.696  -4.437  12.883
    3   3H    THR  -5          HT3       THR  -5 -11.162  -5.097  13.405
    4    HA   THR  -5           HA       THR  -5  -9.708  -6.048  11.013
    5    HB   THR  -5           HB       THR  -5  -9.830  -7.525  13.646
    6    HG1  THR  -5           HG1      THR  -5  -7.431  -6.690  13.479
    7   1HG2  THR  -5          HG21      THR  -5  -9.219  -8.704  11.525
    8   2HG2  THR  -5          HG22      THR  -5  -7.935  -8.714  12.733
    9   3HG2  THR  -5          HG23      THR  -5  -7.848  -7.605  11.363
   10    H    GLU  -4           HN       GLU  -4 -11.632  -6.335   9.860
   11    HA   GLU  -4           HA       GLU  -4 -13.323  -8.539  10.688
   12   1HB   GLU  -4          HB1       GLU  -4 -14.290  -6.111  11.377
   13   2HB   GLU  -4          HB2       GLU  -4 -14.820  -6.143   9.699
   14   1HG   GLU  -4          HG1       GLU  -4 -15.466  -8.239  11.777
   15   2HG   GLU  -4          HG2       GLU  -4 -16.551  -6.960  11.249
   16    H    PHE  -3           HN       PHE  -3 -11.461  -8.782   8.908
   17    HA   PHE  -3           HA       PHE  -3 -11.952  -7.862   6.297
   18   1HB   PHE  -3          HB1       PHE  -3  -9.720  -8.462   6.825
   19   2HB   PHE  -3          HB2       PHE  -3 -10.191 -10.089   7.302
   20    HD1  PHE  -3           HD1      PHE  -3  -9.958  -7.801   4.345
   21    HD2  PHE  -3           HD2      PHE  -3 -10.141 -11.863   5.748
   22    HE1  PHE  -3           HE1      PHE  -3  -9.590  -8.617   2.025
   23    HE2  PHE  -3           HE2      PHE  -3  -9.824 -12.681   3.420
   24    HZ   PHE  -3           HZ       PHE  -3  -9.580 -11.057   1.550
   25    H    LYS  -2           HN       LYS  -2 -12.952  -8.621   4.613
   26    HA   LYS  -2           HA       LYS  -2 -14.285 -11.212   4.579
   27   1HB   LYS  -2          HB1       LYS  -2 -15.603  -8.680   4.979
   28   2HB   LYS  -2          HB2       LYS  -2 -16.069  -9.333   3.411
   29   1HG   LYS  -2          HG1       LYS  -2 -17.646 -10.326   4.762
   30   2HG   LYS  -2          HG2       LYS  -2 -16.392 -11.562   4.760
   31   1HD   LYS  -2          HD1       LYS  -2 -15.538 -10.599   6.911
   32   2HD   LYS  -2          HD2       LYS  -2 -16.927  -9.514   6.921
   33   1HE   LYS  -2          HE1       LYS  -2 -18.382 -11.600   6.832
   34   2HE   LYS  -2          HE2       LYS  -2 -16.918 -12.525   7.148
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.375 -10.683   8.925
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.722 -10.925   9.165
   37   3HZ   LYS  -2          HZ3       LYS  -2 -17.779 -12.240   9.237
   38    H    ALA  -1           HN       ALA  -1 -13.958 -12.160   2.710
   39    HA   ALA  -1           HA       ALA  -1 -12.195 -11.367   0.780
   40   1HB   ALA  -1          HB1       ALA  -1 -12.838 -13.666   1.108
   41   2HB   ALA  -1          HB2       ALA  -1 -13.144 -13.216  -0.571
   42   3HB   ALA  -1          HB3       ALA  -1 -14.484 -13.323   0.572
   43    H    GLY   1           HN       GLY   1 -12.278 -10.432  -1.212
   44   1HA   GLY   1          HA1       GLY   1 -14.740  -9.007  -2.007
   45   2HA   GLY   1          HA2       GLY   1 -13.124  -8.341  -2.184
   46    H    SER   2           HN       SER   2 -13.131  -8.065  -4.334
   47    HA   SER   2           HA       SER   2 -12.654 -10.336  -6.042
   48   1HB   SER   2          HB1       SER   2 -14.762  -8.512  -7.104
   49   2HB   SER   2          HB2       SER   2 -14.473 -10.222  -7.446
   50    HG   SER   2           HG       SER   2 -15.154 -10.565  -5.183
   51    H    ALA   3           HN       ALA   3 -11.322  -9.788  -7.732
   52    HA   ALA   3           HA       ALA   3  -9.783  -7.539  -7.705
   53   1HB   ALA   3          HB1       ALA   3  -9.294  -9.648  -8.891
   54   2HB   ALA   3          HB2       ALA   3  -8.966  -8.212  -9.861
   55   3HB   ALA   3          HB3       ALA   3 -10.419  -9.164 -10.161
   56    H    LYS   4           HN       LYS   4 -12.728  -7.885  -9.779
   57    HA   LYS   4           HA       LYS   4 -12.426  -5.282 -10.876
   58   1HB   LYS   4          HB1       LYS   4 -13.584  -7.373 -11.878
   59   2HB   LYS   4          HB2       LYS   4 -15.014  -6.731 -11.070
   60   1HG   LYS   4          HG1       LYS   4 -14.151  -4.477 -12.234
   61   2HG   LYS   4          HG2       LYS   4 -13.488  -5.641 -13.374
   62   1HD   LYS   4          HD1       LYS   4 -15.636  -4.980 -14.193
   63   2HD   LYS   4          HD2       LYS   4 -15.808  -6.621 -13.561
   64   1HE   LYS   4          HE1       LYS   4 -17.672  -5.096 -12.886
   65   2HE   LYS   4          HE2       LYS   4 -16.802  -5.794 -11.518
   66   1HZ   LYS   4          HZ1       LYS   4 -16.066  -3.152 -12.597
   67   2HZ   LYS   4          HZ2       LYS   4 -15.760  -3.793 -11.064
   68   3HZ   LYS   4          HZ3       LYS   4 -17.328  -3.315 -11.477
   69    H    LYS   5           HN       LYS   5 -13.172  -5.838  -7.809
   70    HA   LYS   5           HA       LYS   5 -15.055  -3.573  -7.629
   71   1HB   LYS   5          HB1       LYS   5 -14.544  -5.755  -5.590
   72   2HB   LYS   5          HB2       LYS   5 -15.590  -4.364  -5.334
   73   1HG   LYS   5          HG1       LYS   5 -16.746  -5.267  -7.548
   74   2HG   LYS   5          HG2       LYS   5 -16.035  -6.789  -7.006
   75   1HD   LYS   5          HD1       LYS   5 -17.422  -5.243  -4.907
   76   2HD   LYS   5          HD2       LYS   5 -18.465  -5.849  -6.194
   77   1HE   LYS   5          HE1       LYS   5 -18.366  -7.463  -4.374
   78   2HE   LYS   5          HE2       LYS   5 -17.584  -8.126  -5.809
   79   1HZ   LYS   5          HZ1       LYS   5 -15.549  -8.057  -4.839
   80   2HZ   LYS   5          HZ2       LYS   5 -16.484  -8.226  -3.434
   81   3HZ   LYS   5          HZ3       LYS   5 -15.912  -6.699  -3.887
   82    H    GLY   6           HN       GLY   6 -12.329  -5.043  -5.818
   83   1HA   GLY   6          HA1       GLY   6 -11.638  -2.791  -4.311
   84   2HA   GLY   6          HA2       GLY   6 -10.529  -4.076  -4.764
   85    H    ALA   7           HN       ALA   7 -10.900  -3.522  -7.678
   86    HA   ALA   7           HA       ALA   7  -8.819  -1.755  -8.158
   87   1HB   ALA   7          HB1       ALA   7 -11.028  -2.604 -10.032
   88   2HB   ALA   7          HB2       ALA   7  -9.488  -3.426  -9.779
   89   3HB   ALA   7          HB3       ALA   7  -9.520  -1.825 -10.515
   90    H    THR   8           HN       THR   8 -12.361  -1.020  -8.611
   91    HA   THR   8           HA       THR   8 -12.123   1.600  -9.393
   92    HB   THR   8           HB       THR   8 -14.278   1.796  -7.703
   93    HG1  THR   8           HG1      THR   8 -13.964  -0.487  -7.244
   94   1HG2  THR   8          HG21      THR   8 -14.364   2.435 -10.014
   95   2HG2  THR   8          HG22      THR   8 -15.618   1.225  -9.736
   96   3HG2  THR   8          HG23      THR   8 -14.114   0.768 -10.536
   97    H    LEU   9           HN       LEU   9 -11.722   0.433  -6.088
   98    HA   LEU   9           HA       LEU   9 -11.649   2.947  -4.794
   99   1HB   LEU   9          HB1       LEU   9 -11.055   0.131  -4.085
  100   2HB   LEU   9          HB2       LEU   9 -10.176   1.345  -3.157
  101    HG   LEU   9           HG       LEU   9 -12.175   0.917  -1.941
  102   1HD1  LEU   9          HD11      LEU   9 -13.238   3.064  -1.899
  103   2HD1  LEU   9          HD12      LEU   9 -12.758   3.392  -3.564
  104   3HD1  LEU   9          HD13      LEU   9 -11.538   3.327  -2.293
  105   1HD2  LEU   9          HD21      LEU   9 -14.412   1.033  -2.882
  106   2HD2  LEU   9          HD22      LEU   9 -13.466  -0.153  -3.781
  107   3HD2  LEU   9          HD23      LEU   9 -13.754   1.447  -4.467
  108    H    PHE  10           HN       PHE  10  -8.873   0.757  -4.884
  109    HA   PHE  10           HA       PHE  10  -6.791   2.452  -4.604
  110   1HB   PHE  10          HB1       PHE  10  -6.629   0.003  -4.726
  111   2HB   PHE  10          HB2       PHE  10  -6.884   0.069  -6.463
  112    HD1  PHE  10           HD1      PHE  10  -5.117   1.293  -7.900
  113    HD2  PHE  10           HD2      PHE  10  -4.484   0.098  -3.817
  114    HE1  PHE  10           HE1      PHE  10  -2.651   1.412  -8.242
  115    HE2  PHE  10           HE2      PHE  10  -2.031   0.341  -4.125
  116    HZ   PHE  10           HZ       PHE  10  -1.107   0.973  -6.341
  117    H    LYS  11           HN       LYS  11  -8.450   1.829  -7.680
  118    HA   LYS  11           HA       LYS  11  -6.686   3.229  -9.358
  119   1HB   LYS  11          HB1       LYS  11  -8.734   1.535  -9.781
  120   2HB   LYS  11          HB2       LYS  11  -9.507   3.060 -10.218
  121   1HG   LYS  11          HG1       LYS  11  -8.003   3.485 -11.948
  122   2HG   LYS  11          HG2       LYS  11  -6.793   2.384 -11.298
  123   1HD   LYS  11          HD1       LYS  11  -9.413   1.598 -12.590
  124   2HD   LYS  11          HD2       LYS  11  -7.812   1.459 -13.318
  125   1HE   LYS  11          HE1       LYS  11  -8.754  -0.001 -10.836
  126   2HE   LYS  11          HE2       LYS  11  -8.625  -0.704 -12.446
  127   1HZ   LYS  11          HZ1       LYS  11  -6.226  -0.284 -12.371
  128   2HZ   LYS  11          HZ2       LYS  11  -6.723  -1.299 -11.115
  129   3HZ   LYS  11          HZ3       LYS  11  -6.379   0.324 -10.795
  130    H    THR  12           HN       THR  12  -8.985   4.543  -7.206
  131    HA   THR  12           HA       THR  12  -8.537   7.233  -8.216
  132    HB   THR  12           HB       THR  12 -10.757   6.103  -8.984
  133    HG1  THR  12           HG1      THR  12 -10.049   8.230  -9.409
  134   1HG2  THR  12          HG21      THR  12 -12.701   6.775  -7.686
  135   2HG2  THR  12          HG22      THR  12 -11.653   7.337  -6.382
  136   3HG2  THR  12          HG23      THR  12 -11.714   5.621  -6.788
  137    H    ARG  13           HN       ARG  13  -7.614   5.597  -5.958
  138    HA   ARG  13           HA       ARG  13  -7.945   7.542  -3.790
  139   1HB   ARG  13          HB1       ARG  13  -8.289   4.557  -3.549
  140   2HB   ARG  13          HB2       ARG  13  -7.939   5.577  -2.170
  141   1HG   ARG  13          HG1       ARG  13 -10.368   5.874  -3.922
  142   2HG   ARG  13          HG2       ARG  13 -10.327   4.937  -2.435
  143   1HD   ARG  13          HD1       ARG  13 -11.318   7.120  -2.033
  144   2HD   ARG  13          HD2       ARG  13  -9.773   6.998  -1.184
  145    HE   ARG  13           HE       ARG  13  -9.954   7.906  -3.809
  146   1HH1  ARG  13          HH11      ARG  13  -9.677   8.847  -0.455
  147   2HH1  ARG  13          HH12      ARG  13  -8.676  10.242  -0.633
  148   1HH2  ARG  13          HH21      ARG  13  -8.394  10.029  -4.035
  149   2HH2  ARG  13          HH22      ARG  13  -7.960  10.880  -2.595
  150    H    CYS  14           HN       CYS  14  -6.036   5.112  -5.374
  151    HA   CYS  14           HA       CYS  14  -3.666   5.855  -3.787
  152   1HB   CYS  14          HB1       CYS  14  -4.008   3.125  -4.960
  153   2HB   CYS  14          HB2       CYS  14  -2.954   3.638  -3.661
  154    H    LEU  15           HN       LEU  15  -4.974   5.042  -6.937
  155    HA   LEU  15           HA       LEU  15  -2.726   4.730  -8.482
  156   1HB   LEU  15          HB1       LEU  15  -5.315   4.701  -9.007
  157   2HB   LEU  15          HB2       LEU  15  -4.997   6.339  -9.560
  158    HG   LEU  15           HG       LEU  15  -3.189   5.421 -11.054
  159   1HD1  LEU  15          HD11      LEU  15  -4.378   2.768 -10.242
  160   2HD1  LEU  15          HD12      LEU  15  -2.733   3.321  -9.923
  161   3HD1  LEU  15          HD13      LEU  15  -3.255   3.014 -11.581
  162   1HD2  LEU  15          HD21      LEU  15  -4.744   4.413 -12.713
  163   2HD2  LEU  15          HD22      LEU  15  -5.331   5.930 -12.033
  164   3HD2  LEU  15          HD23      LEU  15  -5.998   4.396 -11.473
  165    H    GLN  16           HN       GLN  16  -4.112   7.802  -7.401
  166    HA   GLN  16           HA       GLN  16  -2.916   9.703  -8.871
  167   1HB   GLN  16          HB1       GLN  16  -2.817  11.007  -6.603
  168   2HB   GLN  16          HB2       GLN  16  -4.356  10.539  -7.310
  169   1HG   GLN  16          HG1       GLN  16  -4.303   8.499  -5.812
  170   2HG   GLN  16          HG2       GLN  16  -2.921   9.236  -4.998
  171   1HE2  GLN  16          HE21      GLN  16  -3.295  11.310  -3.906
  172   2HE2  GLN  16          HE22      GLN  16  -4.884  11.710  -3.370
  173    H    CYS  17           HN       CYS  17  -1.180   7.805  -6.434
  174    HA   CYS  17           HA       CYS  17   1.320   9.139  -7.219
  175   1HB   CYS  17          HB1       CYS  17   1.188   7.923  -4.525
  176   2HB   CYS  17          HB2       CYS  17   2.004   9.368  -5.097
  177    H    HIS  18           HN       HIS  18  -0.163   6.055  -6.355
  178    HA   HIS  18           HA       HIS  18   2.342   4.585  -6.642
  179   1HB   HIS  18          HB1       HIS  18  -0.378   3.930  -5.562
  180   2HB   HIS  18          HB2       HIS  18   0.790   2.667  -5.895
  181    HD1  HIS  18           HD1      HIS  18   3.256   3.172  -4.510
  182    HD2  HIS  18           HD2      HIS  18  -0.350   4.787  -3.125
  183    HE1  HIS  18           HE1      HIS  18   3.598   3.642  -2.042
  184    H    THR  19           HN       THR  19   2.024   2.363  -7.558
  185    HA   THR  19           HA       THR  19   0.354   2.175  -9.947
  186    HB   THR  19           HB       THR  19   2.694   0.943 -10.713
  187    HG1  THR  19           HG1      THR  19   4.271   2.592 -10.396
  188   1HG2  THR  19          HG21      THR  19   3.025   2.953 -12.170
  189   2HG2  THR  19          HG22      THR  19   1.699   3.728 -11.304
  190   3HG2  THR  19          HG23      THR  19   1.405   2.261 -12.237
  191    H    VAL  20           HN       VAL  20  -0.748   0.272  -9.954
  192    HA   VAL  20           HA       VAL  20  -0.327  -1.690  -7.910
  193    HB   VAL  20           HB       VAL  20  -2.477  -0.741  -9.154
  194   1HG1  VAL  20          HG11      VAL  20  -2.122  -1.878 -11.253
  195   2HG1  VAL  20          HG12      VAL  20  -3.584  -2.469 -10.460
  196   3HG1  VAL  20          HG13      VAL  20  -2.112  -3.440 -10.431
  197   1HG2  VAL  20          HG21      VAL  20  -2.252  -3.369  -7.713
  198   2HG2  VAL  20          HG22      VAL  20  -3.786  -2.607  -8.131
  199   3HG2  VAL  20          HG23      VAL  20  -2.664  -1.790  -7.046
  200    H    GLU  21           HN       GLU  21   0.614  -1.506 -11.191
  201    HA   GLU  21           HA       GLU  21   1.459  -4.326 -11.274
  202   1HB   GLU  21          HB1       GLU  21   1.639  -3.640 -13.848
  203   2HB   GLU  21          HB2       GLU  21   0.128  -4.202 -13.161
  204   1HG   GLU  21          HG1       GLU  21  -0.003  -2.180 -14.687
  205   2HG   GLU  21          HG2       GLU  21  -0.793  -2.026 -13.121
  206    H    LYS  22           HN       LYS  22   3.531  -4.333 -13.060
  207    HA   LYS  22           HA       LYS  22   5.363  -2.364 -11.916
  208   1HB   LYS  22          HB1       LYS  22   5.583  -5.149 -12.342
  209   2HB   LYS  22          HB2       LYS  22   6.827  -4.350 -13.317
  210   1HG   LYS  22          HG1       LYS  22   7.872  -3.423 -11.504
  211   2HG   LYS  22          HG2       LYS  22   6.379  -3.304 -10.572
  212   1HD   LYS  22          HD1       LYS  22   6.442  -5.626 -10.038
  213   2HD   LYS  22          HD2       LYS  22   7.768  -5.907 -11.166
  214   1HE   LYS  22          HE1       LYS  22   8.656  -5.885  -8.923
  215   2HE   LYS  22          HE2       LYS  22   9.225  -4.460  -9.772
  216   1HZ   LYS  22          HZ1       LYS  22   8.668  -3.690  -7.658
  217   2HZ   LYS  22          HZ2       LYS  22   7.265  -4.623  -7.560
  218   3HZ   LYS  22          HZ3       LYS  22   7.304  -3.274  -8.572
  219    H    GLY  23           HN       GLY  23   3.660  -1.719 -14.329
  220   1HA   GLY  23          HA1       GLY  23   5.770  -1.284 -16.343
  221   2HA   GLY  23          HA2       GLY  23   4.043  -1.168 -16.634
  222    H    GLY  24           HN       GLY  24   3.841   0.461 -14.052
  223   1HA   GLY  24          HA1       GLY  24   4.243   3.080 -15.227
  224   2HA   GLY  24          HA2       GLY  24   3.362   2.705 -13.755
  225    HA   PRO  25           HA       PRO  25   8.097   3.703 -12.989
  226   1HB   PRO  25          HB1       PRO  25   8.172   6.439 -13.293
  227   2HB   PRO  25          HB2       PRO  25   8.749   5.287 -14.501
  228   1HG   PRO  25          HG1       PRO  25   6.145   6.750 -14.366
  229   2HG   PRO  25          HG2       PRO  25   7.167   6.404 -15.774
  230   1HD   PRO  25          HD1       PRO  25   4.942   4.983 -15.247
  231   2HD   PRO  25          HD2       PRO  25   6.383   4.234 -15.966
  232    H    HIS  26           HN       HIS  26   8.712   4.543 -10.960
  233    HA   HIS  26           HA       HIS  26   6.747   4.752  -8.982
  234   1HB   HIS  26          HB1       HIS  26   9.628   5.685  -8.963
  235   2HB   HIS  26          HB2       HIS  26   8.630   5.471  -7.535
  236    HD2  HIS  26           HD2      HIS  26  10.723   3.519 -10.078
  237    HE1  HIS  26           HE1      HIS  26   9.545   0.736  -7.096
  238    HE2  HIS  26           HE2      HIS  26  11.041   1.114  -9.112
  239    H    LYS  27           HN       LYS  27   5.299   6.415  -8.846
  240    HA   LYS  27           HA       LYS  27   5.993   9.090  -9.725
  241   1HB   LYS  27          HB1       LYS  27   3.443   7.631  -9.144
  242   2HB   LYS  27          HB2       LYS  27   3.444   9.386  -9.192
  243   1HG   LYS  27          HG1       LYS  27   3.985   9.461 -11.461
  244   2HG   LYS  27          HG2       LYS  27   4.639   7.819 -11.455
  245   1HD   LYS  27          HD1       LYS  27   1.733   8.656 -11.327
  246   2HD   LYS  27          HD2       LYS  27   2.531   7.701 -12.583
  247   1HE   LYS  27          HE1       LYS  27   2.607   5.791 -11.274
  248   2HE   LYS  27          HE2       LYS  27   2.563   6.701  -9.763
  249   1HZ   LYS  27          HZ1       LYS  27   0.247   7.172 -10.116
  250   2HZ   LYS  27          HZ2       LYS  27   0.488   5.503 -10.216
  251   3HZ   LYS  27          HZ3       LYS  27   0.273   6.406 -11.629
  252    H    VAL  28           HN       VAL  28   3.837   9.968  -7.589
  253    HA   VAL  28           HA       VAL  28   5.592  11.054  -5.679
  254    HB   VAL  28           HB       VAL  28   2.644  10.612  -5.234
  255   1HG1  VAL  28          HG11      VAL  28   4.529  12.799  -4.330
  256   2HG1  VAL  28          HG12      VAL  28   3.893  11.497  -3.325
  257   3HG1  VAL  28          HG13      VAL  28   2.802  12.719  -3.980
  258   1HG2  VAL  28          HG21      VAL  28   2.166  12.713  -6.342
  259   2HG2  VAL  28          HG22      VAL  28   2.971  11.634  -7.481
  260   3HG2  VAL  28          HG23      VAL  28   3.873  12.945  -6.723
  261    H    GLY  29           HN       GLY  29   4.102   7.976  -5.938
  262   1HA   GLY  29          HA1       GLY  29   5.126   7.113  -3.312
  263   2HA   GLY  29          HA2       GLY  29   3.581   6.559  -3.936
  264    HA   PRO  30           HA       PRO  30   7.377   3.970  -5.465
  265   1HB   PRO  30          HB1       PRO  30   7.403   1.970  -3.643
  266   2HB   PRO  30          HB2       PRO  30   8.337   3.459  -3.451
  267   1HG   PRO  30          HG1       PRO  30   5.682   2.725  -2.263
  268   2HG   PRO  30          HG2       PRO  30   7.090   3.466  -1.477
  269   1HD   PRO  30          HD1       PRO  30   4.971   4.922  -2.282
  270   2HD   PRO  30          HD2       PRO  30   6.628   5.559  -2.341
  271    H    ASN  31           HN       ASN  31   7.320   1.720  -6.265
  272    HA   ASN  31           HA       ASN  31   4.718   1.003  -7.218
  273   1HB   ASN  31          HB1       ASN  31   6.809   0.857  -8.563
  274   2HB   ASN  31          HB2       ASN  31   7.384  -0.425  -7.507
  275   1HD2  ASN  31          HD21      ASN  31   5.068   0.369 -10.029
  276   2HD2  ASN  31          HD22      ASN  31   4.715  -1.280 -10.430
  277    H    LEU  32           HN       LEU  32   3.325  -0.447  -6.348
  278    HA   LEU  32           HA       LEU  32   3.898  -1.754  -3.821
  279   1HB   LEU  32          HB1       LEU  32   1.310  -1.244  -5.295
  280   2HB   LEU  32          HB2       LEU  32   1.431  -1.970  -3.704
  281    HG   LEU  32           HG       LEU  32   2.201   0.869  -4.436
  282   1HD1  LEU  32          HD11      LEU  32   0.017  -0.170  -2.621
  283   2HD1  LEU  32          HD12      LEU  32  -0.234   0.407  -4.269
  284   3HD1  LEU  32          HD13      LEU  32   0.345   1.517  -3.027
  285   1HD2  LEU  32          HD21      LEU  32   2.372  -0.566  -1.781
  286   2HD2  LEU  32          HD22      LEU  32   2.498   1.181  -1.985
  287   3HD2  LEU  32          HD23      LEU  32   3.710   0.120  -2.703
  288    H    HIS  33           HN       HIS  33   3.769  -2.695  -7.066
  289    HA   HIS  33           HA       HIS  33   2.633  -5.266  -7.011
  290   1HB   HIS  33          HB1       HIS  33   3.053  -3.725  -9.000
  291   2HB   HIS  33          HB2       HIS  33   4.732  -4.253  -8.930
  292    HD2  HIS  33           HD2      HIS  33   1.681  -6.609  -8.456
  293    HE1  HIS  33           HE1      HIS  33   3.614  -7.733 -12.070
  294    HE2  HIS  33           HE2      HIS  33   1.808  -8.361 -10.394
  295    H    GLY  34           HN       GLY  34   3.469  -6.547  -5.405
  296   1HA   GLY  34          HA1       GLY  34   4.926  -8.463  -5.148
  297   2HA   GLY  34          HA2       GLY  34   6.256  -7.462  -5.692
  298    H    ILE  35           HN       ILE  35   4.101  -5.980  -3.339
  299    HA   ILE  35           HA       ILE  35   6.267  -5.961  -1.454
  300    HB   ILE  35           HB       ILE  35   4.852  -4.692   0.055
  301   1HG1  ILE  35          HG11      ILE  35   2.678  -5.274  -1.913
  302   2HG1  ILE  35          HG12      ILE  35   2.598  -5.114  -0.160
  303   1HG2  ILE  35          HG21      ILE  35   4.933  -3.588  -2.744
  304   2HG2  ILE  35          HG22      ILE  35   6.308  -3.698  -1.646
  305   3HG2  ILE  35          HG23      ILE  35   4.935  -2.670  -1.238
  306   1HD1  ILE  35          HD11      ILE  35   2.770  -2.883  -2.190
  307   2HD1  ILE  35          HD12      ILE  35   2.914  -2.641  -0.448
  308   3HD1  ILE  35          HD13      ILE  35   1.414  -3.269  -1.128
  309    H    PHE  36           HN       PHE  36   3.302  -7.858  -1.689
  310    HA   PHE  36           HA       PHE  36   3.211  -8.844   0.919
  311   1HB   PHE  36          HB1       PHE  36   2.250 -10.099  -1.656
  312   2HB   PHE  36          HB2       PHE  36   1.873 -10.718  -0.049
  313    HD1  PHE  36           HD1      PHE  36   1.204  -8.517   1.579
  314    HD2  PHE  36           HD2      PHE  36   0.404  -9.054  -2.614
  315    HE1  PHE  36           HE1      PHE  36  -0.693  -6.916   1.744
  316    HE2  PHE  36           HE2      PHE  36  -1.494  -7.453  -2.453
  317    HZ   PHE  36           HZ       PHE  36  -2.037  -6.376  -0.278
  318    H    GLY  37           HN       GLY  37   4.784  -9.739   1.940
  319   1HA   GLY  37          HA1       GLY  37   5.964 -11.748   2.505
  320   2HA   GLY  37          HA2       GLY  37   6.325 -11.973   0.804
  321    H    ARG  38           HN       ARG  38   6.827  -8.760   1.251
  322    HA   ARG  38           HA       ARG  38   9.689  -9.061   1.897
  323   1HB   ARG  38          HB1       ARG  38   8.184  -7.287  -0.015
  324   2HB   ARG  38          HB2       ARG  38   9.734  -6.757   0.622
  325   1HG   ARG  38          HG1       ARG  38  10.916  -8.352  -0.537
  326   2HG   ARG  38          HG2       ARG  38   9.554  -9.473  -0.596
  327   1HD   ARG  38          HD1       ARG  38   9.692  -8.729  -2.804
  328   2HD   ARG  38          HD2       ARG  38   8.455  -7.672  -2.121
  329    HE   ARG  38           HE       ARG  38  10.413  -6.788  -1.491
  330   1HH1  ARG  38          HH21      ARG  38   9.422  -7.610  -4.687
  331   2HH1  ARG  38          HH22      ARG  38   9.854  -6.124  -5.365
  332   1HH2  ARG  38          HH11      ARG  38  11.676  -4.743  -3.017
  333   2HH2  ARG  38          HH12      ARG  38  11.628  -5.186  -4.668
  334    H    HIS  39           HN       HIS  39  10.573  -6.825   2.656
  335    HA   HIS  39           HA       HIS  39   8.992  -6.056   4.993
  336   1HB   HIS  39          HB1       HIS  39  11.873  -5.347   4.370
  337   2HB   HIS  39          HB2       HIS  39  11.062  -5.267   5.937
  338    HD2  HIS  39           HD2      HIS  39  10.512  -7.626   7.183
  339    HE1  HIS  39           HE1      HIS  39  12.932 -10.077   4.685
  340    HE2  HIS  39           HE2      HIS  39  11.540 -10.003   6.807
  341    H    SER  40           HN       SER  40   9.131  -3.670   5.630
  342    HA   SER  40           HA       SER  40   8.126  -2.067   3.533
  343   1HB   SER  40          HB1       SER  40   9.124  -0.778   6.039
  344   2HB   SER  40          HB2       SER  40   7.703  -0.397   5.078
  345    HG   SER  40           HG       SER  40   6.923  -2.531   5.868
  346    H    GLY  41           HN       GLY  41   8.963  -0.308   2.468
  347   1HA   GLY  41          HA1       GLY  41  10.551   1.135   1.632
  348   2HA   GLY  41          HA2       GLY  41  11.614   0.677   2.940
  349    H    GLN  42           HN       GLN  42  10.363  -1.495   0.314
  350    HA   GLN  42           HA       GLN  42  13.155  -1.766  -0.549
  351   1HB   GLN  42          HB1       GLN  42  11.197  -4.047  -0.514
  352   2HB   GLN  42          HB2       GLN  42  12.917  -4.122  -0.876
  353   1HG   GLN  42          HG1       GLN  42  13.427  -3.398   1.424
  354   2HG   GLN  42          HG2       GLN  42  11.704  -3.359   1.786
  355   1HE2  GLN  42          HE21      GLN  42  13.818  -4.993   3.042
  356   2HE2  GLN  42          HE22      GLN  42  13.346  -6.635   2.805
  357    H    ALA  43           HN       ALA  43  10.855  -0.186  -1.927
  358    HA   ALA  43           HA       ALA  43  10.218  -1.358  -4.362
  359   1HB   ALA  43          HB1       ALA  43  10.644   1.562  -3.766
  360   2HB   ALA  43          HB2       ALA  43   9.158   0.648  -3.517
  361   3HB   ALA  43          HB3       ALA  43   9.769   0.909  -5.150
  362    H    GLU  44           HN       GLU  44  11.170  -1.688  -6.276
  363    HA   GLU  44           HA       GLU  44  13.987  -1.381  -6.584
  364   1HB   GLU  44          HB1       GLU  44  12.222  -2.406  -8.795
  365   2HB   GLU  44          HB2       GLU  44  13.849  -2.904  -8.343
  366   1HG   GLU  44          HG1       GLU  44  12.654  -4.693  -7.548
  367   2HG   GLU  44          HG2       GLU  44  12.689  -3.681  -6.117
  368    H    GLY  45           HN       GLY  45  13.990   0.980  -6.438
  369   1HA   GLY  45          HA1       GLY  45  15.034   2.531  -8.113
  370   2HA   GLY  45          HA2       GLY  45  13.551   2.347  -9.022
  371    H    TYR  46           HN       TYR  46  13.221   2.609  -5.578
  372    HA   TYR  46           HA       TYR  46  12.796   5.477  -5.603
  373   1HB   TYR  46          HB1       TYR  46  10.678   4.575  -6.327
  374   2HB   TYR  46          HB2       TYR  46  10.613   3.518  -4.924
  375    HD1  TYR  46           HD1      TYR  46  10.083   6.913  -6.185
  376    HD2  TYR  46           HD2      TYR  46  10.253   4.454  -2.667
  377    HE1  TYR  46           HE1      TYR  46   8.785   8.634  -4.937
  378    HE2  TYR  46           HE2      TYR  46   8.861   6.111  -1.431
  379    HH   TYR  46           HH       TYR  46   7.270   8.742  -3.049
  380    H    SER  47           HN       SER  47  13.020   6.517  -3.668
  381    HA   SER  47           HA       SER  47  14.177   4.998  -1.460
  382   1HB   SER  47          HB1       SER  47  14.337   7.815  -1.016
  383   2HB   SER  47          HB2       SER  47  15.643   6.673  -1.342
  384    HG   SER  47           HG       SER  47  15.786   7.508  -3.253
  385    H    TYR  48           HN       TYR  48  13.477   5.032   0.564
  386    HA   TYR  48           HA       TYR  48  10.865   6.117   1.297
  387   1HB   TYR  48          HB1       TYR  48  12.488   3.749   2.221
  388   2HB   TYR  48          HB2       TYR  48  11.013   4.266   3.028
  389    HD1  TYR  48           HD1      TYR  48   8.866   3.844   2.118
  390    HD2  TYR  48           HD2      TYR  48  12.390   2.920  -0.166
  391    HE1  TYR  48           HE1      TYR  48   7.499   2.432   0.594
  392    HE2  TYR  48           HE2      TYR  48  11.034   1.506  -1.696
  393    HH   TYR  48           HH       TYR  48   8.046   0.316  -0.850
  394    H    THR  49           HN       THR  49  10.588   6.871   3.612
  395    HA   THR  49           HA       THR  49  12.506   8.773   4.455
  396    HB   THR  49           HB       THR  49  11.056   8.654   6.652
  397    HG1  THR  49           HG1      THR  49   9.112   7.750   4.860
  398   1HG2  THR  49          HG21      THR  49   9.464  10.206   5.666
  399   2HG2  THR  49          HG22      THR  49   9.977   9.713   4.052
  400   3HG2  THR  49          HG23      THR  49  11.110  10.538   5.124
  401    H    ASP  50           HN       ASP  50  13.498   8.956   6.578
  402    HA   ASP  50           HA       ASP  50  15.252   6.964   7.277
  403   1HB   ASP  50          HB1       ASP  50  15.723   9.173   7.936
  404   2HB   ASP  50          HB2       ASP  50  14.167   9.361   8.742
  405    H    ALA  51           HN       ALA  51  11.994   7.470   8.515
  406    HA   ALA  51           HA       ALA  51  12.218   5.515  10.617
  407   1HB   ALA  51          HB1       ALA  51  10.004   6.229  11.234
  408   2HB   ALA  51          HB2       ALA  51   9.804   7.073   9.698
  409   3HB   ALA  51          HB3       ALA  51  10.987   7.649  10.872
  410    H    ASN  52           HN       ASN  52  10.737   5.553   7.351
  411    HA   ASN  52           HA       ASN  52   9.186   3.198   7.763
  412   1HB   ASN  52          HB1       ASN  52   8.341   4.553   6.088
  413   2HB   ASN  52          HB2       ASN  52   9.927   4.885   5.404
  414   1HD2  ASN  52          HD21      ASN  52   7.119   2.938   5.118
  415   2HD2  ASN  52          HD22      ASN  52   7.725   2.003   3.800
  416    H    ILE  53           HN       ILE  53  12.432   3.743   6.464
  417    HA   ILE  53           HA       ILE  53  12.935   1.095   5.634
  418    HB   ILE  53           HB       ILE  53  14.782   3.345   6.366
  419   1HG1  ILE  53          HG11      ILE  53  14.060   2.225   3.637
  420   2HG1  ILE  53          HG12      ILE  53  13.259   3.616   4.363
  421   1HG2  ILE  53          HG21      ILE  53  16.568   2.095   5.176
  422   2HG2  ILE  53          HG22      ILE  53  15.486   0.708   5.050
  423   3HG2  ILE  53          HG23      ILE  53  16.025   1.262   6.635
  424   1HD1  ILE  53          HD11      ILE  53  16.210   3.465   3.727
  425   2HD1  ILE  53          HD12      ILE  53  15.341   4.869   4.343
  426   3HD1  ILE  53          HD13      ILE  53  14.994   4.258   2.726
  427    H    LYS  54           HN       LYS  54  14.524   2.654   8.475
  428    HA   LYS  54           HA       LYS  54  15.281   0.575   9.969
  429   1HB   LYS  54          HB1       LYS  54  13.880   3.073  10.907
  430   2HB   LYS  54          HB2       LYS  54  14.730   1.962  11.984
  431   1HG   LYS  54          HG1       LYS  54  16.642   2.327  10.118
  432   2HG   LYS  54          HG2       LYS  54  15.818   3.885  10.013
  433   1HD   LYS  54          HD1       LYS  54  16.034   3.449  12.744
  434   2HD   LYS  54          HD2       LYS  54  17.571   2.851  12.099
  435   1HE   LYS  54          HE1       LYS  54  17.654   5.273  12.652
  436   2HE   LYS  54          HE2       LYS  54  17.947   4.954  10.939
  437   1HZ   LYS  54          HZ1       LYS  54  15.451   5.364  10.697
  438   2HZ   LYS  54          HZ2       LYS  54  16.469   6.700  10.927
  439   3HZ   LYS  54          HZ3       LYS  54  15.562   6.097  12.222
  440    H    LYS  55           HN       LYS  55  12.010   1.055   9.130
  441    HA   LYS  55           HA       LYS  55  10.843  -0.323  11.398
  442   1HB   LYS  55          HB1       LYS  55   9.680   1.558  10.530
  443   2HB   LYS  55          HB2       LYS  55   9.716   0.921   8.902
  444   1HG   LYS  55          HG1       LYS  55   7.549   0.553   9.428
  445   2HG   LYS  55          HG2       LYS  55   8.240  -0.976   9.939
  446   1HD   LYS  55          HD1       LYS  55   7.654   1.333  11.798
  447   2HD   LYS  55          HD2       LYS  55   6.553  -0.012  11.508
  448   1HE   LYS  55          HE1       LYS  55   9.344  -0.223  12.661
  449   2HE   LYS  55          HE2       LYS  55   7.839  -0.332  13.576
  450   1HZ   LYS  55          HZ1       LYS  55   7.265  -2.274  12.121
  451   2HZ   LYS  55          HZ2       LYS  55   8.565  -2.529  13.167
  452   3HZ   LYS  55          HZ3       LYS  55   8.854  -2.226  11.530
  453    H    ASN  56           HN       ASN  56  11.541  -1.108   8.058
  454    HA   ASN  56           HA       ASN  56  10.999  -2.844   6.688
  455   1HB   ASN  56          HB1       ASN  56  13.081  -3.466   8.648
  456   2HB   ASN  56          HB2       ASN  56  12.441  -4.876   7.834
  457   1HD2  ASN  56          HD21      ASN  56  13.862  -1.634   7.067
  458   2HD2  ASN  56          HD22      ASN  56  14.303  -2.266   5.540
  459    H    VAL  57           HN       VAL  57   8.639  -2.724   7.892
  460    HA   VAL  57           HA       VAL  57   7.939  -5.058   9.378
  461    HB   VAL  57           HB       VAL  57   6.730  -2.619   8.871
  462   1HG1  VAL  57          HG11      VAL  57   4.899  -4.778   7.827
  463   2HG1  VAL  57          HG12      VAL  57   5.507  -3.400   6.909
  464   3HG1  VAL  57          HG13      VAL  57   4.415  -3.141   8.270
  465   1HG2  VAL  57          HG21      VAL  57   6.803  -3.900  10.931
  466   2HG2  VAL  57          HG22      VAL  57   5.665  -5.067  10.258
  467   3HG2  VAL  57          HG23      VAL  57   5.153  -3.405  10.548
  468    H    LEU  58           HN       LEU  58   7.096  -6.992   8.695
  469    HA   LEU  58           HA       LEU  58   7.487  -7.597   5.900
  470   1HB   LEU  58          HB1       LEU  58   8.307  -9.140   7.638
  471   2HB   LEU  58          HB2       LEU  58   6.654  -9.409   8.175
  472    HG   LEU  58           HG       LEU  58   6.196 -10.182   5.736
  473   1HD1  LEU  58          HD11      LEU  58   8.312  -9.337   4.807
  474   2HD1  LEU  58          HD12      LEU  58   8.148 -11.076   4.566
  475   3HD1  LEU  58          HD13      LEU  58   9.208 -10.459   5.833
  476   1HD2  LEU  58          HD21      LEU  58   7.949 -11.838   7.565
  477   2HD2  LEU  58          HD22      LEU  58   7.082 -12.469   6.165
  478   3HD2  LEU  58          HD23      LEU  58   6.185 -11.810   7.532
  479    H    TRP  59           HN       TRP  59   5.953  -6.756   4.651
  480    HA   TRP  59           HA       TRP  59   3.275  -6.310   5.268
  481   1HB   TRP  59          HB1       TRP  59   4.620  -6.722   2.599
  482   2HB   TRP  59          HB2       TRP  59   2.981  -6.129   2.794
  483    HD1  TRP  59           HD1      TRP  59   6.222  -4.881   2.042
  484    HE1  TRP  59           HE1      TRP  59   6.465  -2.383   2.634
  485    HE3  TRP  59           HE3      TRP  59   2.082  -4.267   4.982
  486    HZ2  TRP  59           HZ2      TRP  59   5.179  -0.424   4.273
  487    HZ3  TRP  59           HZ3      TRP  59   1.604  -2.079   6.011
  488    HH2  TRP  59           HH2      TRP  59   3.120  -0.159   5.672
  489    H    ASP  60           HN       ASP  60   1.839  -7.726   5.763
  490    HA   ASP  60           HA       ASP  60   1.524 -10.302   4.408
  491   1HB   ASP  60          HB1       ASP  60   1.976 -11.204   6.408
  492   2HB   ASP  60          HB2       ASP  60   1.950  -9.636   7.190
  493    H    GLU  61           HN       GLU  61  -0.900 -11.056   5.281
  494    HA   GLU  61           HA       GLU  61  -2.700  -9.513   3.722
  495   1HB   GLU  61          HB1       GLU  61  -2.709 -12.093   4.437
  496   2HB   GLU  61          HB2       GLU  61  -3.777 -11.479   5.695
  497   1HG   GLU  61          HG1       GLU  61  -5.322 -11.990   4.078
  498   2HG   GLU  61          HG2       GLU  61  -4.977 -10.313   3.648
  499    H    ASN  62           HN       ASN  62  -2.624 -10.105   7.259
  500    HA   ASN  62           HA       ASN  62  -4.530  -8.045   7.814
  501   1HB   ASN  62          HB1       ASN  62  -4.422 -10.044   9.166
  502   2HB   ASN  62          HB2       ASN  62  -2.750  -9.723   9.591
  503   1HD2  ASN  62          HD21      ASN  62  -2.318  -7.930  10.993
  504   2HD2  ASN  62          HD22      ASN  62  -3.544  -7.372  12.075
  505    H    ASN  63           HN       ASN  63  -0.955  -8.245   8.240
  506    HA   ASN  63           HA       ASN  63  -0.424  -5.859   9.437
  507   1HB   ASN  63          HB1       ASN  63   1.269  -7.491   9.006
  508   2HB   ASN  63          HB2       ASN  63   1.107  -7.293   7.272
  509   1HD2  ASN  63          HD21      ASN  63   2.083  -5.466  10.205
  510   2HD2  ASN  63          HD22      ASN  63   3.041  -4.419   9.216
  511    H    MET  64           HN       MET  64  -0.943  -6.117   5.847
  512    HA   MET  64           HA       MET  64  -0.450  -3.442   5.253
  513   1HB   MET  64          HB1       MET  64  -0.669  -4.992   3.480
  514   2HB   MET  64          HB2       MET  64  -2.293  -5.449   3.977
  515   1HG   MET  64          HG1       MET  64  -3.155  -3.306   3.311
  516   2HG   MET  64          HG2       MET  64  -1.542  -2.719   2.957
  517   1HE   MET  64          HE1       MET  64  -4.558  -4.968   1.756
  518   2HE   MET  64          HE2       MET  64  -3.283  -6.132   2.121
  519   3HE   MET  64          HE3       MET  64  -3.799  -5.884   0.452
  520    H    SER  65           HN       SER  65  -3.498  -4.843   6.477
  521    HA   SER  65           HA       SER  65  -5.052  -2.504   6.383
  522   1HB   SER  65          HB1       SER  65  -5.538  -4.446   8.579
  523   2HB   SER  65          HB2       SER  65  -6.674  -3.681   7.476
  524    HG   SER  65           HG       SER  65  -5.251  -6.032   7.225
  525    H    GLU  66           HN       GLU  66  -2.839  -3.654   8.897
  526    HA   GLU  66           HA       GLU  66  -3.406  -1.903  10.963
  527   1HB   GLU  66          HB1       GLU  66  -0.663  -2.876  10.119
  528   2HB   GLU  66          HB2       GLU  66  -1.149  -2.375  11.736
  529   1HG   GLU  66          HG1       GLU  66  -2.606  -4.268  11.964
  530   2HG   GLU  66          HG2       GLU  66  -2.361  -4.720  10.277
  531    H    TYR  67           HN       TYR  67  -1.192  -1.433   8.241
  532    HA   TYR  67           HA       TYR  67  -0.469   1.259   8.804
  533   1HB   TYR  67          HB1       TYR  67   1.052  -0.183   7.668
  534   2HB   TYR  67          HB2       TYR  67  -0.126  -0.543   6.419
  535    HD1  TYR  67           HD1      TYR  67  -0.264   0.777   4.446
  536    HD2  TYR  67           HD2      TYR  67   2.038   2.132   7.809
  537    HE1  TYR  67           HE1      TYR  67   0.836   2.480   2.999
  538    HE2  TYR  67           HE2      TYR  67   3.188   3.803   6.371
  539    HH   TYR  67           HH       TYR  67   2.204   4.403   3.064
  540    H    LEU  68           HN       LEU  68  -2.825  -0.168   6.463
  541    HA   LEU  68           HA       LEU  68  -3.405   2.221   5.131
  542   1HB   LEU  68          HB1       LEU  68  -5.148  -0.180   5.632
  543   2HB   LEU  68          HB2       LEU  68  -5.576   1.129   4.546
  544    HG   LEU  68           HG       LEU  68  -3.234  -0.766   4.242
  545   1HD1  LEU  68          HD11      LEU  68  -4.517  -1.474   2.261
  546   2HD1  LEU  68          HD12      LEU  68  -5.784  -0.317   2.670
  547   3HD1  LEU  68          HD13      LEU  68  -5.455  -1.678   3.740
  548   1HD2  LEU  68          HD21      LEU  68  -4.079   1.568   2.494
  549   2HD2  LEU  68          HD22      LEU  68  -2.923   0.324   2.020
  550   3HD2  LEU  68          HD23      LEU  68  -2.550   1.410   3.358
  551    H    THR  69           HN       THR  69  -4.889   1.017   8.159
  552    HA   THR  69           HA       THR  69  -6.958   2.919   8.301
  553    HB   THR  69           HB       THR  69  -5.674   1.831  10.773
  554    HG1  THR  69           HG1      THR  69  -5.843   0.057   9.444
  555   1HG2  THR  69          HG21      THR  69  -7.997   1.632  11.525
  556   2HG2  THR  69          HG22      THR  69  -8.565   2.229   9.966
  557   3HG2  THR  69          HG23      THR  69  -7.649   3.291  11.035
  558    H    ASN  70           HN       ASN  70  -3.581   3.140   9.360
  559    HA   ASN  70           HA       ASN  70  -3.727   5.996   9.338
  560   1HB   ASN  70          HB1       ASN  70  -4.598   5.330  11.639
  561   2HB   ASN  70          HB2       ASN  70  -2.963   4.783  11.995
  562   1HD2  ASN  70          HD21      ASN  70  -4.402   6.891  13.337
  563   2HD2  ASN  70          HD22      ASN  70  -3.293   8.205  13.164
  564    HA   PRO  71           HA       PRO  71   0.347   4.391   7.889
  565   1HB   PRO  71          HB1       PRO  71   0.806   6.612   6.325
  566   2HB   PRO  71          HB2       PRO  71  -0.029   5.156   5.776
  567   1HG   PRO  71          HG1       PRO  71  -1.170   7.751   6.731
  568   2HG   PRO  71          HG2       PRO  71  -1.691   6.727   5.380
  569   1HD   PRO  71          HD1       PRO  71  -2.998   6.734   7.724
  570   2HD   PRO  71          HD2       PRO  71  -2.810   5.247   6.771
  571    H    LYS  72           HN       LYS  72  -0.449   7.685   8.939
  572    HA   LYS  72           HA       LYS  72   2.170   8.517   9.597
  573   1HB   LYS  72          HB1       LYS  72  -0.547   9.581   9.908
  574   2HB   LYS  72          HB2       LYS  72   0.553  10.062  11.189
  575   1HG   LYS  72          HG1       LYS  72   0.445  11.703   9.366
  576   2HG   LYS  72          HG2       LYS  72   2.065  11.052   9.589
  577   1HD   LYS  72          HD1       LYS  72   1.828   9.649   7.642
  578   2HD   LYS  72          HD2       LYS  72   0.128  10.089   7.478
  579   1HE   LYS  72          HE1       LYS  72   1.314  11.360   5.863
  580   2HE   LYS  72          HE2       LYS  72   0.874  12.469   7.153
  581   1HZ   LYS  72          HZ1       LYS  72   3.078  12.958   6.575
  582   2HZ   LYS  72          HZ2       LYS  72   3.539  11.332   6.558
  583   3HZ   LYS  72          HZ3       LYS  72   3.187  12.085   8.027
  584    H    LYS  73           HN       LYS  73  -0.318   6.873  11.481
  585    HA   LYS  73           HA       LYS  73   1.143   7.143  13.946
  586   1HB   LYS  73          HB1       LYS  73  -1.275   7.044  14.028
  587   2HB   LYS  73          HB2       LYS  73  -1.270   5.456  13.275
  588   1HG   LYS  73          HG1       LYS  73  -1.676   5.269  15.666
  589   2HG   LYS  73          HG2       LYS  73  -0.146   4.514  15.239
  590   1HD   LYS  73          HD1       LYS  73   0.769   6.947  15.902
  591   2HD   LYS  73          HD2       LYS  73  -0.688   6.929  16.893
  592   1HE   LYS  73          HE1       LYS  73   1.171   6.125  18.206
  593   2HE   LYS  73          HE2       LYS  73   0.067   4.788  17.897
  594   1HZ   LYS  73          HZ1       LYS  73   2.165   5.066  15.943
  595   2HZ   LYS  73          HZ2       LYS  73   1.611   3.688  16.748
  596   3HZ   LYS  73          HZ3       LYS  73   2.720   4.713  17.505
  597    H    TYR  74           HN       TYR  74   0.696   4.500  11.610
  598    HA   TYR  74           HA       TYR  74   2.218   2.574  13.024
  599   1HB   TYR  74          HB1       TYR  74   0.505   2.296  11.105
  600   2HB   TYR  74          HB2       TYR  74   1.887   2.576  10.044
  601    HD1  TYR  74           HD1      TYR  74   3.442   0.796   9.567
  602    HD2  TYR  74           HD2      TYR  74   0.631   0.479  12.805
  603    HE1  TYR  74           HE1      TYR  74   4.025  -1.617   9.836
  604    HE2  TYR  74           HE2      TYR  74   1.194  -1.920  13.080
  605    HH   TYR  74           HH       TYR  74   2.081  -3.760  11.653
  606    H    ILE  75           HN       ILE  75   3.092   4.834  10.471
  607    HA   ILE  75           HA       ILE  75   5.946   4.400  10.998
  608    HB   ILE  75           HB       ILE  75   4.735   4.871   8.261
  609   1HG1  ILE  75          HG11      ILE  75   5.954   2.376   9.498
  610   2HG1  ILE  75          HG12      ILE  75   4.303   2.564   8.925
  611   1HG2  ILE  75          HG21      ILE  75   7.088   4.470   7.505
  612   2HG2  ILE  75          HG22      ILE  75   7.588   4.453   9.195
  613   3HG2  ILE  75          HG23      ILE  75   6.908   5.920   8.493
  614   1HD1  ILE  75          HD11      ILE  75   5.816   1.219   7.437
  615   2HD1  ILE  75          HD12      ILE  75   6.709   2.704   7.107
  616   3HD1  ILE  75          HD13      ILE  75   5.012   2.574   6.644
  617    HA   PRO  76           HA       PRO  76   4.965   8.756  11.949
  618   1HB   PRO  76          HB1       PRO  76   7.133   9.106  13.561
  619   2HB   PRO  76          HB2       PRO  76   5.613   8.394  14.110
  620   1HG   PRO  76          HG1       PRO  76   8.150   7.040  13.286
  621   2HG   PRO  76          HG2       PRO  76   7.074   6.670  14.646
  622   1HD   PRO  76          HD1       PRO  76   7.044   5.252  12.344
  623   2HD   PRO  76          HD2       PRO  76   5.583   5.520  13.316
  624    H    GLY  77           HN       GLY  77   5.534  10.414  10.684
  625   1HA   GLY  77          HA1       GLY  77   6.925  11.968   9.670
  626   2HA   GLY  77          HA2       GLY  77   8.291  10.901   9.929
  627    H    THR  78           HN       THR  78   6.163   8.882   8.535
  628    HA   THR  78           HA       THR  78   7.382   8.600   6.070
  629    HB   THR  78           HB       THR  78   5.577   7.191   7.463
  630    HG1  THR  78           HG1      THR  78   6.802   6.949   5.090
  631   1HG2  THR  78          HG21      THR  78   4.012   8.211   5.095
  632   2HG2  THR  78          HG22      THR  78   3.569   8.330   6.798
  633   3HG2  THR  78          HG23      THR  78   3.617   6.754   6.007
  634    H    LYS  79           HN       LYS  79   6.900   9.128   3.968
  635    HA   LYS  79           HA       LYS  79   5.818  11.719   3.490
  636   1HB   LYS  79          HB1       LYS  79   6.372   9.648   1.379
  637   2HB   LYS  79          HB2       LYS  79   6.460  11.396   1.236
  638   1HG   LYS  79          HG1       LYS  79   8.439  11.385   2.733
  639   2HG   LYS  79          HG2       LYS  79   8.371   9.615   2.753
  640   1HD   LYS  79          HD1       LYS  79   8.219  10.262   0.046
  641   2HD   LYS  79          HD2       LYS  79   9.408  11.401   0.691
  642   1HE   LYS  79          HE1       LYS  79  10.820   9.650   0.310
  643   2HE   LYS  79          HE2       LYS  79  10.258   9.175   1.913
  644   1HZ   LYS  79          HZ1       LYS  79   9.084   7.457   1.088
  645   2HZ   LYS  79          HZ2       LYS  79  10.183   7.569  -0.190
  646   3HZ   LYS  79          HZ3       LYS  79   8.656   8.273  -0.336
  647    H    MET  80           HN       MET  80   4.226   8.601   3.533
  648    HA   MET  80           HA       MET  80   2.204   9.247   1.647
  649   1HB   MET  80          HB1       MET  80   2.459   6.975   1.796
  650   2HB   MET  80          HB2       MET  80   2.662   6.999   3.552
  651   1HG   MET  80          HG1       MET  80   0.443   6.995   3.963
  652   2HG   MET  80          HG2       MET  80   0.061   7.939   2.536
  653   1HE   MET  80          HE1       MET  80  -2.073   4.543   2.569
  654   2HE   MET  80          HE2       MET  80  -2.181   6.298   2.710
  655   3HE   MET  80          HE3       MET  80  -1.414   5.357   3.989
  656    H    ALA  81           HN       ALA  81   1.222  11.085   2.032
  657    HA   ALA  81           HA       ALA  81   0.039  11.715   4.596
  658   1HB   ALA  81          HB1       ALA  81   1.514  13.299   3.373
  659   2HB   ALA  81          HB2       ALA  81  -0.046  13.958   3.862
  660   3HB   ALA  81          HB3       ALA  81   0.224  13.489   2.184
  661    H    PHE  82           HN       PHE  82  -1.141   9.817   2.655
  662    HA   PHE  82           HA       PHE  82  -3.554  10.584   1.559
  663   1HB   PHE  82          HB1       PHE  82  -2.471   8.633   0.794
  664   2HB   PHE  82          HB2       PHE  82  -2.452   7.918   2.401
  665    HD1  PHE  82           HD1      PHE  82  -4.737   8.957  -0.372
  666    HD2  PHE  82           HD2      PHE  82  -4.188   6.509   3.124
  667    HE1  PHE  82           HE1      PHE  82  -6.938   7.871  -0.784
  668    HE2  PHE  82           HE2      PHE  82  -6.391   5.434   2.720
  669    HZ   PHE  82           HZ       PHE  82  -7.775   6.130   0.777
  670    H    GLY  83           HN       GLY  83  -2.945  10.215   4.934
  671   1HA   GLY  83          HA1       GLY  83  -4.471  10.723   6.638
  672   2HA   GLY  83          HA2       GLY  83  -5.777  10.603   5.480
  673    H    GLY  84           HN       GLY  84  -5.348   7.942   4.594
  674   1HA   GLY  84          HA1       GLY  84  -5.250   5.687   5.272
  675   2HA   GLY  84          HA2       GLY  84  -5.393   6.198   6.944
  676    H    LEU  85           HN       LEU  85  -6.941   4.523   4.678
  677    HA   LEU  85           HA       LEU  85  -9.646   5.430   4.861
  678   1HB   LEU  85          HB1       LEU  85  -8.316   2.994   3.717
  679   2HB   LEU  85          HB2       LEU  85 -10.060   3.077   3.852
  680    HG   LEU  85           HG       LEU  85  -8.285   4.881   2.192
  681   1HD1  LEU  85          HD11      LEU  85 -10.377   2.795   1.550
  682   2HD1  LEU  85          HD12      LEU  85  -8.657   2.741   1.165
  683   3HD1  LEU  85          HD13      LEU  85  -9.703   3.910   0.360
  684   1HD2  LEU  85          HD21      LEU  85 -10.299   5.971   1.387
  685   2HD2  LEU  85          HD22      LEU  85 -10.204   6.169   3.137
  686   3HD2  LEU  85          HD23      LEU  85 -11.302   4.976   2.443
  687    H    LYS  86           HN       LYS  86 -10.297   5.522   6.861
  688    HA   LYS  86           HA       LYS  86  -9.967   3.749   8.993
  689   1HB   LYS  86          HB1       LYS  86 -12.199   5.755   8.678
  690   2HB   LYS  86          HB2       LYS  86 -11.485   5.165  10.173
  691   1HG   LYS  86          HG1       LYS  86  -9.748   6.595   8.197
  692   2HG   LYS  86          HG2       LYS  86 -10.830   7.526   9.235
  693   1HD   LYS  86          HD1       LYS  86  -9.802   6.578  11.225
  694   2HD   LYS  86          HD2       LYS  86  -8.793   5.521  10.239
  695   1HE   LYS  86          HE1       LYS  86  -8.679   8.535  10.082
  696   2HE   LYS  86          HE2       LYS  86  -7.654   7.589  11.158
  697   1HZ   LYS  86          HZ1       LYS  86  -7.742   7.331   8.201
  698   2HZ   LYS  86          HZ2       LYS  86  -6.734   6.460   9.242
  699   3HZ   LYS  86          HZ3       LYS  86  -6.537   8.131   9.085
  700    H    LYS  87           HN       LYS  87 -12.183   3.561   6.370
  701    HA   LYS  87           HA       LYS  87 -14.248   2.027   7.665
  702   1HB   LYS  87          HB1       LYS  87 -13.661   2.372   4.735
  703   2HB   LYS  87          HB2       LYS  87 -15.140   1.761   5.425
  704   1HG   LYS  87          HG1       LYS  87 -15.671   4.044   6.269
  705   2HG   LYS  87          HG2       LYS  87 -14.179   4.639   5.478
  706   1HD   LYS  87          HD1       LYS  87 -15.056   3.130   3.523
  707   2HD   LYS  87          HD2       LYS  87 -16.597   3.366   4.274
  708   1HE   LYS  87          HE1       LYS  87 -16.768   5.529   3.466
  709   2HE   LYS  87          HE2       LYS  87 -15.012   5.681   3.230
  710   1HZ   LYS  87          HZ1       LYS  87 -16.746   3.739   1.788
  711   2HZ   LYS  87          HZ2       LYS  87 -15.092   3.962   1.544
  712   3HZ   LYS  87          HZ3       LYS  87 -16.178   5.194   1.123
  713    H    GLU  88           HN       GLU  88 -13.838  -0.026   8.258
  714    HA   GLU  88           HA       GLU  88 -11.895  -1.768   7.334
  715   1HB   GLU  88          HB1       GLU  88 -13.205  -1.905   9.459
  716   2HB   GLU  88          HB2       GLU  88 -14.546  -2.561   8.523
  717   1HG   GLU  88          HG1       GLU  88 -13.659  -4.585   8.917
  718   2HG   GLU  88          HG2       GLU  88 -12.390  -4.142   7.767
  719    H    LYS  89           HN       LYS  89 -15.345  -1.785   6.323
  720    HA   LYS  89           HA       LYS  89 -15.210  -4.038   4.688
  721   1HB   LYS  89          HB1       LYS  89 -17.067  -1.769   4.065
  722   2HB   LYS  89          HB2       LYS  89 -17.367  -3.504   4.023
  723   1HG   LYS  89          HG1       LYS  89 -16.733  -2.153   6.618
  724   2HG   LYS  89          HG2       LYS  89 -18.362  -2.082   5.961
  725   1HD   LYS  89          HD1       LYS  89 -18.471  -3.927   7.380
  726   2HD   LYS  89          HD2       LYS  89 -18.122  -4.687   5.818
  727   1HE   LYS  89          HE1       LYS  89 -15.712  -4.673   6.365
  728   2HE   LYS  89          HE2       LYS  89 -16.079  -3.962   7.936
  729   1HZ   LYS  89          HZ1       LYS  89 -17.134  -6.582   7.037
  730   2HZ   LYS  89          HZ2       LYS  89 -17.216  -5.924   8.589
  731   3HZ   LYS  89          HZ3       LYS  89 -15.724  -6.403   7.960
  732    H    ASP  90           HN       ASP  90 -14.700  -0.695   3.948
  733    HA   ASP  90           HA       ASP  90 -14.259  -0.659   1.249
  734   1HB   ASP  90          HB1       ASP  90 -13.866   0.992   3.585
  735   2HB   ASP  90          HB2       ASP  90 -12.547   1.216   2.451
  736    H    ARG  91           HN       ARG  91 -11.779  -1.236   3.839
  737    HA   ARG  91           HA       ARG  91  -9.687  -1.706   1.942
  738   1HB   ARG  91          HB1       ARG  91  -9.591  -2.713   4.785
  739   2HB   ARG  91          HB2       ARG  91  -8.244  -2.327   3.721
  740   1HG   ARG  91          HG1       ARG  91  -8.802   0.035   3.827
  741   2HG   ARG  91          HG2       ARG  91 -10.209  -0.318   4.817
  742   1HD   ARG  91          HD1       ARG  91  -7.341  -0.817   5.631
  743   2HD   ARG  91          HD2       ARG  91  -8.282   0.593   6.089
  744    HE   ARG  91           HE       ARG  91  -8.418  -1.873   6.438
  745   1HH1  ARG  91          HH21      ARG  91  -9.372   1.224   7.690
  746   2HH1  ARG  91          HH22      ARG  91 -10.225   0.805   9.136
  747   1HH2  ARG  91          HH11      ARG  91  -9.776  -2.583   8.795
  748   2HH2  ARG  91          HH12      ARG  91 -10.487  -1.320   9.736
  749    H    ASN  92           HN       ASN  92 -11.956  -3.861   3.586
  750    HA   ASN  92           HA       ASN  92 -10.885  -6.321   3.229
  751   1HB   ASN  92          HB1       ASN  92 -13.740  -5.414   2.900
  752   2HB   ASN  92          HB2       ASN  92 -13.285  -7.110   2.851
  753   1HD2  ASN  92          HD21      ASN  92 -14.947  -6.902   4.668
  754   2HD2  ASN  92          HD22      ASN  92 -14.143  -6.873   6.200
  755    H    ASP  93           HN       ASP  93 -12.907  -4.797   0.670
  756    HA   ASP  93           HA       ASP  93 -12.245  -6.646  -1.351
  757   1HB   ASP  93          HB1       ASP  93 -13.997  -4.504  -1.106
  758   2HB   ASP  93          HB2       ASP  93 -12.888  -3.993  -2.369
  759    H    LEU  94           HN       LEU  94 -10.669  -3.524  -0.482
  760    HA   LEU  94           HA       LEU  94  -8.942  -3.239  -2.591
  761   1HB   LEU  94          HB1       LEU  94  -9.217  -2.235   0.144
  762   2HB   LEU  94          HB2       LEU  94  -7.590  -2.274  -0.425
  763    HG   LEU  94           HG       LEU  94  -9.752  -0.992  -2.064
  764   1HD1  LEU  94          HD11      LEU  94  -9.642  -0.065   0.279
  765   2HD1  LEU  94          HD12      LEU  94  -9.341   1.103  -1.011
  766   3HD1  LEU  94          HD13      LEU  94  -7.992   0.448  -0.084
  767   1HD2  LEU  94          HD21      LEU  94  -6.834  -0.235  -1.914
  768   2HD2  LEU  94          HD22      LEU  94  -8.035   0.298  -3.089
  769   3HD2  LEU  94          HD23      LEU  94  -7.469  -1.372  -3.104
  770    H    ILE  95           HN       ILE  95  -8.501  -5.227   0.320
  771    HA   ILE  95           HA       ILE  95  -5.829  -5.999  -0.102
  772    HB   ILE  95           HB       ILE  95  -8.037  -7.437   1.387
  773   1HG1  ILE  95          HG11      ILE  95  -5.848  -5.669   2.514
  774   2HG1  ILE  95          HG12      ILE  95  -7.441  -5.051   2.087
  775   1HG2  ILE  95          HG21      ILE  95  -6.115  -8.929   0.886
  776   2HG2  ILE  95          HG22      ILE  95  -6.287  -8.605   2.610
  777   3HG2  ILE  95          HG23      ILE  95  -5.042  -7.774   1.679
  778   1HD1  ILE  95          HD11      ILE  95  -8.483  -6.522   3.721
  779   2HD1  ILE  95          HD12      ILE  95  -7.235  -5.544   4.494
  780   3HD1  ILE  95          HD13      ILE  95  -6.917  -7.235   4.109
  781    H    THR  96           HN       THR  96  -8.872  -7.696  -0.965
  782    HA   THR  96           HA       THR  96  -7.813  -9.893  -2.279
  783    HB   THR  96           HB       THR  96 -10.294  -8.577  -3.342
  784    HG1  THR  96           HG1      THR  96 -10.714  -8.504  -1.184
  785   1HG2  THR  96          HG21      THR  96  -9.573 -11.454  -2.737
  786   2HG2  THR  96          HG22      THR  96  -9.543 -10.709  -4.336
  787   3HG2  THR  96          HG23      THR  96 -11.073 -10.893  -3.477
  788    H    TYR  97           HN       TYR  97  -8.516  -6.671  -3.706
  789    HA   TYR  97           HA       TYR  97  -7.755  -7.301  -6.328
  790   1HB   TYR  97          HB1       TYR  97  -8.983  -5.280  -5.837
  791   2HB   TYR  97          HB2       TYR  97  -7.637  -4.650  -4.897
  792    HD1  TYR  97           HD1      TYR  97  -6.463  -2.953  -5.903
  793    HD2  TYR  97           HD2      TYR  97  -8.095  -6.088  -8.351
  794    HE1  TYR  97           HE1      TYR  97  -5.511  -1.863  -7.924
  795    HE2  TYR  97           HE2      TYR  97  -7.252  -4.944 -10.393
  796    HH   TYR  97           HH       TYR  97  -4.983  -2.975 -10.602
  797    H    LEU  98           HN       LEU  98  -5.725  -5.684  -3.834
  798    HA   LEU  98           HA       LEU  98  -3.336  -5.665  -5.302
  799   1HB   LEU  98          HB1       LEU  98  -4.222  -4.906  -2.728
  800   2HB   LEU  98          HB2       LEU  98  -2.840  -5.970  -2.481
  801    HG   LEU  98           HG       LEU  98  -2.048  -3.666  -2.658
  802   1HD1  LEU  98          HD11      LEU  98  -1.457  -5.327  -5.116
  803   2HD1  LEU  98          HD12      LEU  98  -0.555  -5.320  -3.600
  804   3HD1  LEU  98          HD13      LEU  98  -0.543  -3.895  -4.641
  805   1HD2  LEU  98          HD21      LEU  98  -2.377  -2.361  -4.693
  806   2HD2  LEU  98          HD22      LEU  98  -3.936  -2.774  -3.979
  807   3HD2  LEU  98          HD23      LEU  98  -3.350  -3.659  -5.387
  808    H    LYS  99           HN       LYS  99  -4.553  -7.967  -2.937
  809    HA   LYS  99           HA       LYS  99  -2.472  -9.803  -2.895
  810   1HB   LYS  99          HB1       LYS  99  -3.826 -10.476  -1.251
  811   2HB   LYS  99          HB2       LYS  99  -5.213  -9.671  -1.960
  812   1HG   LYS  99          HG1       LYS  99  -5.607 -11.620  -3.401
  813   2HG   LYS  99          HG2       LYS  99  -4.218 -12.426  -2.699
  814   1HD   LYS  99          HD1       LYS  99  -6.267 -11.583  -0.753
  815   2HD   LYS  99          HD2       LYS  99  -6.800 -12.800  -1.916
  816   1HE   LYS  99          HE1       LYS  99  -5.676 -13.528   0.325
  817   2HE   LYS  99          HE2       LYS  99  -5.302 -14.372  -1.170
  818   1HZ   LYS  99          HZ1       LYS  99  -3.197 -13.670  -1.122
  819   2HZ   LYS  99          HZ2       LYS  99  -3.485 -13.441   0.533
  820   3HZ   LYS  99          HZ3       LYS  99  -3.604 -12.129  -0.528
  821    H    LYS 100           HN       LYS 100  -5.183  -9.548  -5.192
  822    HA   LYS 100           HA       LYS 100  -4.583 -11.944  -6.592
  823   1HB   LYS 100          HB1       LYS 100  -6.737 -10.277  -6.456
  824   2HB   LYS 100          HB2       LYS 100  -6.164 -10.020  -8.087
  825   1HG   LYS 100          HG1       LYS 100  -7.993 -11.839  -7.565
  826   2HG   LYS 100          HG2       LYS 100  -6.744 -12.153  -8.774
  827   1HD   LYS 100          HD1       LYS 100  -6.082 -12.859  -6.006
  828   2HD   LYS 100          HD2       LYS 100  -7.382 -13.780  -6.693
  829   1HE   LYS 100          HE1       LYS 100  -5.700 -15.215  -7.091
  830   2HE   LYS 100          HE2       LYS 100  -5.467 -14.221  -8.539
  831   1HZ   LYS 100          HZ1       LYS 100  -3.404 -14.590  -7.152
  832   2HZ   LYS 100          HZ2       LYS 100  -4.127 -13.658  -5.940
  833   3HZ   LYS 100          HZ3       LYS 100  -3.783 -12.963  -7.447
  834    H    ALA 101           HN       ALA 101  -3.515  -8.785  -6.999
  835    HA   ALA 101           HA       ALA 101  -2.328  -8.955  -9.586
  836   1HB   ALA 101          HB1       ALA 101  -3.375  -6.914  -8.649
  837   2HB   ALA 101          HB2       ALA 101  -1.714  -6.659  -9.181
  838   3HB   ALA 101          HB3       ALA 101  -2.074  -6.826  -7.462
  839    H    THR 102           HN       THR 102  -1.140  -9.205  -6.265
  840    HA   THR 102           HA       THR 102   1.654  -9.371  -6.962
  841    HB   THR 102           HB       THR 102   0.444 -10.006  -4.275
  842    HG1  THR 102           HG1      THR 102  -0.163  -7.878  -5.058
  843   1HG2  THR 102          HG21      THR 102   2.842 -10.558  -4.598
  844   2HG2  THR 102          HG22      THR 102   2.591  -9.284  -3.404
  845   3HG2  THR 102          HG23      THR 102   3.145  -8.873  -5.027
  846    H    GLU 103           HN       GLU 103  -0.906 -11.656  -5.987
  847    HA   GLU 103           HA       GLU 103   0.879 -13.858  -6.810
  848   1HB   GLU 103          HB1       GLU 103  -0.702 -15.184  -5.101
  849   2HB   GLU 103          HB2       GLU 103   0.805 -14.431  -4.607
  850   1HG   GLU 103          HG1       GLU 103  -0.346 -13.366  -3.051
  851   2HG   GLU 103          HG2       GLU 103  -1.079 -12.418  -4.340
  852    HHA  HEC 104           HA       HEC 104   4.922   3.400   1.483
  853    HHB  HEC 104           HB       HEC 104  -0.766   0.538   0.196
  854    HHC  HEC 104           HC       HEC 104  -3.229   6.294  -1.483
  855    HHD  HEC 104           HD       HEC 104   2.729   8.788  -1.377
  856   1HMA  HEC 104          HMA1      HEC 104   0.989  -0.861   2.054
  857   2HMA  HEC 104          HMA2      HEC 104   2.515  -1.252   1.260
  858   3HMA  HEC 104          HMA3      HEC 104   1.042  -1.082   0.304
  859   1HAA  HEC 104          HAA1      HEC 104   4.046  -0.249   2.185
  860   2HAA  HEC 104          HAA2      HEC 104   4.734   1.321   2.556
  861   1HBA  HEC 104          HBA1      HEC 104   5.635   1.441   0.245
  862   2HBA  HEC 104          HBA2      HEC 104   5.004  -0.170  -0.059
  863   1HMB  HEC 104          HMB1      HEC 104  -2.638   0.234  -0.454
  864   2HMB  HEC 104          HMB2      HEC 104  -3.533   0.825  -1.854
  865   3HMB  HEC 104          HMB3      HEC 104  -4.219   0.985  -0.238
  866    HAB  HEC 104           HAB      HEC 104  -4.644   4.976  -1.538
  867   1HBB  HEC 104          HBB1      HEC 104  -5.020   3.782   0.757
  868   2HBB  HEC 104          HBB2      HEC 104  -6.011   2.709  -0.231
  869   3HBB  HEC 104          HBB3      HEC 104  -6.351   4.440  -0.194
  870   1HMC  HEC 104          HMC1      HEC 104  -3.260   8.860  -1.672
  871   2HMC  HEC 104          HMC2      HEC 104  -2.904   8.114  -3.230
  872   3HMC  HEC 104          HMC3      HEC 104  -2.288   9.725  -2.862
  873    HAC  HEC 104           HAC      HEC 104   1.559   9.835  -2.682
  874   1HBC  HEC 104          HBC1      HEC 104   0.752  11.248  -1.037
  875   2HBC  HEC 104          HBC2      HEC 104  -0.899  11.185  -1.652
  876   3HBC  HEC 104          HBC3      HEC 104   0.352  12.026  -2.568
  877   1HMD  HEC 104          HMD1      HEC 104   4.852   9.180  -0.438
  878   2HMD  HEC 104          HMD2      HEC 104   5.315   8.175  -1.811
  879   3HMD  HEC 104          HMD3      HEC 104   6.315   8.198  -0.358
  880   1HAD  HEC 104          HAD1      HEC 104   7.092   6.327   0.453
  881   2HAD  HEC 104          HAD2      HEC 104   6.616   4.796   1.178
  882   1HBD  HEC 104          HBD1      HEC 104   6.076   5.770   3.210
  883   2HBD  HEC 104          HBD2      HEC 104   5.779   7.342   2.498
  884    H2   4NL 105           H2       4NL 105  -0.435 -12.945  -1.209
  885    H6   4NL 105           H6       4NL 105   1.683 -14.212   3.321
  886    H3   4NL 105           H3       4NL 105  -1.389 -10.245   2.056
  887    H5   4NL 105           H5       4NL 105  -2.475 -10.244   0.088
  888    H4   4NL 105           H4       4NL 105   0.345 -11.360   3.486
  889    H1   4NL 105           H1       4NL 105   1.298 -14.060   0.220
  890    H7   4NL 105           H7       4NL 105   2.886 -13.028   2.757
  Start of MODEL   13
    1   1H    THR  -5          HT1       THR  -5 -10.541  -5.646  12.935
    2   2H    THR  -5          HT2       THR  -5 -12.004  -6.446  13.224
    3   3H    THR  -5          HT3       THR  -5 -11.856  -5.423  11.885
    4    HA   THR  -5           HA       THR  -5 -10.387  -6.871  10.787
    5    HB   THR  -5           HB       THR  -5 -10.489  -8.930  12.954
    6    HG1  THR  -5           HG1      THR  -5  -8.285  -7.719  13.422
    7   1HG2  THR  -5          HG21      THR  -5  -8.207  -9.367  12.110
    8   2HG2  THR  -5          HG22      THR  -5  -8.372  -8.006  11.000
    9   3HG2  THR  -5          HG23      THR  -5  -9.408  -9.423  10.818
   10    H    GLU  -4           HN       GLU  -4 -12.965  -6.435  10.428
   11    HA   GLU  -4           HA       GLU  -4 -14.408  -8.985  10.612
   12   1HB   GLU  -4          HB1       GLU  -4 -15.551  -6.902  11.466
   13   2HB   GLU  -4          HB2       GLU  -4 -15.482  -6.245   9.836
   14   1HG   GLU  -4          HG1       GLU  -4 -16.665  -8.879   9.820
   15   2HG   GLU  -4          HG2       GLU  -4 -17.508  -7.827  10.950
   16    H    PHE  -3           HN       PHE  -3 -12.333  -9.091   8.957
   17    HA   PHE  -3           HA       PHE  -3 -12.597  -8.176   6.351
   18   1HB   PHE  -3          HB1       PHE  -3 -10.475  -8.994   7.135
   19   2HB   PHE  -3          HB2       PHE  -3 -11.125 -10.615   7.346
   20    HD1  PHE  -3           HD1      PHE  -3 -10.160  -8.060   4.814
   21    HD2  PHE  -3           HD2      PHE  -3 -11.224 -12.165   5.529
   22    HE1  PHE  -3           HE1      PHE  -3  -9.576  -8.620   2.462
   23    HE2  PHE  -3           HE2      PHE  -3 -10.688 -12.716   3.164
   24    HZ   PHE  -3           HZ       PHE  -3  -9.892 -10.936   1.618
   25    H    LYS  -2           HN       LYS  -2 -13.240  -9.060   4.463
   26    HA   LYS  -2           HA       LYS  -2 -14.756 -11.484   4.223
   27   1HB   LYS  -2          HB1       LYS  -2 -16.155  -9.192   4.987
   28   2HB   LYS  -2          HB2       LYS  -2 -16.395  -9.271   3.243
   29   1HG   LYS  -2          HG1       LYS  -2 -17.641 -11.164   3.354
   30   2HG   LYS  -2          HG2       LYS  -2 -16.711 -11.825   4.697
   31   1HD   LYS  -2          HD1       LYS  -2 -18.404  -9.455   5.281
   32   2HD   LYS  -2          HD2       LYS  -2 -19.248 -10.965   4.944
   33   1HE   LYS  -2          HE1       LYS  -2 -18.962 -10.859   7.302
   34   2HE   LYS  -2          HE2       LYS  -2 -17.804 -12.045   6.710
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.191  -9.229   7.449
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.071 -10.349   6.860
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.807 -10.612   8.355
   38    H    ALA  -1           HN       ALA  -1 -14.167 -12.271   2.363
   39    HA   ALA  -1           HA       ALA  -1 -12.354 -11.258   0.612
   40   1HB   ALA  -1          HB1       ALA  -1 -12.989 -13.613   0.777
   41   2HB   ALA  -1          HB2       ALA  -1 -13.029 -13.058  -0.898
   42   3HB   ALA  -1          HB3       ALA  -1 -14.534 -13.257   0.001
   43    H    GLY   1           HN       GLY   1 -12.346 -10.201  -1.330
   44   1HA   GLY   1          HA1       GLY   1 -14.738  -8.648  -2.059
   45   2HA   GLY   1          HA2       GLY   1 -13.075  -8.158  -2.345
   46    H    SER   2           HN       SER   2 -13.136  -7.887  -4.484
   47    HA   SER   2           HA       SER   2 -13.108 -10.190  -6.221
   48   1HB   SER   2          HB1       SER   2 -15.013  -8.004  -7.013
   49   2HB   SER   2          HB2       SER   2 -14.910  -9.663  -7.616
   50    HG   SER   2           HG       SER   2 -15.413 -10.137  -5.229
   51    H    ALA   3           HN       ALA   3 -11.588  -9.876  -7.751
   52    HA   ALA   3           HA       ALA   3  -9.814  -7.839  -7.821
   53   1HB   ALA   3          HB1       ALA   3 -10.660  -9.561 -10.146
   54   2HB   ALA   3          HB2       ALA   3  -9.462  -9.963  -8.915
   55   3HB   ALA   3          HB3       ALA   3  -9.156  -8.644 -10.043
   56    H    LYS   4           HN       LYS   4 -12.812  -7.843  -9.831
   57    HA   LYS   4           HA       LYS   4 -12.113  -5.331 -11.018
   58   1HB   LYS   4          HB1       LYS   4 -13.322  -7.204 -12.191
   59   2HB   LYS   4          HB2       LYS   4 -14.769  -6.674 -11.334
   60   1HG   LYS   4          HG1       LYS   4 -13.544  -4.365 -12.446
   61   2HG   LYS   4          HG2       LYS   4 -13.606  -5.589 -13.708
   62   1HD   LYS   4          HD1       LYS   4 -15.887  -5.535 -13.830
   63   2HD   LYS   4          HD2       LYS   4 -16.076  -5.178 -12.109
   64   1HE   LYS   4          HE1       LYS   4 -14.906  -3.137 -13.986
   65   2HE   LYS   4          HE2       LYS   4 -16.654  -3.319 -13.831
   66   1HZ   LYS   4          HZ1       LYS   4 -15.542  -1.622 -12.354
   67   2HZ   LYS   4          HZ2       LYS   4 -14.904  -2.923 -11.485
   68   3HZ   LYS   4          HZ3       LYS   4 -16.579  -2.723 -11.590
   69    H    LYS   5           HN       LYS   5 -13.113  -5.755  -8.002
   70    HA   LYS   5           HA       LYS   5 -14.818  -3.348  -7.968
   71   1HB   LYS   5          HB1       LYS   5 -15.355  -5.735  -6.749
   72   2HB   LYS   5          HB2       LYS   5 -14.565  -4.855  -5.447
   73   1HG   LYS   5          HG1       LYS   5 -16.188  -3.077  -5.571
   74   2HG   LYS   5          HG2       LYS   5 -16.913  -3.783  -7.018
   75   1HD   LYS   5          HD1       LYS   5 -17.042  -4.753  -4.173
   76   2HD   LYS   5          HD2       LYS   5 -18.365  -4.451  -5.299
   77   1HE   LYS   5          HE1       LYS   5 -18.371  -6.625  -5.812
   78   2HE   LYS   5          HE2       LYS   5 -16.751  -6.441  -6.484
   79   1HZ   LYS   5          HZ1       LYS   5 -17.533  -7.344  -3.789
   80   2HZ   LYS   5          HZ2       LYS   5 -15.993  -6.688  -4.068
   81   3HZ   LYS   5          HZ3       LYS   5 -16.485  -8.076  -4.904
   82    H    GLY   6           HN       GLY   6 -12.342  -4.911  -5.888
   83   1HA   GLY   6          HA1       GLY   6 -11.533  -2.649  -4.486
   84   2HA   GLY   6          HA2       GLY   6 -10.501  -4.028  -4.826
   85    H    ALA   7           HN       ALA   7 -10.614  -3.642  -7.753
   86    HA   ALA   7           HA       ALA   7  -8.414  -1.992  -8.163
   87   1HB   ALA   7          HB1       ALA   7 -10.460  -2.959 -10.159
   88   2HB   ALA   7          HB2       ALA   7  -8.960  -3.768  -9.704
   89   3HB   ALA   7          HB3       ALA   7  -8.905  -2.235 -10.571
   90    H    THR   8           HN       THR   8 -11.890  -1.192  -8.894
   91    HA   THR   8           HA       THR   8 -11.376   1.371  -9.883
   92    HB   THR   8           HB       THR   8 -13.809   1.746  -8.715
   93    HG1  THR   8           HG1      THR   8 -13.649  -0.510  -7.995
   94   1HG2  THR   8          HG21      THR   8 -14.749   1.045 -10.900
   95   2HG2  THR   8          HG22      THR   8 -13.172   0.379 -11.331
   96   3HG2  THR   8          HG23      THR   8 -13.354   2.114 -11.062
   97    H    LEU   9           HN       LEU   9 -11.750   0.387  -6.513
   98    HA   LEU   9           HA       LEU   9 -11.862   2.948  -5.343
   99   1HB   LEU   9          HB1       LEU   9 -10.784   0.420  -4.064
  100   2HB   LEU   9          HB2       LEU   9 -11.454   1.828  -3.244
  101    HG   LEU   9           HG       LEU   9 -13.044   0.052  -5.111
  102   1HD1  LEU   9          HD11      LEU   9 -13.085   0.161  -2.091
  103   2HD1  LEU   9          HD12      LEU   9 -12.328  -1.119  -3.038
  104   3HD1  LEU   9          HD13      LEU   9 -14.072  -0.873  -3.124
  105   1HD2  LEU   9          HD21      LEU   9 -14.022   2.090  -3.102
  106   2HD2  LEU   9          HD22      LEU   9 -14.983   1.195  -4.279
  107   3HD2  LEU   9          HD23      LEU   9 -13.843   2.426  -4.826
  108    H    PHE  10           HN       PHE  10  -9.128   0.653  -5.515
  109    HA   PHE  10           HA       PHE  10  -7.084   2.323  -4.646
  110   1HB   PHE  10          HB1       PHE  10  -7.009  -0.160  -4.911
  111   2HB   PHE  10          HB2       PHE  10  -6.868   0.068  -6.647
  112    HD1  PHE  10           HD1      PHE  10  -4.828   1.555  -7.449
  113    HD2  PHE  10           HD2      PHE  10  -5.104  -0.408  -3.632
  114    HE1  PHE  10           HE1      PHE  10  -2.346   1.625  -7.228
  115    HE2  PHE  10           HE2      PHE  10  -2.642  -0.221  -3.357
  116    HZ   PHE  10           HZ       PHE  10  -1.255   0.771  -5.161
  117    H    LYS  11           HN       LYS  11  -8.435   1.949  -7.889
  118    HA   LYS  11           HA       LYS  11  -6.405   3.481  -9.206
  119   1HB   LYS  11          HB1       LYS  11  -8.269   1.633 -10.019
  120   2HB   LYS  11          HB2       LYS  11  -8.888   3.137 -10.704
  121   1HG   LYS  11          HG1       LYS  11  -7.154   3.366 -12.143
  122   2HG   LYS  11          HG2       LYS  11  -5.982   2.714 -11.002
  123   1HD   LYS  11          HD1       LYS  11  -7.921   1.137 -12.705
  124   2HD   LYS  11          HD2       LYS  11  -6.172   1.234 -12.916
  125   1HE   LYS  11          HE1       LYS  11  -5.887   0.174 -10.681
  126   2HE   LYS  11          HE2       LYS  11  -7.636   0.003 -10.567
  127   1HZ   LYS  11          HZ1       LYS  11  -7.642  -1.522 -12.364
  128   2HZ   LYS  11          HZ2       LYS  11  -6.412  -2.023 -11.317
  129   3HZ   LYS  11          HZ3       LYS  11  -6.020  -1.205 -12.743
  130    H    THR  12           HN       THR  12  -8.699   4.630  -7.206
  131    HA   THR  12           HA       THR  12  -8.654   7.289  -8.378
  132    HB   THR  12           HB       THR  12 -10.905   5.690  -8.518
  133    HG1  THR  12           HG1      THR  12 -10.152   7.528  -9.791
  134   1HG2  THR  12          HG21      THR  12 -11.489   6.281  -6.176
  135   2HG2  THR  12          HG22      THR  12 -12.665   6.835  -7.368
  136   3HG2  THR  12          HG23      THR  12 -11.525   7.977  -6.656
  137    H    ARG  13           HN       ARG  13  -7.827   5.500  -5.909
  138    HA   ARG  13           HA       ARG  13  -8.032   7.598  -3.848
  139   1HB   ARG  13          HB1       ARG  13  -8.233   4.606  -3.537
  140   2HB   ARG  13          HB2       ARG  13  -7.923   5.677  -2.187
  141   1HG   ARG  13          HG1       ARG  13 -10.381   5.788  -3.922
  142   2HG   ARG  13          HG2       ARG  13 -10.275   4.920  -2.397
  143   1HD   ARG  13          HD1       ARG  13 -11.353   6.997  -1.951
  144   2HD   ARG  13          HD2       ARG  13  -9.711   7.131  -1.307
  145    HE   ARG  13           HE       ARG  13 -10.461   7.834  -3.912
  146   1HH1  ARG  13          HH11      ARG  13  -9.397   8.914  -0.764
  147   2HH1  ARG  13          HH12      ARG  13  -8.583  10.365  -1.222
  148   1HH2  ARG  13          HH21      ARG  13  -9.145  10.026  -4.579
  149   2HH2  ARG  13          HH22      ARG  13  -8.415  10.957  -3.318
  150    H    CYS  14           HN       CYS  14  -6.091   4.998  -5.202
  151    HA   CYS  14           HA       CYS  14  -3.730   5.927  -3.699
  152   1HB   CYS  14          HB1       CYS  14  -3.956   3.216  -4.944
  153   2HB   CYS  14          HB2       CYS  14  -2.921   3.738  -3.633
  154    H    LEU  15           HN       LEU  15  -4.980   5.071  -6.887
  155    HA   LEU  15           HA       LEU  15  -2.763   4.908  -8.452
  156   1HB   LEU  15          HB1       LEU  15  -5.200   4.690  -9.103
  157   2HB   LEU  15          HB2       LEU  15  -5.233   6.442  -9.252
  158    HG   LEU  15           HG       LEU  15  -3.338   6.256 -10.918
  159   1HD1  LEU  15          HD11      LEU  15  -4.082   3.334 -10.957
  160   2HD1  LEU  15          HD12      LEU  15  -2.603   3.977 -10.243
  161   3HD1  LEU  15          HD13      LEU  15  -2.891   4.143 -11.976
  162   1HD2  LEU  15          HD21      LEU  15  -4.973   4.981 -12.634
  163   2HD2  LEU  15          HD22      LEU  15  -5.222   6.649 -12.117
  164   3HD2  LEU  15          HD23      LEU  15  -6.116   5.341 -11.341
  165    H    GLN  16           HN       GLN  16  -4.188   7.928  -7.266
  166    HA   GLN  16           HA       GLN  16  -3.044   9.887  -8.692
  167   1HB   GLN  16          HB1       GLN  16  -2.945  11.139  -6.398
  168   2HB   GLN  16          HB2       GLN  16  -4.483  10.647  -7.089
  169   1HG   GLN  16          HG1       GLN  16  -4.246   8.532  -5.637
  170   2HG   GLN  16          HG2       GLN  16  -2.994   9.431  -4.776
  171   1HE2  GLN  16          HE21      GLN  16  -3.638  11.326  -3.584
  172   2HE2  GLN  16          HE22      GLN  16  -5.291  11.591  -3.173
  173    H    CYS  17           HN       CYS  17  -1.243   7.996  -6.285
  174    HA   CYS  17           HA       CYS  17   1.215   9.421  -7.045
  175   1HB   CYS  17          HB1       CYS  17   1.108   8.118  -4.389
  176   2HB   CYS  17          HB2       CYS  17   1.896   9.596  -4.915
  177    H    HIS  18           HN       HIS  18  -0.148   6.261  -6.228
  178    HA   HIS  18           HA       HIS  18   2.414   4.897  -6.485
  179   1HB   HIS  18          HB1       HIS  18  -0.307   4.144  -5.488
  180   2HB   HIS  18          HB2       HIS  18   0.882   2.907  -5.841
  181    HD1  HIS  18           HD1      HIS  18   3.312   3.378  -4.398
  182    HD2  HIS  18           HD2      HIS  18  -0.318   4.955  -3.033
  183    HE1  HIS  18           HE1      HIS  18   3.614   3.790  -1.914
  184    H    THR  19           HN       THR  19   2.023   2.580  -7.356
  185    HA   THR  19           HA       THR  19   0.588   2.472  -9.894
  186    HB   THR  19           HB       THR  19   2.823   1.195 -10.621
  187    HG1  THR  19           HG1      THR  19   4.160   3.312  -9.601
  188   1HG2  THR  19          HG21      THR  19   2.472   4.190 -10.767
  189   2HG2  THR  19          HG22      THR  19   1.791   3.014 -11.891
  190   3HG2  THR  19          HG23      THR  19   3.538   3.224 -11.787
  191    H    VAL  20           HN       VAL  20  -0.666   0.676  -9.885
  192    HA   VAL  20           HA       VAL  20  -0.425  -1.344  -7.873
  193    HB   VAL  20           HB       VAL  20  -2.470  -0.259  -9.176
  194   1HG1  VAL  20          HG11      VAL  20  -2.147  -1.336 -11.287
  195   2HG1  VAL  20          HG12      VAL  20  -3.621  -1.949 -10.535
  196   3HG1  VAL  20          HG13      VAL  20  -2.153  -2.928 -10.524
  197   1HG2  VAL  20          HG21      VAL  20  -2.767  -1.355  -7.091
  198   2HG2  VAL  20          HG22      VAL  20  -2.467  -2.938  -7.808
  199   3HG2  VAL  20          HG23      VAL  20  -3.923  -2.041  -8.233
  200    H    GLU  21           HN       GLU  21   0.475  -1.224 -11.206
  201    HA   GLU  21           HA       GLU  21   1.288  -4.054 -11.225
  202   1HB   GLU  21          HB1       GLU  21   1.418  -3.424 -13.823
  203   2HB   GLU  21          HB2       GLU  21  -0.075  -3.971 -13.087
  204   1HG   GLU  21          HG1       GLU  21  -0.297  -2.005 -14.636
  205   2HG   GLU  21          HG2       GLU  21  -0.966  -1.763 -13.026
  206    H    LYS  22           HN       LYS  22   3.325  -4.160 -13.035
  207    HA   LYS  22           HA       LYS  22   5.212  -2.192 -11.993
  208   1HB   LYS  22          HB1       LYS  22   5.371  -4.994 -12.379
  209   2HB   LYS  22          HB2       LYS  22   6.619  -4.223 -13.370
  210   1HG   LYS  22          HG1       LYS  22   7.685  -3.280 -11.573
  211   2HG   LYS  22          HG2       LYS  22   6.201  -3.155 -10.627
  212   1HD   LYS  22          HD1       LYS  22   6.261  -5.478 -10.091
  213   2HD   LYS  22          HD2       LYS  22   7.581  -5.762 -11.227
  214   1HE   LYS  22          HE1       LYS  22   8.524  -5.739  -9.027
  215   2HE   LYS  22          HE2       LYS  22   9.024  -4.264  -9.834
  216   1HZ   LYS  22          HZ1       LYS  22   7.114  -3.171  -8.564
  217   2HZ   LYS  22          HZ2       LYS  22   8.464  -3.629  -7.661
  218   3HZ   LYS  22          HZ3       LYS  22   7.068  -4.577  -7.624
  219    H    GLY  23           HN       GLY  23   3.458  -1.603 -14.399
  220   1HA   GLY  23          HA1       GLY  23   5.524  -1.248 -16.469
  221   2HA   GLY  23          HA2       GLY  23   3.793  -1.083 -16.711
  222    H    GLY  24           HN       GLY  24   3.648   0.611 -14.201
  223   1HA   GLY  24          HA1       GLY  24   4.101   3.185 -15.434
  224   2HA   GLY  24          HA2       GLY  24   3.260   2.866 -13.926
  225    HA   PRO  25           HA       PRO  25   8.045   3.777 -13.345
  226   1HB   PRO  25          HB1       PRO  25   8.157   6.505 -13.732
  227   2HB   PRO  25          HB2       PRO  25   8.685   5.306 -14.916
  228   1HG   PRO  25          HG1       PRO  25   6.111   6.817 -14.765
  229   2HG   PRO  25          HG2       PRO  25   7.088   6.405 -16.186
  230   1HD   PRO  25          HD1       PRO  25   4.854   5.044 -15.555
  231   2HD   PRO  25          HD2       PRO  25   6.263   4.244 -16.282
  232    H    HIS  26           HN       HIS  26   8.734   4.657 -11.354
  233    HA   HIS  26           HA       HIS  26   6.856   4.920  -9.319
  234   1HB   HIS  26          HB1       HIS  26   9.733   5.843  -9.497
  235   2HB   HIS  26          HB2       HIS  26   8.808   5.823  -8.006
  236    HD2  HIS  26           HD2      HIS  26  10.880   3.606 -10.279
  237    HE1  HIS  26           HE1      HIS  26   9.515   1.096  -7.138
  238    HE2  HIS  26           HE2      HIS  26  11.110   1.285  -9.104
  239    H    LYS  27           HN       LYS  27   5.651   6.640  -8.614
  240    HA   LYS  27           HA       LYS  27   6.197   9.300  -9.739
  241   1HB   LYS  27          HB1       LYS  27   4.186   8.095 -10.624
  242   2HB   LYS  27          HB2       LYS  27   3.481   8.190  -9.015
  243   1HG   LYS  27          HG1       LYS  27   3.630  10.670  -9.132
  244   2HG   LYS  27          HG2       LYS  27   4.225  10.523 -10.789
  245   1HD   LYS  27          HD1       LYS  27   1.578  10.772 -10.089
  246   2HD   LYS  27          HD2       LYS  27   2.158  10.093 -11.615
  247   1HE   LYS  27          HE1       LYS  27   1.972   7.866 -10.809
  248   2HE   LYS  27          HE2       LYS  27   1.784   8.407  -9.141
  249   1HZ   LYS  27          HZ1       LYS  27  -0.341   7.770  -9.922
  250   2HZ   LYS  27          HZ2       LYS  27  -0.174   8.661 -11.348
  251   3HZ   LYS  27          HZ3       LYS  27  -0.340   9.466  -9.871
  252    H    VAL  28           HN       VAL  28   3.873  10.079  -7.739
  253    HA   VAL  28           HA       VAL  28   5.485  11.240  -5.752
  254    HB   VAL  28           HB       VAL  28   2.532  10.690  -5.482
  255   1HG1  VAL  28          HG11      VAL  28   2.564  12.830  -4.224
  256   2HG1  VAL  28          HG12      VAL  28   4.319  12.871  -4.390
  257   3HG1  VAL  28          HG13      VAL  28   3.550  11.577  -3.471
  258   1HG2  VAL  28          HG21      VAL  28   2.839  11.745  -7.660
  259   2HG2  VAL  28          HG22      VAL  28   3.844  13.000  -6.935
  260   3HG2  VAL  28          HG23      VAL  28   2.132  12.897  -6.526
  261    H    GLY  29           HN       GLY  29   4.129   8.105  -6.052
  262   1HA   GLY  29          HA1       GLY  29   5.113   7.291  -3.398
  263   2HA   GLY  29          HA2       GLY  29   3.572   6.717  -4.014
  264    HA   PRO  30           HA       PRO  30   7.393   4.132  -5.511
  265   1HB   PRO  30          HB1       PRO  30   7.431   2.176  -3.629
  266   2HB   PRO  30          HB2       PRO  30   8.386   3.658  -3.506
  267   1HG   PRO  30          HG1       PRO  30   5.756   2.990  -2.233
  268   2HG   PRO  30          HG2       PRO  30   7.185   3.756  -1.510
  269   1HD   PRO  30          HD1       PRO  30   5.052   5.189  -2.314
  270   2HD   PRO  30          HD2       PRO  30   6.709   5.815  -2.445
  271    H    ASN  31           HN       ASN  31   7.310   1.900  -6.321
  272    HA   ASN  31           HA       ASN  31   4.692   1.174  -7.202
  273   1HB   ASN  31          HB1       ASN  31   6.756   1.036  -8.593
  274   2HB   ASN  31          HB2       ASN  31   7.349  -0.255  -7.558
  275   1HD2  ASN  31          HD21      ASN  31   4.806   0.568  -9.885
  276   2HD2  ASN  31          HD22      ASN  31   4.513  -1.076 -10.352
  277    H    LEU  32           HN       LEU  32   3.324  -0.293  -6.317
  278    HA   LEU  32           HA       LEU  32   3.963  -1.614  -3.809
  279   1HB   LEU  32          HB1       LEU  32   1.324  -1.092  -5.184
  280   2HB   LEU  32          HB2       LEU  32   1.511  -1.789  -3.588
  281    HG   LEU  32           HG       LEU  32   2.214   1.039  -4.419
  282   1HD1  LEU  32          HD11      LEU  32   0.160  -0.074  -2.496
  283   2HD1  LEU  32          HD12      LEU  32  -0.168   0.672  -4.060
  284   3HD1  LEU  32          HD13      LEU  32   0.502   1.639  -2.747
  285   1HD2  LEU  32          HD21      LEU  32   2.534  -0.234  -1.694
  286   2HD2  LEU  32          HD22      LEU  32   2.831   1.456  -2.105
  287   3HD2  LEU  32          HD23      LEU  32   3.859   0.191  -2.778
  288    H    HIS  33           HN       HIS  33   3.525  -2.501  -7.086
  289    HA   HIS  33           HA       HIS  33   2.379  -5.040  -7.001
  290   1HB   HIS  33          HB1       HIS  33   2.692  -3.548  -9.000
  291   2HB   HIS  33          HB2       HIS  33   4.399  -3.982  -8.989
  292    HD2  HIS  33           HD2      HIS  33   1.248  -6.282  -8.677
  293    HE1  HIS  33           HE1      HIS  33   3.546  -7.633 -11.986
  294    HE2  HIS  33           HE2      HIS  33   1.518  -8.108 -10.531
  295    H    GLY  34           HN       GLY  34   3.252  -6.357  -5.435
  296   1HA   GLY  34          HA1       GLY  34   4.614  -8.346  -5.280
  297   2HA   GLY  34          HA2       GLY  34   5.956  -7.421  -5.919
  298    H    ILE  35           HN       ILE  35   4.140  -5.740  -3.453
  299    HA   ILE  35           HA       ILE  35   6.406  -5.945  -1.705
  300    HB   ILE  35           HB       ILE  35   5.318  -4.482  -0.164
  301   1HG1  ILE  35          HG11      ILE  35   2.836  -4.994  -1.743
  302   2HG1  ILE  35          HG12      ILE  35   3.037  -4.721  -0.014
  303   1HG2  ILE  35          HG21      ILE  35   5.338  -3.711  -3.058
  304   2HG2  ILE  35          HG22      ILE  35   6.565  -3.439  -1.821
  305   3HG2  ILE  35          HG23      ILE  35   5.052  -2.533  -1.776
  306   1HD1  ILE  35          HD11      ILE  35   1.808  -2.899  -1.198
  307   2HD1  ILE  35          HD12      ILE  35   3.282  -2.550  -2.102
  308   3HD1  ILE  35          HD13      ILE  35   3.255  -2.346  -0.351
  309    H    PHE  36           HN       PHE  36   3.388  -7.680  -1.862
  310    HA   PHE  36           HA       PHE  36   3.132  -8.513   0.779
  311   1HB   PHE  36          HB1       PHE  36   2.210  -9.659  -1.832
  312   2HB   PHE  36          HB2       PHE  36   1.969 -10.561  -0.336
  313    HD1  PHE  36           HD1      PHE  36   1.544  -8.174   1.497
  314    HD2  PHE  36           HD2      PHE  36  -0.078  -9.174  -2.360
  315    HE1  PHE  36           HE1      PHE  36  -0.458  -6.780   1.986
  316    HE2  PHE  36           HE2      PHE  36  -2.081  -7.781  -1.875
  317    HZ   PHE  36           HZ       PHE  36  -2.267  -6.575   0.293
  318    H    GLY  37           HN       GLY  37   4.583  -9.401   1.963
  319   1HA   GLY  37          HA1       GLY  37   5.707 -11.322   2.772
  320   2HA   GLY  37          HA2       GLY  37   6.068 -11.786   1.120
  321    H    ARG  38           HN       ARG  38   6.685  -8.487   1.503
  322    HA   ARG  38           HA       ARG  38   9.559  -8.918   2.023
  323   1HB   ARG  38          HB1       ARG  38   8.106  -7.142   0.065
  324   2HB   ARG  38          HB2       ARG  38   9.718  -6.711   0.618
  325   1HG   ARG  38          HG1       ARG  38  10.722  -8.442  -0.507
  326   2HG   ARG  38          HG2       ARG  38   9.280  -9.458  -0.452
  327   1HD   ARG  38          HD1       ARG  38   9.335  -8.847  -2.692
  328   2HD   ARG  38          HD2       ARG  38   8.264  -7.619  -2.015
  329    HE   ARG  38           HE       ARG  38  10.433  -7.018  -1.567
  330   1HH1  ARG  38          HH21      ARG  38   8.840  -7.582  -4.570
  331   2HH1  ARG  38          HH22      ARG  38   9.381  -6.157  -5.298
  332   1HH2  ARG  38          HH11      ARG  38  11.733  -5.133  -3.260
  333   2HH2  ARG  38          HH12      ARG  38  11.348  -5.498  -4.886
  334    H    HIS  39           HN       HIS  39  10.640  -6.939   2.873
  335    HA   HIS  39           HA       HIS  39   9.153  -5.924   5.136
  336   1HB   HIS  39          HB1       HIS  39  12.016  -5.297   4.366
  337   2HB   HIS  39          HB2       HIS  39  11.279  -5.175   5.966
  338    HD2  HIS  39           HD2      HIS  39  11.005  -7.397   7.404
  339    HE1  HIS  39           HE1      HIS  39  12.829 -10.101   4.672
  340    HE2  HIS  39           HE2      HIS  39  11.848  -9.841   7.000
  341    H    SER  40           HN       SER  40   9.119  -3.586   5.660
  342    HA   SER  40           HA       SER  40   8.183  -1.998   3.564
  343   1HB   SER  40          HB1       SER  40   9.282  -0.567   5.924
  344   2HB   SER  40          HB2       SER  40   7.754  -0.345   5.084
  345    HG   SER  40           HG       SER  40   7.207  -2.467   6.087
  346    H    GLY  41           HN       GLY  41   9.040  -0.428   2.308
  347   1HA   GLY  41          HA1       GLY  41  10.647   1.018   1.452
  348   2HA   GLY  41          HA2       GLY  41  11.772   0.474   2.673
  349    H    GLN  42           HN       GLN  42  10.190  -1.612   0.165
  350    HA   GLN  42           HA       GLN  42  12.892  -2.125  -0.851
  351   1HB   GLN  42          HB1       GLN  42  10.605  -4.034  -0.539
  352   2HB   GLN  42          HB2       GLN  42  12.012  -4.404  -1.530
  353   1HG   GLN  42          HG1       GLN  42  13.437  -3.936   0.502
  354   2HG   GLN  42          HG2       GLN  42  11.949  -3.865   1.439
  355   1HE2  GLN  42          HE21      GLN  42  12.822  -5.696   2.670
  356   2HE2  GLN  42          HE22      GLN  42  12.702  -7.289   2.019
  357    H    ALA  43           HN       ALA  43  10.788  -0.170  -2.072
  358    HA   ALA  43           HA       ALA  43   9.970  -1.123  -4.558
  359   1HB   ALA  43          HB1       ALA  43   9.650   1.188  -5.171
  360   2HB   ALA  43          HB2       ALA  43  10.708   1.711  -3.861
  361   3HB   ALA  43          HB3       ALA  43   9.168   0.935  -3.495
  362    H    GLU  44           HN       GLU  44  10.990  -1.738  -6.329
  363    HA   GLU  44           HA       GLU  44  13.763  -1.583  -6.722
  364   1HB   GLU  44          HB1       GLU  44  11.785  -2.358  -8.875
  365   2HB   GLU  44          HB2       GLU  44  13.439  -2.921  -8.657
  366   1HG   GLU  44          HG1       GLU  44  12.295  -4.731  -7.835
  367   2HG   GLU  44          HG2       GLU  44  12.535  -3.816  -6.359
  368    H    GLY  45           HN       GLY  45  14.291   0.626  -6.605
  369   1HA   GLY  45          HA1       GLY  45  15.401   2.209  -8.046
  370   2HA   GLY  45          HA2       GLY  45  14.044   2.104  -9.145
  371    H    TYR  46           HN       TYR  46  13.453   2.467  -5.709
  372    HA   TYR  46           HA       TYR  46  13.086   5.338  -5.876
  373   1HB   TYR  46          HB1       TYR  46  10.998   4.140  -6.652
  374   2HB   TYR  46          HB2       TYR  46  10.792   3.616  -4.986
  375    HD1  TYR  46           HD1      TYR  46  10.989   6.623  -7.184
  376    HD2  TYR  46           HD2      TYR  46   9.913   5.052  -3.333
  377    HE1  TYR  46           HE1      TYR  46   9.734   8.718  -6.695
  378    HE2  TYR  46           HE2      TYR  46   8.559   7.092  -2.870
  379    HH   TYR  46           HH       TYR  46   7.695   9.303  -5.281
  380    H    SER  47           HN       SER  47  13.170   6.455  -3.961
  381    HA   SER  47           HA       SER  47  14.360   5.087  -1.699
  382   1HB   SER  47          HB1       SER  47  13.940   8.004  -1.536
  383   2HB   SER  47          HB2       SER  47  15.384   7.044  -1.205
  384    HG   SER  47           HG       SER  47  15.514   6.783  -3.556
  385    H    TYR  48           HN       TYR  48  13.778   5.508   0.455
  386    HA   TYR  48           HA       TYR  48  10.998   6.167   1.108
  387   1HB   TYR  48          HB1       TYR  48  12.736   3.851   1.936
  388   2HB   TYR  48          HB2       TYR  48  11.312   4.315   2.864
  389    HD1  TYR  48           HD1      TYR  48   9.077   4.044   1.978
  390    HD2  TYR  48           HD2      TYR  48  12.516   2.873  -0.322
  391    HE1  TYR  48           HE1      TYR  48   7.623   2.632   0.538
  392    HE2  TYR  48           HE2      TYR  48  11.072   1.457  -1.768
  393    HH   TYR  48           HH       TYR  48   8.132   0.375  -0.833
  394    H    THR  49           HN       THR  49  10.766   6.607   3.615
  395    HA   THR  49           HA       THR  49  12.578   8.675   4.443
  396    HB   THR  49           HB       THR  49  11.122   8.401   6.637
  397    HG1  THR  49           HG1      THR  49   9.092   7.699   4.935
  398   1HG2  THR  49          HG21      THR  49  11.168  10.360   5.178
  399   2HG2  THR  49          HG22      THR  49   9.539   9.995   5.747
  400   3HG2  THR  49          HG23      THR  49  10.012   9.576   4.100
  401    H    ASP  50           HN       ASP  50  13.543   8.824   6.589
  402    HA   ASP  50           HA       ASP  50  15.312   6.814   7.274
  403   1HB   ASP  50          HB1       ASP  50  15.589   9.177   7.836
  404   2HB   ASP  50          HB2       ASP  50  14.231   9.088   8.956
  405    H    ALA  51           HN       ALA  51  12.059   7.379   8.509
  406    HA   ALA  51           HA       ALA  51  12.239   5.430  10.615
  407   1HB   ALA  51          HB1       ALA  51  11.022   7.551  10.876
  408   2HB   ALA  51          HB2       ALA  51   9.993   6.148  11.166
  409   3HB   ALA  51          HB3       ALA  51   9.872   7.028   9.643
  410    H    ASN  52           HN       ASN  52  10.829   5.445   7.321
  411    HA   ASN  52           HA       ASN  52   9.271   3.085   7.734
  412   1HB   ASN  52          HB1       ASN  52   8.430   4.445   6.057
  413   2HB   ASN  52          HB2       ASN  52  10.018   4.769   5.373
  414   1HD2  ASN  52          HD21      ASN  52   7.233   2.719   5.205
  415   2HD2  ASN  52          HD22      ASN  52   7.808   1.822   3.847
  416    H    ILE  53           HN       ILE  53  12.522   3.656   6.463
  417    HA   ILE  53           HA       ILE  53  13.053   0.990   5.681
  418    HB   ILE  53           HB       ILE  53  14.896   3.261   6.366
  419   1HG1  ILE  53          HG11      ILE  53  14.119   2.145   3.651
  420   2HG1  ILE  53          HG12      ILE  53  13.341   3.541   4.392
  421   1HG2  ILE  53          HG21      ILE  53  16.102   1.128   6.607
  422   2HG2  ILE  53          HG22      ILE  53  16.677   2.028   5.204
  423   3HG2  ILE  53          HG23      ILE  53  15.593   0.656   4.985
  424   1HD1  ILE  53          HD11      ILE  53  16.296   3.408   3.788
  425   2HD1  ILE  53          HD12      ILE  53  15.363   4.822   4.276
  426   3HD1  ILE  53          HD13      ILE  53  15.097   4.095   2.692
  427    H    LYS  54           HN       LYS  54  14.629   2.642   8.474
  428    HA   LYS  54           HA       LYS  54  15.412   0.603  10.018
  429   1HB   LYS  54          HB1       LYS  54  14.023   3.136  10.874
  430   2HB   LYS  54          HB2       LYS  54  14.841   2.049  11.999
  431   1HG   LYS  54          HG1       LYS  54  16.946   2.338  10.821
  432   2HG   LYS  54          HG2       LYS  54  16.156   3.341   9.602
  433   1HD   LYS  54          HD1       LYS  54  15.526   4.930  11.463
  434   2HD   LYS  54          HD2       LYS  54  16.584   3.985  12.523
  435   1HE   LYS  54          HE1       LYS  54  18.513   4.545  11.292
  436   2HE   LYS  54          HE2       LYS  54  17.571   5.073   9.894
  437   1HZ   LYS  54          HZ1       LYS  54  16.677   6.842  11.487
  438   2HZ   LYS  54          HZ2       LYS  54  18.244   7.029  10.869
  439   3HZ   LYS  54          HZ3       LYS  54  18.022   6.458  12.447
  440    H    LYS  55           HN       LYS  55  12.132   1.051   9.187
  441    HA   LYS  55           HA       LYS  55  10.972  -0.269  11.486
  442   1HB   LYS  55          HB1       LYS  55   9.883   1.617  10.376
  443   2HB   LYS  55          HB2       LYS  55   9.746   0.687   8.902
  444   1HG   LYS  55          HG1       LYS  55   7.616   0.730   9.866
  445   2HG   LYS  55          HG2       LYS  55   8.243  -0.885  10.143
  446   1HD   LYS  55          HD1       LYS  55   8.939   0.523  12.442
  447   2HD   LYS  55          HD2       LYS  55   7.329   1.117  12.039
  448   1HE   LYS  55          HE1       LYS  55   7.073  -0.761  13.511
  449   2HE   LYS  55          HE2       LYS  55   6.568  -1.270  11.899
  450   1HZ   LYS  55          HZ1       LYS  55   9.117  -1.907  13.280
  451   2HZ   LYS  55          HZ2       LYS  55   8.877  -2.176  11.631
  452   3HZ   LYS  55          HZ3       LYS  55   7.915  -2.984  12.761
  453    H    ASN  56           HN       ASN  56  11.739  -1.184   8.197
  454    HA   ASN  56           HA       ASN  56  11.325  -2.979   6.887
  455   1HB   ASN  56          HB1       ASN  56  13.255  -3.514   9.001
  456   2HB   ASN  56          HB2       ASN  56  12.622  -4.980   8.287
  457   1HD2  ASN  56          HD21      ASN  56  14.110  -1.839   7.251
  458   2HD2  ASN  56          HD22      ASN  56  14.657  -2.648   5.846
  459    H    VAL  57           HN       VAL  57   8.888  -2.728   8.037
  460    HA   VAL  57           HA       VAL  57   8.068  -5.064   9.465
  461    HB   VAL  57           HB       VAL  57   6.969  -2.559   8.990
  462   1HG1  VAL  57          HG11      VAL  57   5.014  -4.620   7.974
  463   2HG1  VAL  57          HG12      VAL  57   5.739  -3.340   7.000
  464   3HG1  VAL  57          HG13      VAL  57   4.666  -2.930   8.338
  465   1HG2  VAL  57          HG21      VAL  57   5.387  -3.277  10.671
  466   2HG2  VAL  57          HG22      VAL  57   6.996  -3.905  11.028
  467   3HG2  VAL  57          HG23      VAL  57   5.769  -4.966  10.338
  468    H    LEU  58           HN       LEU  58   7.156  -6.941   8.718
  469    HA   LEU  58           HA       LEU  58   7.490  -7.459   5.893
  470   1HB   LEU  58          HB1       LEU  58   8.235  -9.048   7.722
  471   2HB   LEU  58          HB2       LEU  58   6.535  -9.405   7.996
  472    HG   LEU  58           HG       LEU  58   6.430 -10.000   5.483
  473   1HD1  LEU  58          HD11      LEU  58   9.415  -9.939   5.938
  474   2HD1  LEU  58          HD12      LEU  58   8.491  -9.046   4.730
  475   3HD1  LEU  58          HD13      LEU  58   8.647 -10.797   4.600
  476   1HD2  LEU  58          HD21      LEU  58   8.109 -11.739   7.305
  477   2HD2  LEU  58          HD22      LEU  58   7.326 -12.269   5.817
  478   3HD2  LEU  58          HD23      LEU  58   6.349 -11.756   7.192
  479    H    TRP  59           HN       TRP  59   5.957  -6.536   4.708
  480    HA   TRP  59           HA       TRP  59   3.309  -6.027   5.370
  481   1HB   TRP  59          HB1       TRP  59   4.574  -6.475   2.668
  482   2HB   TRP  59          HB2       TRP  59   2.968  -5.814   2.910
  483    HD1  TRP  59           HD1      TRP  59   6.096  -4.635   1.905
  484    HE1  TRP  59           HE1      TRP  59   6.515  -2.178   2.567
  485    HE3  TRP  59           HE3      TRP  59   2.395  -4.017   5.380
  486    HZ2  TRP  59           HZ2      TRP  59   5.531  -0.256   4.442
  487    HZ3  TRP  59           HZ3      TRP  59   2.143  -1.865   6.556
  488    HH2  TRP  59           HH2      TRP  59   3.680   0.014   6.106
  489    H    ASP  60           HN       ASP  60   1.962  -7.488   6.021
  490    HA   ASP  60           HA       ASP  60   1.508 -10.025   4.634
  491   1HB   ASP  60          HB1       ASP  60   1.957 -10.923   6.636
  492   2HB   ASP  60          HB2       ASP  60   2.003  -9.345   7.397
  493    H    GLU  61           HN       GLU  61  -0.924 -10.711   5.567
  494    HA   GLU  61           HA       GLU  61  -2.701  -9.142   4.001
  495   1HB   GLU  61          HB1       GLU  61  -2.726 -11.736   4.893
  496   2HB   GLU  61          HB2       GLU  61  -3.944 -10.999   5.929
  497   1HG   GLU  61          HG1       GLU  61  -5.299 -11.564   4.191
  498   2HG   GLU  61          HG2       GLU  61  -4.753  -9.999   3.581
  499    H    ASN  62           HN       ASN  62  -2.558  -9.700   7.539
  500    HA   ASN  62           HA       ASN  62  -4.457  -7.632   8.105
  501   1HB   ASN  62          HB1       ASN  62  -4.341  -9.624   9.468
  502   2HB   ASN  62          HB2       ASN  62  -2.663  -9.306   9.872
  503   1HD2  ASN  62          HD21      ASN  62  -2.210  -7.497  11.250
  504   2HD2  ASN  62          HD22      ASN  62  -3.421  -6.923  12.339
  505    H    ASN  63           HN       ASN  63  -0.879  -7.850   8.478
  506    HA   ASN  63           HA       ASN  63  -0.365  -5.451   9.693
  507   1HB   ASN  63          HB1       ASN  63   1.369  -7.012   9.413
  508   2HB   ASN  63          HB2       ASN  63   1.187  -7.042   7.670
  509   1HD2  ASN  63          HD21      ASN  63   2.042  -4.690  10.265
  510   2HD2  ASN  63          HD22      ASN  63   3.060  -3.864   9.137
  511    H    MET  64           HN       MET  64  -0.877  -5.772   6.116
  512    HA   MET  64           HA       MET  64  -0.281  -3.084   5.531
  513   1HB   MET  64          HB1       MET  64  -0.376  -4.790   3.816
  514   2HB   MET  64          HB2       MET  64  -2.099  -5.012   4.087
  515   1HG   MET  64          HG1       MET  64  -2.470  -2.675   3.367
  516   2HG   MET  64          HG2       MET  64  -0.759  -2.539   3.010
  517   1HE   MET  64          HE1       MET  64  -4.191  -4.122   2.043
  518   2HE   MET  64          HE2       MET  64  -3.223  -5.575   2.302
  519   3HE   MET  64          HE3       MET  64  -3.771  -5.160   0.678
  520    H    SER  65           HN       SER  65  -3.380  -4.524   6.546
  521    HA   SER  65           HA       SER  65  -4.934  -2.176   6.221
  522   1HB   SER  65          HB1       SER  65  -5.690  -4.263   8.220
  523   2HB   SER  65          HB2       SER  65  -6.706  -3.357   7.109
  524    HG   SER  65           HG       SER  65  -5.563  -5.767   6.798
  525    H    GLU  66           HN       GLU  66  -3.290  -3.510   9.085
  526    HA   GLU  66           HA       GLU  66  -4.201  -1.688  10.996
  527   1HB   GLU  66          HB1       GLU  66  -2.534  -2.596  12.389
  528   2HB   GLU  66          HB2       GLU  66  -2.886  -3.895  11.254
  529   1HG   GLU  66          HG1       GLU  66  -0.919  -3.001   9.881
  530   2HG   GLU  66          HG2       GLU  66  -0.496  -2.073  11.321
  531    H    TYR  67           HN       TYR  67  -1.515  -1.505   8.743
  532    HA   TYR  67           HA       TYR  67  -0.452   1.004   9.595
  533   1HB   TYR  67          HB1       TYR  67   1.075  -0.478   8.646
  534   2HB   TYR  67          HB2       TYR  67   0.010  -0.875   7.311
  535    HD1  TYR  67           HD1      TYR  67   0.173   0.266   5.233
  536    HD2  TYR  67           HD2      TYR  67   2.187   1.787   8.708
  537    HE1  TYR  67           HE1      TYR  67   1.528   1.769   3.782
  538    HE2  TYR  67           HE2      TYR  67   3.589   3.256   7.274
  539    HH   TYR  67           HH       TYR  67   4.408   3.190   4.882
  540    H    LEU  68           HN       LEU  68  -2.395   0.070   6.670
  541    HA   LEU  68           HA       LEU  68  -2.493   2.598   5.534
  542   1HB   LEU  68          HB1       LEU  68  -4.494   0.358   5.487
  543   2HB   LEU  68          HB2       LEU  68  -4.692   1.823   4.543
  544    HG   LEU  68           HG       LEU  68  -2.403  -0.146   4.289
  545   1HD1  LEU  68          HD11      LEU  68  -4.618  -0.915   3.498
  546   2HD1  LEU  68          HD12      LEU  68  -3.486  -0.684   2.166
  547   3HD1  LEU  68          HD13      LEU  68  -4.738   0.518   2.479
  548   1HD2  LEU  68          HD21      LEU  68  -3.040   2.331   2.653
  549   2HD2  LEU  68          HD22      LEU  68  -1.812   1.131   2.253
  550   3HD2  LEU  68          HD23      LEU  68  -1.637   2.122   3.701
  551    H    THR  69           HN       THR  69  -4.588   1.396   8.168
  552    HA   THR  69           HA       THR  69  -6.468   3.481   8.113
  553    HB   THR  69           HB       THR  69  -5.678   2.123  10.663
  554    HG1  THR  69           HG1      THR  69  -5.899   0.427   9.302
  555   1HG2  THR  69          HG21      THR  69  -7.496   3.839  10.712
  556   2HG2  THR  69          HG22      THR  69  -8.047   2.222  11.151
  557   3HG2  THR  69          HG23      THR  69  -8.390   2.863   9.545
  558    H    ASN  70           HN       ASN  70  -3.203   3.466   9.330
  559    HA   ASN  70           HA       ASN  70  -3.240   6.285   9.704
  560   1HB   ASN  70          HB1       ASN  70  -4.277   5.396  11.855
  561   2HB   ASN  70          HB2       ASN  70  -2.692   4.729  12.234
  562   1HD2  ASN  70          HD21      ASN  70  -4.233   6.816  13.630
  563   2HD2  ASN  70          HD22      ASN  70  -3.028   8.050  13.738
  564    HA   PRO  71           HA       PRO  71   0.849   4.511   8.397
  565   1HB   PRO  71          HB1       PRO  71   1.420   6.651   6.766
  566   2HB   PRO  71          HB2       PRO  71   0.582   5.189   6.238
  567   1HG   PRO  71          HG1       PRO  71  -0.547   7.845   7.022
  568   2HG   PRO  71          HG2       PRO  71  -1.027   6.769   5.697
  569   1HD   PRO  71          HD1       PRO  71  -2.433   6.916   7.986
  570   2HD   PRO  71          HD2       PRO  71  -2.256   5.391   7.093
  571    H    LYS  72           HN       LYS  72  -0.021   7.779   9.437
  572    HA   LYS  72           HA       LYS  72   2.554   8.715  10.086
  573   1HB   LYS  72          HB1       LYS  72  -0.188   9.639  10.421
  574   2HB   LYS  72          HB2       LYS  72   0.834  10.078  11.779
  575   1HG   LYS  72          HG1       LYS  72   0.722  11.839  10.073
  576   2HG   LYS  72          HG2       LYS  72   2.360  11.245  10.318
  577   1HD   LYS  72          HD1       LYS  72   2.219   9.932   8.273
  578   2HD   LYS  72          HD2       LYS  72   0.537  10.414   8.053
  579   1HE   LYS  72          HE1       LYS  72   1.159  12.689   7.671
  580   2HE   LYS  72          HE2       LYS  72   2.817  12.384   8.166
  581   1HZ   LYS  72          HZ1       LYS  72   3.294  11.323   6.183
  582   2HZ   LYS  72          HZ2       LYS  72   2.276  12.577   5.689
  583   3HZ   LYS  72          HZ3       LYS  72   1.663  11.011   5.828
  584    H    LYS  73           HN       LYS  73   0.172   6.946  12.008
  585    HA   LYS  73           HA       LYS  73   1.701   7.196  14.428
  586   1HB   LYS  73          HB1       LYS  73  -0.693   7.011  14.608
  587   2HB   LYS  73          HB2       LYS  73  -0.683   5.467  13.769
  588   1HG   LYS  73          HG1       LYS  73  -0.996   5.122  16.148
  589   2HG   LYS  73          HG2       LYS  73   0.550   4.455  15.641
  590   1HD   LYS  73          HD1       LYS  73   1.357   6.910  16.415
  591   2HD   LYS  73          HD2       LYS  73  -0.044   6.720  17.467
  592   1HE   LYS  73          HE1       LYS  73   1.724   5.884  18.747
  593   2HE   LYS  73          HE2       LYS  73   0.977   4.435  18.082
  594   1HZ   LYS  73          HZ1       LYS  73   3.566   5.644  17.468
  595   2HZ   LYS  73          HZ2       LYS  73   2.760   4.836  16.223
  596   3HZ   LYS  73          HZ3       LYS  73   3.147   4.012  17.646
  597    H    TYR  74           HN       TYR  74   1.346   4.647  11.990
  598    HA   TYR  74           HA       TYR  74   2.929   2.712  13.335
  599   1HB   TYR  74          HB1       TYR  74   1.205   2.518  11.364
  600   2HB   TYR  74          HB2       TYR  74   2.641   2.743  10.364
  601    HD1  TYR  74           HD1      TYR  74   4.164   0.911   9.977
  602    HD2  TYR  74           HD2      TYR  74   1.180   0.706  13.066
  603    HE1  TYR  74           HE1      TYR  74   4.649  -1.520  10.283
  604    HE2  TYR  74           HE2      TYR  74   1.645  -1.710  13.377
  605    HH   TYR  74           HH       TYR  74   2.542  -3.587  11.995
  606    H    ILE  75           HN       ILE  75   3.702   5.103  10.876
  607    HA   ILE  75           HA       ILE  75   6.575   4.730  11.341
  608    HB   ILE  75           HB       ILE  75   5.233   5.146   8.658
  609   1HG1  ILE  75          HG11      ILE  75   7.014   2.892   9.656
  610   2HG1  ILE  75          HG12      ILE  75   5.271   2.780   9.467
  611   1HG2  ILE  75          HG21      ILE  75   7.214   6.528   8.782
  612   2HG2  ILE  75          HG22      ILE  75   7.583   5.125   7.780
  613   3HG2  ILE  75          HG23      ILE  75   8.159   5.193   9.445
  614   1HD1  ILE  75          HD11      ILE  75   6.351   1.683   7.613
  615   2HD1  ILE  75          HD12      ILE  75   7.307   3.122   7.261
  616   3HD1  ILE  75          HD13      ILE  75   5.561   3.145   7.022
  617    HA   PRO  76           HA       PRO  76   5.510   9.030  12.457
  618   1HB   PRO  76          HB1       PRO  76   7.713   9.364  14.034
  619   2HB   PRO  76          HB2       PRO  76   6.211   8.623  14.598
  620   1HG   PRO  76          HG1       PRO  76   8.746   7.319  13.693
  621   2HG   PRO  76          HG2       PRO  76   7.693   6.897  15.055
  622   1HD   PRO  76          HD1       PRO  76   7.648   5.548  12.711
  623   2HD   PRO  76          HD2       PRO  76   6.199   5.766  13.712
  624    H    GLY  77           HN       GLY  77   5.882  10.172  10.600
  625   1HA   GLY  77          HA1       GLY  77   7.375  11.952   9.808
  626   2HA   GLY  77          HA2       GLY  77   8.683  10.789   9.899
  627    H    THR  78           HN       THR  78   6.218   9.005   8.695
  628    HA   THR  78           HA       THR  78   7.180   8.648   6.129
  629    HB   THR  78           HB       THR  78   5.530   7.265   7.564
  630    HG1  THR  78           HG1      THR  78   6.301   7.065   5.168
  631   1HG2  THR  78          HG21      THR  78   3.215   7.264   6.578
  632   2HG2  THR  78          HG22      THR  78   3.565   8.871   5.940
  633   3HG2  THR  78          HG23      THR  78   3.568   8.594   7.682
  634    H    LYS  79           HN       LYS  79   6.637   9.312   4.098
  635    HA   LYS  79           HA       LYS  79   5.640  11.989   3.801
  636   1HB   LYS  79          HB1       LYS  79   6.100  10.127   1.502
  637   2HB   LYS  79          HB2       LYS  79   6.378  11.858   1.598
  638   1HG   LYS  79          HG1       LYS  79   8.322  11.435   3.077
  639   2HG   LYS  79          HG2       LYS  79   8.059   9.695   2.871
  640   1HD   LYS  79          HD1       LYS  79   8.071  10.388   0.289
  641   2HD   LYS  79          HD2       LYS  79   9.068  11.710   0.911
  642   1HE   LYS  79          HE1       LYS  79  10.692  10.125   0.494
  643   2HE   LYS  79          HE2       LYS  79  10.304   9.756   2.175
  644   1HZ   LYS  79          HZ1       LYS  79  10.373   7.898   0.339
  645   2HZ   LYS  79          HZ2       LYS  79   8.780   8.394   0.086
  646   3HZ   LYS  79          HZ3       LYS  79   9.252   7.841   1.609
  647    H    MET  80           HN       MET  80   4.087   8.829   3.472
  648    HA   MET  80           HA       MET  80   2.050   9.626   1.701
  649   1HB   MET  80          HB1       MET  80   2.262   7.352   1.704
  650   2HB   MET  80          HB2       MET  80   2.507   7.262   3.451
  651   1HG   MET  80          HG1       MET  80   0.288   7.300   3.922
  652   2HG   MET  80          HG2       MET  80  -0.112   8.260   2.510
  653   1HE   MET  80          HE1       MET  80   1.608   4.667   3.060
  654   2HE   MET  80          HE2       MET  80   0.144   3.700   2.877
  655   3HE   MET  80          HE3       MET  80   0.252   4.900   4.164
  656    H    ALA  81           HN       ALA  81   0.831  11.263   2.058
  657    HA   ALA  81           HA       ALA  81  -0.353  11.786   4.668
  658   1HB   ALA  81          HB1       ALA  81  -0.549  14.071   3.991
  659   2HB   ALA  81          HB2       ALA  81  -0.067  13.668   2.344
  660   3HB   ALA  81          HB3       ALA  81   1.088  13.500   3.665
  661    H    PHE  82           HN       PHE  82  -1.383   9.996   2.503
  662    HA   PHE  82           HA       PHE  82  -3.712  10.690   1.292
  663   1HB   PHE  82          HB1       PHE  82  -2.665   8.724   0.625
  664   2HB   PHE  82          HB2       PHE  82  -2.606   8.081   2.261
  665    HD1  PHE  82           HD1      PHE  82  -4.915   8.865  -0.567
  666    HD2  PHE  82           HD2      PHE  82  -4.315   6.683   3.093
  667    HE1  PHE  82           HE1      PHE  82  -7.076   7.680  -0.917
  668    HE2  PHE  82           HE2      PHE  82  -6.479   5.510   2.750
  669    HZ   PHE  82           HZ       PHE  82  -7.868   6.024   0.756
  670    H    GLY  83           HN       GLY  83  -3.406  10.112   4.741
  671   1HA   GLY  83          HA1       GLY  83  -5.133  10.894   6.215
  672   2HA   GLY  83          HA2       GLY  83  -6.312  10.536   4.973
  673    H    GLY  84           HN       GLY  84  -5.456   7.825   4.464
  674   1HA   GLY  84          HA1       GLY  84  -5.381   5.673   5.339
  675   2HA   GLY  84          HA2       GLY  84  -5.588   6.332   6.951
  676    H    LEU  85           HN       LEU  85  -7.038   4.550   4.580
  677    HA   LEU  85           HA       LEU  85  -9.781   5.278   4.810
  678   1HB   LEU  85          HB1       LEU  85  -8.313   2.940   3.637
  679   2HB   LEU  85          HB2       LEU  85 -10.056   2.899   3.794
  680    HG   LEU  85           HG       LEU  85  -8.442   4.855   2.139
  681   1HD1  LEU  85          HD11      LEU  85  -9.472   3.762   0.262
  682   2HD1  LEU  85          HD12      LEU  85 -10.497   2.795   1.323
  683   3HD1  LEU  85          HD13      LEU  85  -8.756   2.514   1.284
  684   1HD2  LEU  85          HD21      LEU  85 -11.457   4.669   2.337
  685   2HD2  LEU  85          HD22      LEU  85 -10.517   5.806   1.371
  686   3HD2  LEU  85          HD23      LEU  85 -10.498   5.919   3.130
  687    H    LYS  86           HN       LYS  86 -10.441   5.318   6.806
  688    HA   LYS  86           HA       LYS  86  -9.990   3.537   8.921
  689   1HB   LYS  86          HB1       LYS  86 -12.277   5.489   8.653
  690   2HB   LYS  86          HB2       LYS  86 -11.562   4.878  10.139
  691   1HG   LYS  86          HG1       LYS  86  -9.914   6.447   8.172
  692   2HG   LYS  86          HG2       LYS  86 -10.935   7.261   9.361
  693   1HD   LYS  86          HD1       LYS  86  -9.761   6.043  11.170
  694   2HD   LYS  86          HD2       LYS  86  -8.718   5.287   9.968
  695   1HE   LYS  86          HE1       LYS  86  -8.923   8.281  10.258
  696   2HE   LYS  86          HE2       LYS  86  -7.789   7.325  11.210
  697   1HZ   LYS  86          HZ1       LYS  86  -6.917   8.333   9.088
  698   2HZ   LYS  86          HZ2       LYS  86  -7.863   7.207   8.255
  699   3HZ   LYS  86          HZ3       LYS  86  -6.641   6.672   9.292
  700    H    LYS  87           HN       LYS  87 -12.296   3.357   6.358
  701    HA   LYS  87           HA       LYS  87 -14.246   1.701   7.688
  702   1HB   LYS  87          HB1       LYS  87 -13.864   2.110   4.737
  703   2HB   LYS  87          HB2       LYS  87 -15.307   1.566   5.549
  704   1HG   LYS  87          HG1       LYS  87 -15.572   3.909   6.478
  705   2HG   LYS  87          HG2       LYS  87 -14.228   4.391   5.398
  706   1HD   LYS  87          HD1       LYS  87 -15.619   2.747   3.796
  707   2HD   LYS  87          HD2       LYS  87 -16.927   3.360   4.748
  708   1HE   LYS  87          HE1       LYS  87 -16.940   5.358   3.631
  709   2HE   LYS  87          HE2       LYS  87 -15.217   5.253   3.204
  710   1HZ   LYS  87          HZ1       LYS  87 -16.738   4.705   1.327
  711   2HZ   LYS  87          HZ2       LYS  87 -17.301   3.377   2.200
  712   3HZ   LYS  87          HZ3       LYS  87 -15.677   3.438   1.718
  713    H    GLU  88           HN       GLU  88 -13.774  -0.372   8.139
  714    HA   GLU  88           HA       GLU  88 -11.832  -2.001   6.986
  715   1HB   GLU  88          HB1       GLU  88 -13.035  -2.220   9.215
  716   2HB   GLU  88          HB2       GLU  88 -14.323  -3.021   8.320
  717   1HG   GLU  88          HG1       GLU  88 -13.175  -4.948   8.194
  718   2HG   GLU  88          HG2       GLU  88 -11.691  -4.121   7.700
  719    H    LYS  89           HN       LYS  89 -15.322  -1.923   6.190
  720    HA   LYS  89           HA       LYS  89 -15.458  -4.117   4.519
  721   1HB   LYS  89          HB1       LYS  89 -17.006  -1.652   3.838
  722   2HB   LYS  89          HB2       LYS  89 -17.535  -3.333   3.888
  723   1HG   LYS  89          HG1       LYS  89 -16.764  -1.784   6.355
  724   2HG   LYS  89          HG2       LYS  89 -18.409  -1.838   5.736
  725   1HD   LYS  89          HD1       LYS  89 -16.936  -4.390   6.326
  726   2HD   LYS  89          HD2       LYS  89 -17.714  -3.479   7.630
  727   1HE   LYS  89          HE1       LYS  89 -19.845  -3.536   6.405
  728   2HE   LYS  89          HE2       LYS  89 -19.077  -4.438   5.099
  729   1HZ   LYS  89          HZ1       LYS  89 -20.409  -5.663   6.946
  730   2HZ   LYS  89          HZ2       LYS  89 -18.973  -5.517   7.827
  731   3HZ   LYS  89          HZ3       LYS  89 -18.972  -6.333   6.348
  732    H    ASP  90           HN       ASP  90 -14.644  -0.840   3.699
  733    HA   ASP  90           HA       ASP  90 -14.139  -0.999   0.998
  734   1HB   ASP  90          HB1       ASP  90 -13.348   0.772   3.274
  735   2HB   ASP  90          HB2       ASP  90 -12.620   1.034   1.701
  736    H    ARG  91           HN       ARG  91 -11.769  -1.391   3.724
  737    HA   ARG  91           HA       ARG  91  -9.578  -1.974   2.008
  738   1HB   ARG  91          HB1       ARG  91  -9.721  -2.959   4.857
  739   2HB   ARG  91          HB2       ARG  91  -8.288  -2.605   3.898
  740   1HG   ARG  91          HG1       ARG  91  -8.895  -0.218   3.908
  741   2HG   ARG  91          HG2       ARG  91 -10.292  -0.587   4.905
  742   1HD   ARG  91          HD1       ARG  91  -7.448  -1.138   5.751
  743   2HD   ARG  91          HD2       ARG  91  -8.282   0.367   6.101
  744    HE   ARG  91           HE       ARG  91  -8.656  -2.055   6.589
  745   1HH1  ARG  91          HH21      ARG  91  -9.190   1.190   7.710
  746   2HH1  ARG  91          HH22      ARG  91 -10.081   0.946   9.172
  747   1HH2  ARG  91          HH11      ARG  91 -10.031  -2.484   9.006
  748   2HH2  ARG  91          HH12      ARG  91 -10.594  -1.102   9.874
  749    H    ASN  92           HN       ASN  92 -11.977  -4.092   3.524
  750    HA   ASN  92           HA       ASN  92 -10.888  -6.562   3.226
  751   1HB   ASN  92          HB1       ASN  92 -13.734  -5.665   2.798
  752   2HB   ASN  92          HB2       ASN  92 -13.268  -7.359   2.807
  753   1HD2  ASN  92          HD21      ASN  92 -15.117  -6.223   4.565
  754   2HD2  ASN  92          HD22      ASN  92 -14.414  -6.575   6.106
  755    H    ASP  93           HN       ASP  93 -12.876  -5.087   0.613
  756    HA   ASP  93           HA       ASP  93 -12.166  -6.937  -1.379
  757   1HB   ASP  93          HB1       ASP  93 -14.043  -5.049  -1.252
  758   2HB   ASP  93          HB2       ASP  93 -12.850  -4.150  -2.176
  759    H    LEU  94           HN       LEU  94 -10.588  -3.823  -0.496
  760    HA   LEU  94           HA       LEU  94  -8.860  -3.532  -2.606
  761   1HB   LEU  94          HB1       LEU  94  -9.144  -2.519   0.127
  762   2HB   LEU  94          HB2       LEU  94  -7.518  -2.543  -0.446
  763    HG   LEU  94           HG       LEU  94  -9.699  -1.290  -2.083
  764   1HD1  LEU  94          HD11      LEU  94  -9.569  -0.361   0.269
  765   2HD1  LEU  94          HD12      LEU  94  -9.328   0.805  -1.035
  766   3HD1  LEU  94          HD13      LEU  94  -7.942   0.193  -0.135
  767   1HD2  LEU  94          HD21      LEU  94  -7.408  -1.657  -3.122
  768   2HD2  LEU  94          HD22      LEU  94  -6.792  -0.493  -1.950
  769   3HD2  LEU  94          HD23      LEU  94  -8.003   0.004  -3.130
  770    H    ILE  95           HN       ILE  95  -8.455  -5.561   0.271
  771    HA   ILE  95           HA       ILE  95  -5.765  -6.329  -0.199
  772    HB   ILE  95           HB       ILE  95  -7.910  -7.717   1.424
  773   1HG1  ILE  95          HG11      ILE  95  -5.729  -5.859   2.411
  774   2HG1  ILE  95          HG12      ILE  95  -7.349  -5.295   2.014
  775   1HG2  ILE  95          HG21      ILE  95  -6.068  -9.251   1.015
  776   2HG2  ILE  95          HG22      ILE  95  -6.005  -8.696   2.687
  777   3HG2  ILE  95          HG23      ILE  95  -4.898  -8.019   1.494
  778   1HD1  ILE  95          HD11      ILE  95  -6.683  -7.365   4.112
  779   2HD1  ILE  95          HD12      ILE  95  -8.294  -6.756   3.731
  780   3HD1  ILE  95          HD13      ILE  95  -7.085  -5.675   4.422
  781    H    THR  96           HN       THR  96  -8.885  -7.902  -0.974
  782    HA   THR  96           HA       THR  96  -7.924 -10.217  -2.187
  783    HB   THR  96           HB       THR  96 -10.413  -8.773  -3.101
  784    HG1  THR  96           HG1      THR  96  -9.873  -9.582  -0.655
  785   1HG2  THR  96          HG21      THR  96 -11.247 -11.008  -3.540
  786   2HG2  THR  96          HG22      THR  96  -9.772 -11.721  -2.884
  787   3HG2  THR  96          HG23      THR  96  -9.711 -10.792  -4.382
  788    H    TYR  97           HN       TYR  97  -8.501  -7.019  -3.710
  789    HA   TYR  97           HA       TYR  97  -7.807  -7.798  -6.323
  790   1HB   TYR  97          HB1       TYR  97  -8.980  -5.746  -6.008
  791   2HB   TYR  97          HB2       TYR  97  -7.705  -5.104  -4.980
  792    HD1  TYR  97           HD1      TYR  97  -6.463  -3.422  -5.928
  793    HD2  TYR  97           HD2      TYR  97  -7.897  -6.611  -8.430
  794    HE1  TYR  97           HE1      TYR  97  -5.355  -2.374  -7.891
  795    HE2  TYR  97           HE2      TYR  97  -6.897  -5.509 -10.423
  796    HH   TYR  97           HH       TYR  97  -4.598  -3.484 -10.454
  797    H    LEU  98           HN       LEU  98  -5.726  -6.119  -3.913
  798    HA   LEU  98           HA       LEU  98  -3.345  -6.211  -5.382
  799   1HB   LEU  98          HB1       LEU  98  -4.200  -5.360  -2.826
  800   2HB   LEU  98          HB2       LEU  98  -2.842  -6.449  -2.558
  801    HG   LEU  98           HG       LEU  98  -2.068  -4.111  -2.812
  802   1HD1  LEU  98          HD11      LEU  98  -1.323  -5.870  -5.160
  803   2HD1  LEU  98          HD12      LEU  98  -0.593  -5.940  -3.556
  804   3HD1  LEU  98          HD13      LEU  98  -0.389  -4.500  -4.556
  805   1HD2  LEU  98          HD21      LEU  98  -3.876  -3.347  -4.321
  806   2HD2  LEU  98          HD22      LEU  98  -3.189  -4.333  -5.612
  807   3HD2  LEU  98          HD23      LEU  98  -2.272  -2.977  -4.956
  808    H    LYS  99           HN       LYS  99  -4.646  -8.431  -2.995
  809    HA   LYS  99           HA       LYS  99  -2.599 -10.318  -2.903
  810   1HB   LYS  99          HB1       LYS  99  -4.181 -10.444  -1.184
  811   2HB   LYS  99          HB2       LYS  99  -5.540 -10.424  -2.294
  812   1HG   LYS  99          HG1       LYS  99  -5.205 -12.692  -2.901
  813   2HG   LYS  99          HG2       LYS  99  -3.621 -12.741  -2.151
  814   1HD   LYS  99          HD1       LYS  99  -5.421 -12.136  -0.075
  815   2HD   LYS  99          HD2       LYS  99  -6.205 -13.390  -1.041
  816   1HE   LYS  99          HE1       LYS  99  -4.847 -14.384   0.715
  817   2HE   LYS  99          HE2       LYS  99  -4.205 -14.781  -0.872
  818   1HZ   LYS  99          HZ1       LYS  99  -2.276 -14.089  -0.090
  819   2HZ   LYS  99          HZ2       LYS  99  -2.975 -13.419   1.302
  820   3HZ   LYS  99          HZ3       LYS  99  -2.902 -12.508  -0.123
  821    H    LYS 100           HN       LYS 100  -5.316 -10.039  -5.187
  822    HA   LYS 100           HA       LYS 100  -4.823 -12.442  -6.582
  823   1HB   LYS 100          HB1       LYS 100  -6.961 -11.142  -6.494
  824   2HB   LYS 100          HB2       LYS 100  -6.278 -10.078  -7.700
  825   1HG   LYS 100          HG1       LYS 100  -7.836 -11.728  -8.668
  826   2HG   LYS 100          HG2       LYS 100  -6.206 -11.908  -9.323
  827   1HD   LYS 100          HD1       LYS 100  -6.402 -13.497  -7.003
  828   2HD   LYS 100          HD2       LYS 100  -7.842 -13.793  -7.925
  829   1HE   LYS 100          HE1       LYS 100  -6.346 -15.549  -8.365
  830   2HE   LYS 100          HE2       LYS 100  -6.304 -14.524  -9.809
  831   1HZ   LYS 100          HZ1       LYS 100  -4.291 -13.461  -8.968
  832   2HZ   LYS 100          HZ2       LYS 100  -4.063 -15.131  -9.090
  833   3HZ   LYS 100          HZ3       LYS 100  -4.334 -14.427  -7.574
  834    H    ALA 101           HN       ALA 101  -3.578  -9.330  -7.047
  835    HA   ALA 101           HA       ALA 101  -2.254  -9.618  -9.531
  836   1HB   ALA 101          HB1       ALA 101  -1.852  -7.553  -7.366
  837   2HB   ALA 101          HB2       ALA 101  -3.132  -7.497  -8.578
  838   3HB   ALA 101          HB3       ALA 101  -1.442  -7.402  -9.075
  839    H    THR 102           HN       THR 102  -1.232 -10.051  -6.175
  840    HA   THR 102           HA       THR 102   1.537 -10.611  -6.834
  841    HB   THR 102           HB       THR 102   0.314 -10.985  -4.114
  842    HG1  THR 102           HG1      THR 102  -0.184  -8.853  -4.952
  843   1HG2  THR 102          HG21      THR 102   2.562 -10.234  -3.379
  844   2HG2  THR 102          HG22      THR 102   3.067 -10.173  -5.068
  845   3HG2  THR 102          HG23      THR 102   2.620 -11.715  -4.337
  846    H    GLU 103           HN       GLU 103  -1.355 -12.412  -5.786
  847    HA   GLU 103           HA       GLU 103  -0.010 -14.881  -6.637
  848   1HB   GLU 103          HB1       GLU 103  -1.100 -16.102  -4.731
  849   2HB   GLU 103          HB2       GLU 103   0.169 -14.985  -4.254
  850   1HG   GLU 103          HG1       GLU 103  -1.501 -13.352  -3.578
  851   2HG   GLU 103          HG2       GLU 103  -2.787 -14.436  -4.098
  852    HHA  HEC 104           HA       HEC 104   4.920   3.575   1.618
  853    HHB  HEC 104           HB       HEC 104  -0.680   0.593   0.222
  854    HHC  HEC 104           HC       HEC 104  -3.268   6.310  -1.397
  855    HHD  HEC 104           HD       HEC 104   2.624   8.950  -1.184
  856   1HMA  HEC 104          HMA1      HEC 104   1.088  -0.792   2.078
  857   2HMA  HEC 104          HMA2      HEC 104   2.633  -1.132   1.296
  858   3HMA  HEC 104          HMA3      HEC 104   1.167  -0.984   0.326
  859   1HAA  HEC 104          HAA1      HEC 104   4.128  -0.105   2.254
  860   2HAA  HEC 104          HAA2      HEC 104   4.772   1.475   2.657
  861   1HBA  HEC 104          HBA1      HEC 104   5.695   1.654   0.359
  862   2HBA  HEC 104          HBA2      HEC 104   5.109   0.033   0.022
  863   1HMB  HEC 104          HMB1      HEC 104  -2.536   0.252  -0.455
  864   2HMB  HEC 104          HMB2      HEC 104  -3.430   0.842  -1.856
  865   3HMB  HEC 104          HMB3      HEC 104  -4.138   0.960  -0.245
  866    HAB  HEC 104           HAB      HEC 104  -4.648   4.959  -1.489
  867   1HBB  HEC 104          HBB1      HEC 104  -5.020   3.720   0.783
  868   2HBB  HEC 104          HBB2      HEC 104  -5.972   2.638  -0.232
  869   3HBB  HEC 104          HBB3      HEC 104  -6.357   4.359  -0.174
  870   1HMC  HEC 104          HMC1      HEC 104  -3.361   8.877  -1.548
  871   2HMC  HEC 104          HMC2      HEC 104  -2.969   8.165  -3.113
  872   3HMC  HEC 104          HMC3      HEC 104  -2.398   9.784  -2.713
  873    HAC  HEC 104           HAC      HEC 104   1.443   9.988  -2.488
  874   1HBC  HEC 104          HBC1      HEC 104   0.582  11.355  -0.830
  875   2HBC  HEC 104          HBC2      HEC 104  -1.060  11.261  -1.465
  876   3HBC  HEC 104          HBC3      HEC 104   0.180  12.146  -2.354
  877   1HMD  HEC 104          HMD1      HEC 104   4.726   9.380  -0.215
  878   2HMD  HEC 104          HMD2      HEC 104   5.230   8.409  -1.598
  879   3HMD  HEC 104          HMD3      HEC 104   6.212   8.434  -0.133
  880   1HAD  HEC 104          HAD1      HEC 104   7.027   6.571   0.658
  881   2HAD  HEC 104          HAD2      HEC 104   6.581   5.017   1.354
  882   1HBD  HEC 104          HBD1      HEC 104   5.994   5.946   3.394
  883   2HBD  HEC 104          HBD2      HEC 104   5.666   7.520   2.703
  884    H2   4NL 105           H2       4NL 105   1.049 -12.986  -0.851
  885    H6   4NL 105           H6       4NL 105   2.224 -13.201   4.134
  886    H3   4NL 105           H3       4NL 105  -1.550 -10.591   1.674
  887    H5   4NL 105           H5       4NL 105  -1.007 -12.237  -1.487
  888    H4   4NL 105           H4       4NL 105   0.003 -10.947   3.611
  889    H1   4NL 105           H1       4NL 105   2.602 -13.342   1.086
  890    H7   4NL 105           H7       4NL 105   2.992 -11.633   3.787
  Start of MODEL   14
    1   1H    THR  -5          HT1       THR  -5 -13.303  -6.114  13.726
    2   2H    THR  -5          HT2       THR  -5 -12.596  -5.304  12.418
    3   3H    THR  -5          HT3       THR  -5 -11.712  -5.540  13.842
    4    HA   THR  -5           HA       THR  -5 -11.217  -7.059  11.878
    5    HB   THR  -5           HB       THR  -5 -11.937  -8.624  14.345
    6    HG1  THR  -5           HG1      THR  -5  -9.882  -7.732  15.187
    7   1HG2  THR  -5          HG21      THR  -5  -9.387  -8.440  12.733
    8   2HG2  THR  -5          HG22      THR  -5 -10.665  -9.616  12.425
    9   3HG2  THR  -5          HG23      THR  -5  -9.789  -9.646  13.956
   10    H    GLU  -4           HN       GLU  -4 -12.984  -7.143  10.375
   11    HA   GLU  -4           HA       GLU  -4 -14.603  -9.518  10.574
   12   1HB   GLU  -4          HB1       GLU  -4 -15.954  -7.595  11.673
   13   2HB   GLU  -4          HB2       GLU  -4 -16.054  -6.907  10.056
   14   1HG   GLU  -4          HG1       GLU  -4 -16.956  -9.713  10.673
   15   2HG   GLU  -4          HG2       GLU  -4 -18.022  -8.323  10.834
   16    H    PHE  -3           HN       PHE  -3 -12.967  -9.886   8.933
   17    HA   PHE  -3           HA       PHE  -3 -13.039  -8.372   6.494
   18   1HB   PHE  -3          HB1       PHE  -3 -10.885  -9.148   7.128
   19   2HB   PHE  -3          HB2       PHE  -3 -11.447 -10.808   7.272
   20    HD1  PHE  -3           HD1      PHE  -3 -10.534  -8.118   4.890
   21    HD2  PHE  -3           HD2      PHE  -3 -11.624 -12.252   5.346
   22    HE1  PHE  -3           HE1      PHE  -3  -9.962  -8.530   2.504
   23    HE2  PHE  -3           HE2      PHE  -3 -11.101 -12.656   2.948
   24    HZ   PHE  -3           HZ       PHE  -3 -10.297 -10.786   1.517
   25    H    LYS  -2           HN       LYS  -2 -13.932  -8.797   4.652
   26    HA   LYS  -2           HA       LYS  -2 -15.405 -11.274   4.146
   27   1HB   LYS  -2          HB1       LYS  -2 -16.765  -9.125   4.966
   28   2HB   LYS  -2          HB2       LYS  -2 -16.599  -8.673   3.269
   29   1HG   LYS  -2          HG1       LYS  -2 -18.515  -9.864   3.056
   30   2HG   LYS  -2          HG2       LYS  -2 -17.395 -11.219   2.957
   31   1HD   LYS  -2          HD1       LYS  -2 -18.714 -10.284   5.514
   32   2HD   LYS  -2          HD2       LYS  -2 -19.331 -11.590   4.504
   33   1HE   LYS  -2          HE1       LYS  -2 -17.666 -13.043   5.127
   34   2HE   LYS  -2          HE2       LYS  -2 -16.496 -11.758   5.402
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.727 -12.559   7.194
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.768 -11.192   7.443
   37   3HZ   LYS  -2          HZ3       LYS  -2 -17.064 -12.725   7.480
   38    H    ALA  -1           HN       ALA  -1 -14.951 -12.061   2.227
   39    HA   ALA  -1           HA       ALA  -1 -12.913 -11.136   0.587
   40   1HB   ALA  -1          HB1       ALA  -1 -13.603 -13.476   0.779
   41   2HB   ALA  -1          HB2       ALA  -1 -13.570 -12.954  -0.906
   42   3HB   ALA  -1          HB3       ALA  -1 -15.110 -13.104  -0.061
   43    H    GLY   1           HN       GLY   1 -12.826 -10.118  -1.376
   44   1HA   GLY   1          HA1       GLY   1 -15.206  -8.636  -2.284
   45   2HA   GLY   1          HA2       GLY   1 -13.553  -8.058  -2.416
   46    H    SER   2           HN       SER   2 -13.474  -7.782  -4.562
   47    HA   SER   2           HA       SER   2 -13.042 -10.065  -6.257
   48   1HB   SER   2          HB1       SER   2 -15.062  -8.185  -7.386
   49   2HB   SER   2          HB2       SER   2 -14.820  -9.907  -7.706
   50    HG   SER   2           HG       SER   2 -15.544 -10.151  -5.408
   51    H    ALA   3           HN       ALA   3 -11.756  -9.544  -8.025
   52    HA   ALA   3           HA       ALA   3 -10.080  -7.386  -7.929
   53   1HB   ALA   3          HB1       ALA   3  -9.618  -9.422  -9.165
   54   2HB   ALA   3          HB2       ALA   3  -9.393  -8.005 -10.192
   55   3HB   ALA   3          HB3       ALA   3 -10.841  -8.995 -10.362
   56    H    LYS   4           HN       LYS   4 -13.160  -7.463  -9.789
   57    HA   LYS   4           HA       LYS   4 -12.689  -4.858 -10.876
   58   1HB   LYS   4          HB1       LYS   4 -13.952  -6.797 -11.978
   59   2HB   LYS   4          HB2       LYS   4 -15.338  -6.218 -11.053
   60   1HG   LYS   4          HG1       LYS   4 -14.470  -3.880 -12.083
   61   2HG   LYS   4          HG2       LYS   4 -13.946  -4.977 -13.354
   62   1HD   LYS   4          HD1       LYS   4 -16.103  -4.240 -13.993
   63   2HD   LYS   4          HD2       LYS   4 -16.338  -5.872 -13.356
   64   1HE   LYS   4          HE1       LYS   4 -18.041  -4.245 -12.530
   65   2HE   LYS   4          HE2       LYS   4 -17.106  -4.990 -11.234
   66   1HZ   LYS   4          HZ1       LYS   4 -15.780  -3.034 -11.045
   67   2HZ   LYS   4          HZ2       LYS   4 -17.404  -2.573 -10.978
   68   3HZ   LYS   4          HZ3       LYS   4 -16.521  -2.329 -12.398
   69    H    LYS   5           HN       LYS   5 -13.409  -5.491  -7.816
   70    HA   LYS   5           HA       LYS   5 -15.128  -3.109  -7.514
   71   1HB   LYS   5          HB1       LYS   5 -14.875  -5.518  -5.703
   72   2HB   LYS   5          HB2       LYS   5 -15.663  -4.024  -5.214
   73   1HG   LYS   5          HG1       LYS   5 -17.083  -4.390  -7.390
   74   2HG   LYS   5          HG2       LYS   5 -16.553  -6.065  -7.213
   75   1HD   LYS   5          HD1       LYS   5 -17.560  -4.815  -4.738
   76   2HD   LYS   5          HD2       LYS   5 -18.766  -5.009  -6.009
   77   1HE   LYS   5          HE1       LYS   5 -18.870  -6.982  -4.688
   78   2HE   LYS   5          HE2       LYS   5 -18.028  -7.429  -6.171
   79   1HZ   LYS   5          HZ1       LYS   5 -16.126  -7.819  -5.066
   80   2HZ   LYS   5          HZ2       LYS   5 -17.147  -7.990  -3.723
   81   3HZ   LYS   5          HZ3       LYS   5 -16.345  -6.523  -3.992
   82    H    GLY   6           HN       GLY   6 -12.522  -4.912  -5.836
   83   1HA   GLY   6          HA1       GLY   6 -11.668  -2.822  -4.171
   84   2HA   GLY   6          HA2       GLY   6 -10.669  -4.166  -4.698
   85    H    ALA   7           HN       ALA   7 -11.000  -3.391  -7.578
   86    HA   ALA   7           HA       ALA   7  -8.770  -1.747  -7.914
   87   1HB   ALA   7          HB1       ALA   7  -9.366  -1.709 -10.291
   88   2HB   ALA   7          HB2       ALA   7 -10.951  -2.381  -9.903
   89   3HB   ALA   7          HB3       ALA   7  -9.497  -3.333  -9.612
   90    H    THR   8           HN       THR   8 -12.249  -0.812  -8.490
   91    HA   THR   8           HA       THR   8 -11.900   1.811  -9.139
   92    HB   THR   8           HB       THR   8 -14.030   2.031  -7.401
   93    HG1  THR   8           HG1      THR   8 -13.959  -0.211  -6.998
   94   1HG2  THR   8          HG21      THR   8 -15.413   1.819  -9.394
   95   2HG2  THR   8          HG22      THR   8 -14.074   1.069 -10.264
   96   3HG2  THR   8          HG23      THR   8 -13.960   2.754  -9.754
   97    H    LEU   9           HN       LEU   9 -11.496   0.514  -5.888
   98    HA   LEU   9           HA       LEU   9 -11.331   2.994  -4.519
   99   1HB   LEU   9          HB1       LEU   9 -10.857   0.131  -3.874
  100   2HB   LEU   9          HB2       LEU   9  -9.990   1.304  -2.885
  101    HG   LEU   9           HG       LEU   9 -12.022   0.934  -1.735
  102   1HD1  LEU   9          HD11      LEU   9 -11.442   3.317  -1.983
  103   2HD1  LEU   9          HD12      LEU   9 -13.186   3.077  -1.874
  104   3HD1  LEU   9          HD13      LEU   9 -12.437   3.394  -3.438
  105   1HD2  LEU   9          HD21      LEU   9 -14.247   1.144  -2.812
  106   2HD2  LEU   9          HD22      LEU   9 -13.312  -0.202  -3.461
  107   3HD2  LEU   9          HD23      LEU   9 -13.447   1.298  -4.379
  108    H    PHE  10           HN       PHE  10  -8.673   0.664  -4.605
  109    HA   PHE  10           HA       PHE  10  -6.522   2.285  -4.287
  110   1HB   PHE  10          HB1       PHE  10  -6.506  -0.191  -4.352
  111   2HB   PHE  10          HB2       PHE  10  -6.641  -0.131  -6.102
  112    HD1  PHE  10           HD1      PHE  10  -4.724   0.852  -7.459
  113    HD2  PHE  10           HD2      PHE  10  -4.426  -0.049  -3.264
  114    HE1  PHE  10           HE1      PHE  10  -2.237   0.849  -7.632
  115    HE2  PHE  10           HE2      PHE  10  -1.949   0.076  -3.413
  116    HZ   PHE  10           HZ       PHE  10  -0.848   0.499  -5.597
  117    H    LYS  11           HN       LYS  11  -8.068   1.573  -7.416
  118    HA   LYS  11           HA       LYS  11  -6.190   2.976  -9.003
  119   1HB   LYS  11          HB1       LYS  11  -8.208   1.160  -9.478
  120   2HB   LYS  11          HB2       LYS  11  -8.800   2.631 -10.246
  121   1HG   LYS  11          HG1       LYS  11  -7.538   1.981 -11.993
  122   2HG   LYS  11          HG2       LYS  11  -6.203   2.644 -11.054
  123   1HD   LYS  11          HD1       LYS  11  -5.894   0.336 -10.068
  124   2HD   LYS  11          HD2       LYS  11  -7.060  -0.246 -11.257
  125   1HE   LYS  11          HE1       LYS  11  -5.577   0.663 -13.059
  126   2HE   LYS  11          HE2       LYS  11  -4.390   1.064 -11.822
  127   1HZ   LYS  11          HZ1       LYS  11  -5.177  -1.564 -12.863
  128   2HZ   LYS  11          HZ2       LYS  11  -4.658  -1.462 -11.259
  129   3HZ   LYS  11          HZ3       LYS  11  -3.632  -0.961 -12.506
  130    H    THR  12           HN       THR  12  -8.180   4.401  -6.886
  131    HA   THR  12           HA       THR  12  -8.137   6.945  -8.291
  132    HB   THR  12           HB       THR  12 -10.477   5.491  -7.973
  133    HG1  THR  12           HG1      THR  12  -9.828   7.088  -9.551
  134   1HG2  THR  12          HG21      THR  12 -11.979   7.055  -6.808
  135   2HG2  THR  12          HG22      THR  12 -10.572   7.932  -6.205
  136   3HG2  THR  12          HG23      THR  12 -10.845   6.260  -5.715
  137    H    ARG  13           HN       ARG  13  -8.207   5.213  -5.304
  138    HA   ARG  13           HA       ARG  13  -7.760   7.545  -3.607
  139   1HB   ARG  13          HB1       ARG  13  -8.545   4.711  -3.167
  140   2HB   ARG  13          HB2       ARG  13  -7.671   5.505  -1.874
  141   1HG   ARG  13          HG1       ARG  13 -10.292   6.404  -3.055
  142   2HG   ARG  13          HG2       ARG  13 -10.078   5.565  -1.526
  143   1HD   ARG  13          HD1       ARG  13 -10.333   7.779  -0.868
  144   2HD   ARG  13          HD2       ARG  13  -8.575   7.601  -0.910
  145    HE   ARG  13           HE       ARG  13 -10.308   8.554  -2.912
  146   1HH1  ARG  13          HH11      ARG  13  -7.298   8.822  -1.155
  147   2HH1  ARG  13          HH12      ARG  13  -6.468   9.935  -2.181
  148   1HH2  ARG  13          HH21      ARG  13  -9.007  10.263  -4.450
  149   2HH2  ARG  13          HH22      ARG  13  -7.418  10.748  -3.971
  150    H    CYS  14           HN       CYS  14  -5.910   5.216  -5.212
  151    HA   CYS  14           HA       CYS  14  -3.518   5.877  -3.633
  152   1HB   CYS  14          HB1       CYS  14  -3.885   3.160  -4.829
  153   2HB   CYS  14          HB2       CYS  14  -2.789   3.661  -3.561
  154    H    LEU  15           HN       LEU  15  -4.904   5.145  -6.776
  155    HA   LEU  15           HA       LEU  15  -2.672   4.811  -8.354
  156   1HB   LEU  15          HB1       LEU  15  -5.162   4.622  -8.930
  157   2HB   LEU  15          HB2       LEU  15  -5.096   6.349  -9.256
  158    HG   LEU  15           HG       LEU  15  -3.230   5.892 -10.896
  159   1HD1  LEU  15          HD11      LEU  15  -2.529   3.701 -10.063
  160   2HD1  LEU  15          HD12      LEU  15  -2.989   3.620 -11.764
  161   3HD1  LEU  15          HD13      LEU  15  -4.092   3.024 -10.523
  162   1HD2  LEU  15          HD21      LEU  15  -6.017   4.879 -11.273
  163   2HD2  LEU  15          HD22      LEU  15  -4.833   4.681 -12.565
  164   3HD2  LEU  15          HD23      LEU  15  -5.236   6.294 -11.977
  165    H    GLN  16           HN       GLN  16  -4.083   7.888  -7.303
  166    HA   GLN  16           HA       GLN  16  -2.907   9.788  -8.775
  167   1HB   GLN  16          HB1       GLN  16  -2.801  11.124  -6.551
  168   2HB   GLN  16          HB2       GLN  16  -4.350  10.574  -7.170
  169   1HG   GLN  16          HG1       GLN  16  -4.311   8.677  -5.608
  170   2HG   GLN  16          HG2       GLN  16  -2.750   9.223  -4.988
  171   1HE2  GLN  16          HE21      GLN  16  -3.477  12.070  -5.114
  172   2HE2  GLN  16          HE22      GLN  16  -4.615  12.327  -3.845
  173    H    CYS  17           HN       CYS  17  -1.123   7.896  -6.370
  174    HA   CYS  17           HA       CYS  17   1.357   9.248  -7.188
  175   1HB   CYS  17          HB1       CYS  17   1.274   8.010  -4.501
  176   2HB   CYS  17          HB2       CYS  17   2.075   9.462  -5.075
  177    H    HIS  18           HN       HIS  18  -0.110   6.151  -6.376
  178    HA   HIS  18           HA       HIS  18   2.407   4.698  -6.696
  179   1HB   HIS  18          HB1       HIS  18  -0.279   4.029  -5.544
  180   2HB   HIS  18          HB2       HIS  18   0.880   2.767  -5.917
  181    HD1  HIS  18           HD1      HIS  18   3.391   3.283  -4.610
  182    HD2  HIS  18           HD2      HIS  18  -0.182   4.858  -3.099
  183    HE1  HIS  18           HE1      HIS  18   3.806   3.736  -2.149
  184    H    THR  19           HN       THR  19   1.871   2.379  -7.500
  185    HA   THR  19           HA       THR  19   0.167   2.162  -9.824
  186    HB   THR  19           HB       THR  19   2.437   1.160 -10.910
  187    HG1  THR  19           HG1      THR  19   4.123   2.493 -10.490
  188   1HG2  THR  19          HG21      THR  19   0.921   2.641 -12.089
  189   2HG2  THR  19          HG22      THR  19   2.573   3.238 -12.239
  190   3HG2  THR  19          HG23      THR  19   1.457   4.008 -11.113
  191    H    VAL  20           HN       VAL  20  -0.816   0.213  -9.657
  192    HA   VAL  20           HA       VAL  20   0.020  -1.781  -7.790
  193    HB   VAL  20           HB       VAL  20  -2.334  -0.992  -8.727
  194   1HG1  VAL  20          HG11      VAL  20  -2.155  -1.986 -10.912
  195   2HG1  VAL  20          HG12      VAL  20  -3.433  -2.772  -9.984
  196   3HG1  VAL  20          HG13      VAL  20  -1.877  -3.576 -10.198
  197   1HG2  VAL  20          HG21      VAL  20  -1.852  -3.732  -7.575
  198   2HG2  VAL  20          HG22      VAL  20  -3.380  -2.853  -7.574
  199   3HG2  VAL  20          HG23      VAL  20  -2.007  -2.231  -6.662
  200    H    GLU  21           HN       GLU  21   0.448  -1.455 -11.188
  201    HA   GLU  21           HA       GLU  21   1.394  -4.201 -11.557
  202   1HB   GLU  21          HB1       GLU  21   1.347  -2.200 -13.784
  203   2HB   GLU  21          HB2       GLU  21   1.033  -3.922 -13.840
  204   1HG   GLU  21          HG1       GLU  21  -1.046  -2.998 -14.313
  205   2HG   GLU  21          HG2       GLU  21  -1.163  -3.353 -12.592
  206    H    LYS  22           HN       LYS  22   3.624  -4.461 -12.627
  207    HA   LYS  22           HA       LYS  22   5.435  -2.494 -11.559
  208   1HB   LYS  22          HB1       LYS  22   5.575  -5.253 -12.068
  209   2HB   LYS  22          HB2       LYS  22   6.849  -4.487 -13.034
  210   1HG   LYS  22          HG1       LYS  22   7.828  -3.458 -11.171
  211   2HG   LYS  22          HG2       LYS  22   6.382  -3.664 -10.182
  212   1HD   LYS  22          HD1       LYS  22   6.773  -6.000  -9.958
  213   2HD   LYS  22          HD2       LYS  22   8.053  -5.962 -11.172
  214   1HE   LYS  22          HE1       LYS  22   9.074  -6.105  -8.994
  215   2HE   LYS  22          HE2       LYS  22   9.397  -4.515  -9.661
  216   1HZ   LYS  22          HZ1       LYS  22   7.690  -3.592  -8.196
  217   2HZ   LYS  22          HZ2       LYS  22   8.859  -4.413  -7.298
  218   3HZ   LYS  22          HZ3       LYS  22   7.356  -5.131  -7.574
  219    H    GLY  23           HN       GLY  23   3.860  -2.358 -14.436
  220   1HA   GLY  23          HA1       GLY  23   6.136  -1.497 -16.056
  221   2HA   GLY  23          HA2       GLY  23   4.468  -1.621 -16.590
  222    H    GLY  24           HN       GLY  24   4.152  -0.006 -13.807
  223   1HA   GLY  24          HA1       GLY  24   3.882   2.586 -15.057
  224   2HA   GLY  24          HA2       GLY  24   3.342   2.124 -13.452
  225    HA   PRO  25           HA       PRO  25   7.886   3.975 -13.521
  226   1HB   PRO  25          HB1       PRO  25   7.416   6.662 -13.933
  227   2HB   PRO  25          HB2       PRO  25   8.014   5.552 -15.169
  228   1HG   PRO  25          HG1       PRO  25   5.235   6.545 -14.696
  229   2HG   PRO  25          HG2       PRO  25   6.087   6.282 -16.228
  230   1HD   PRO  25          HD1       PRO  25   4.255   4.540 -15.304
  231   2HD   PRO  25          HD2       PRO  25   5.690   4.001 -16.201
  232    H    HIS  26           HN       HIS  26   8.559   4.650 -11.527
  233    HA   HIS  26           HA       HIS  26   6.813   4.858  -9.370
  234   1HB   HIS  26          HB1       HIS  26   9.679   5.761  -9.718
  235   2HB   HIS  26          HB2       HIS  26   8.853   5.745  -8.169
  236    HD2  HIS  26           HD2      HIS  26  10.913   3.588 -10.438
  237    HE1  HIS  26           HE1      HIS  26   9.435   0.957  -7.451
  238    HE2  HIS  26           HE2      HIS  26  11.106   1.225  -9.344
  239    H    LYS  27           HN       LYS  27   5.333   6.480  -9.120
  240    HA   LYS  27           HA       LYS  27   5.903   9.179 -10.037
  241   1HB   LYS  27          HB1       LYS  27   3.432   7.635  -9.362
  242   2HB   LYS  27          HB2       LYS  27   3.371   9.390  -9.342
  243   1HG   LYS  27          HG1       LYS  27   3.839   9.560 -11.638
  244   2HG   LYS  27          HG2       LYS  27   4.462   7.908 -11.721
  245   1HD   LYS  27          HD1       LYS  27   1.592   8.818 -11.480
  246   2HD   LYS  27          HD2       LYS  27   2.317   7.792 -12.724
  247   1HE   LYS  27          HE1       LYS  27   2.434   5.936 -11.303
  248   2HE   LYS  27          HE2       LYS  27   2.314   6.924  -9.847
  249   1HZ   LYS  27          HZ1       LYS  27   0.122   6.460 -11.796
  250   2HZ   LYS  27          HZ2       LYS  27   0.009   7.379 -10.383
  251   3HZ   LYS  27          HZ3       LYS  27   0.268   5.712 -10.281
  252    H    VAL  28           HN       VAL  28   3.830   9.952  -7.766
  253    HA   VAL  28           HA       VAL  28   5.692  11.073  -5.959
  254    HB   VAL  28           HB       VAL  28   2.750  10.659  -5.434
  255   1HG1  VAL  28          HG11      VAL  28   2.942  12.660  -4.067
  256   2HG1  VAL  28          HG12      VAL  28   4.643  12.825  -4.503
  257   3HG1  VAL  28          HG13      VAL  28   4.111  11.454  -3.529
  258   1HG2  VAL  28          HG21      VAL  28   2.384  12.911  -6.397
  259   2HG2  VAL  28          HG22      VAL  28   2.921  11.747  -7.607
  260   3HG2  VAL  28          HG23      VAL  28   4.057  12.928  -6.957
  261    H    GLY  29           HN       GLY  29   4.133   8.014  -6.123
  262   1HA   GLY  29          HA1       GLY  29   5.280   7.150  -3.547
  263   2HA   GLY  29          HA2       GLY  29   3.712   6.595  -4.111
  264    HA   PRO  30           HA       PRO  30   7.450   4.024  -5.809
  265   1HB   PRO  30          HB1       PRO  30   7.649   2.070  -3.952
  266   2HB   PRO  30          HB2       PRO  30   8.552   3.586  -3.848
  267   1HG   PRO  30          HG1       PRO  30   6.001   2.808  -2.477
  268   2HG   PRO  30          HG2       PRO  30   7.436   3.600  -1.798
  269   1HD   PRO  30          HD1       PRO  30   5.228   4.982  -2.495
  270   2HD   PRO  30          HD2       PRO  30   6.860   5.663  -2.659
  271    H    ASN  31           HN       ASN  31   7.372   1.774  -6.587
  272    HA   ASN  31           HA       ASN  31   4.750   0.999  -7.386
  273   1HB   ASN  31          HB1       ASN  31   6.475   0.647  -8.957
  274   2HB   ASN  31          HB2       ASN  31   7.533  -0.102  -7.769
  275   1HD2  ASN  31          HD21      ASN  31   4.948  -0.657 -10.031
  276   2HD2  ASN  31          HD22      ASN  31   4.976  -2.383  -9.889
  277    H    LEU  32           HN       LEU  32   3.413  -0.533  -6.516
  278    HA   LEU  32           HA       LEU  32   4.074  -1.774  -3.955
  279   1HB   LEU  32          HB1       LEU  32   1.451  -1.024  -5.245
  280   2HB   LEU  32          HB2       LEU  32   1.570  -1.904  -3.735
  281    HG   LEU  32           HG       LEU  32   2.471   0.939  -4.255
  282   1HD1  LEU  32          HD11      LEU  32   0.831   1.420  -2.436
  283   2HD1  LEU  32          HD12      LEU  32   0.336  -0.272  -2.493
  284   3HD1  LEU  32          HD13      LEU  32   0.095   0.764  -3.899
  285   1HD2  LEU  32          HD21      LEU  32   4.101  -0.029  -2.758
  286   2HD2  LEU  32          HD22      LEU  32   2.827  -0.752  -1.775
  287   3HD2  LEU  32          HD23      LEU  32   3.015   1.001  -1.825
  288    H    HIS  33           HN       HIS  33   3.977  -2.741  -7.105
  289    HA   HIS  33           HA       HIS  33   2.621  -5.224  -7.081
  290   1HB   HIS  33          HB1       HIS  33   3.220  -3.716  -9.063
  291   2HB   HIS  33          HB2       HIS  33   4.840  -4.395  -8.949
  292    HD2  HIS  33           HD2      HIS  33   1.698  -6.579  -8.433
  293    HE1  HIS  33           HE1      HIS  33   3.399  -7.704 -12.161
  294    HE2  HIS  33           HE2      HIS  33   1.658  -8.296 -10.407
  295    H    GLY  34           HN       GLY  34   3.340  -6.507  -5.405
  296   1HA   GLY  34          HA1       GLY  34   4.690  -8.502  -5.078
  297   2HA   GLY  34          HA2       GLY  34   6.087  -7.567  -5.570
  298    H    ILE  35           HN       ILE  35   4.001  -5.823  -3.397
  299    HA   ILE  35           HA       ILE  35   6.023  -5.728  -1.443
  300    HB   ILE  35           HB       ILE  35   4.447  -4.648   0.071
  301   1HG1  ILE  35          HG11      ILE  35   2.392  -5.412  -1.968
  302   2HG1  ILE  35          HG12      ILE  35   2.258  -5.326  -0.214
  303   1HG2  ILE  35          HG21      ILE  35   4.659  -3.600  -2.740
  304   2HG2  ILE  35          HG22      ILE  35   5.789  -3.367  -1.407
  305   3HG2  ILE  35          HG23      ILE  35   4.190  -2.626  -1.346
  306   1HD1  ILE  35          HD11      ILE  35   0.899  -3.592  -1.194
  307   2HD1  ILE  35          HD12      ILE  35   2.264  -2.997  -2.140
  308   3HD1  ILE  35          HD13      ILE  35   2.275  -2.840  -0.384
  309    H    PHE  36           HN       PHE  36   3.093  -7.771  -1.495
  310    HA   PHE  36           HA       PHE  36   3.310  -8.881   1.034
  311   1HB   PHE  36          HB1       PHE  36   2.257 -10.175  -1.487
  312   2HB   PHE  36          HB2       PHE  36   1.987 -10.770   0.150
  313    HD1  PHE  36           HD1      PHE  36   1.293  -8.571   1.763
  314    HD2  PHE  36           HD2      PHE  36   0.331  -9.223  -2.379
  315    HE1  PHE  36           HE1      PHE  36  -0.662  -7.050   1.986
  316    HE2  PHE  36           HE2      PHE  36  -1.626  -7.702  -2.160
  317    HZ   PHE  36           HZ       PHE  36  -2.117  -6.606   0.019
  318    H    GLY  37           HN       GLY  37   4.923  -9.811   1.934
  319   1HA   GLY  37          HA1       GLY  37   6.306 -11.702   2.325
  320   2HA   GLY  37          HA2       GLY  37   6.533 -11.869   0.595
  321    H    ARG  38           HN       ARG  38   6.874  -8.628   1.186
  322    HA   ARG  38           HA       ARG  38   9.797  -8.781   1.560
  323   1HB   ARG  38          HB1       ARG  38   8.049  -7.153  -0.243
  324   2HB   ARG  38          HB2       ARG  38   9.506  -6.391   0.381
  325   1HG   ARG  38          HG1       ARG  38  10.902  -7.733  -0.839
  326   2HG   ARG  38          HG2       ARG  38   9.770  -9.088  -0.849
  327   1HD   ARG  38          HD1       ARG  38  10.116  -7.920  -3.079
  328   2HD   ARG  38          HD2       ARG  38   8.440  -8.084  -2.550
  329    HE   ARG  38           HE       ARG  38   8.616  -6.372  -1.707
  330   1HH1  ARG  38          HH21      ARG  38  10.909  -6.676  -4.262
  331   2HH1  ARG  38          HH22      ARG  38  10.597  -5.155  -4.925
  332   1HH2  ARG  38          HH11      ARG  38   8.855  -3.672  -2.577
  333   2HH2  ARG  38          HH12      ARG  38  10.232  -3.542  -3.583
  334    H    HIS  39           HN       HIS  39  10.674  -6.656   2.431
  335    HA   HIS  39           HA       HIS  39   9.179  -5.989   4.848
  336   1HB   HIS  39          HB1       HIS  39  12.027  -5.245   4.118
  337   2HB   HIS  39          HB2       HIS  39  11.288  -5.187   5.721
  338    HD2  HIS  39           HD2      HIS  39  10.702  -7.597   6.904
  339    HE1  HIS  39           HE1      HIS  39  13.140  -9.961   4.341
  340    HE2  HIS  39           HE2      HIS  39  11.745  -9.955   6.463
  341    H    SER  40           HN       SER  40   9.251  -3.648   5.582
  342    HA   SER  40           HA       SER  40   8.222  -1.935   3.592
  343   1HB   SER  40          HB1       SER  40   9.266  -0.858   6.193
  344   2HB   SER  40          HB2       SER  40   7.906  -0.296   5.232
  345    HG   SER  40           HG       SER  40   7.093  -2.571   5.828
  346    H    GLY  41           HN       GLY  41   9.092  -0.372   2.382
  347   1HA   GLY  41          HA1       GLY  41  10.669   1.161   1.627
  348   2HA   GLY  41          HA2       GLY  41  11.760   0.646   2.891
  349    H    GLN  42           HN       GLN  42  10.369  -1.319   0.158
  350    HA   GLN  42           HA       GLN  42  13.133  -1.680  -0.755
  351   1HB   GLN  42          HB1       GLN  42  11.104  -3.896  -0.623
  352   2HB   GLN  42          HB2       GLN  42  12.764  -4.036  -1.189
  353   1HG   GLN  42          HG1       GLN  42  13.585  -3.416   1.040
  354   2HG   GLN  42          HG2       GLN  42  11.926  -3.266   1.612
  355   1HE2  GLN  42          HE21      GLN  42  14.103  -5.080   2.524
  356   2HE2  GLN  42          HE22      GLN  42  13.478  -6.677   2.342
  357    H    ALA  43           HN       ALA  43  11.311   0.179  -2.103
  358    HA   ALA  43           HA       ALA  43  10.378  -0.974  -4.523
  359   1HB   ALA  43          HB1       ALA  43   9.869   1.230  -5.202
  360   2HB   ALA  43          HB2       ALA  43  11.059   1.921  -4.100
  361   3HB   ALA  43          HB3       ALA  43   9.604   1.160  -3.460
  362    H    GLU  44           HN       GLU  44  11.276  -1.334  -6.458
  363    HA   GLU  44           HA       GLU  44  14.086  -1.254  -6.824
  364   1HB   GLU  44          HB1       GLU  44  12.054  -1.993  -8.943
  365   2HB   GLU  44          HB2       GLU  44  13.730  -2.518  -8.818
  366   1HG   GLU  44          HG1       GLU  44  12.577  -4.379  -8.050
  367   2HG   GLU  44          HG2       GLU  44  13.026  -3.568  -6.563
  368    H    GLY  45           HN       GLY  45  14.349   1.075  -6.531
  369   1HA   GLY  45          HA1       GLY  45  15.503   2.692  -7.991
  370   2HA   GLY  45          HA2       GLY  45  14.111   2.608  -9.048
  371    H    TYR  46           HN       TYR  46  13.539   2.765  -5.611
  372    HA   TYR  46           HA       TYR  46  13.087   5.636  -5.631
  373   1HB   TYR  46          HB1       TYR  46  11.016   4.659  -6.423
  374   2HB   TYR  46          HB2       TYR  46  10.928   3.635  -4.997
  375    HD1  TYR  46           HD1      TYR  46  10.305   6.954  -6.376
  376    HD2  TYR  46           HD2      TYR  46  10.540   4.651  -2.758
  377    HE1  TYR  46           HE1      TYR  46   8.934   8.675  -5.208
  378    HE2  TYR  46           HE2      TYR  46   9.077   6.303  -1.601
  379    HH   TYR  46           HH       TYR  46   7.369   8.763  -3.322
  380    H    SER  47           HN       SER  47  13.354   6.674  -3.728
  381    HA   SER  47           HA       SER  47  14.480   5.191  -1.497
  382   1HB   SER  47          HB1       SER  47  14.532   7.963  -0.947
  383   2HB   SER  47          HB2       SER  47  15.878   6.927  -1.429
  384    HG   SER  47           HG       SER  47  15.848   7.860  -3.301
  385    H    TYR  48           HN       TYR  48  13.827   5.303   0.573
  386    HA   TYR  48           HA       TYR  48  11.133   6.219   1.269
  387   1HB   TYR  48          HB1       TYR  48  12.795   3.845   2.107
  388   2HB   TYR  48          HB2       TYR  48  11.324   4.315   2.955
  389    HD1  TYR  48           HD1      TYR  48   9.150   4.029   1.975
  390    HD2  TYR  48           HD2      TYR  48  12.692   2.975  -0.223
  391    HE1  TYR  48           HE1      TYR  48   7.771   2.662   0.422
  392    HE2  TYR  48           HE2      TYR  48  11.323   1.606  -1.782
  393    HH   TYR  48           HH       TYR  48   8.352   0.469  -1.012
  394    H    THR  49           HN       THR  49  10.820   6.841   3.637
  395    HA   THR  49           HA       THR  49  12.779   8.719   4.555
  396    HB   THR  49           HB       THR  49  11.177   8.766   6.616
  397    HG1  THR  49           HG1      THR  49   9.291   7.856   4.769
  398   1HG2  THR  49          HG21      THR  49  11.364  10.589   5.067
  399   2HG2  THR  49          HG22      THR  49   9.662  10.290   5.418
  400   3HG2  THR  49          HG23      THR  49  10.358   9.741   3.892
  401    H    ASP  50           HN       ASP  50  13.401   8.855   6.895
  402    HA   ASP  50           HA       ASP  50  15.006   6.743   7.724
  403   1HB   ASP  50          HB1       ASP  50  15.561   8.919   8.428
  404   2HB   ASP  50          HB2       ASP  50  13.946   9.223   9.063
  405    H    ALA  51           HN       ALA  51  11.653   7.412   8.490
  406    HA   ALA  51           HA       ALA  51  11.506   5.583  10.709
  407   1HB   ALA  51          HB1       ALA  51   9.257   6.401  10.965
  408   2HB   ALA  51          HB2       ALA  51   9.308   7.158   9.373
  409   3HB   ALA  51          HB3       ALA  51  10.337   7.766  10.669
  410    H    ASN  52           HN       ASN  52  10.501   5.471   7.268
  411    HA   ASN  52           HA       ASN  52   8.882   3.127   7.639
  412   1HB   ASN  52          HB1       ASN  52   8.129   4.456   5.895
  413   2HB   ASN  52          HB2       ASN  52   9.751   4.778   5.295
  414   1HD2  ASN  52          HD21      ASN  52   7.016   2.631   5.083
  415   2HD2  ASN  52          HD22      ASN  52   7.651   1.754   3.739
  416    H    ILE  53           HN       ILE  53  12.195   3.709   6.545
  417    HA   ILE  53           HA       ILE  53  12.766   1.045   5.778
  418    HB   ILE  53           HB       ILE  53  14.615   3.282   6.562
  419   1HG1  ILE  53          HG11      ILE  53  13.778   2.337   3.798
  420   2HG1  ILE  53          HG12      ILE  53  13.095   3.741   4.615
  421   1HG2  ILE  53          HG21      ILE  53  15.887   1.252   6.699
  422   2HG2  ILE  53          HG22      ILE  53  16.307   2.024   5.170
  423   3HG2  ILE  53          HG23      ILE  53  15.201   0.651   5.188
  424   1HD1  ILE  53          HD11      ILE  53  15.232   4.872   4.565
  425   2HD1  ILE  53          HD12      ILE  53  14.830   4.323   2.938
  426   3HD1  ILE  53          HD13      ILE  53  16.015   3.439   3.898
  427    H    LYS  54           HN       LYS  54  14.247   2.706   8.618
  428    HA   LYS  54           HA       LYS  54  15.019   0.719  10.203
  429   1HB   LYS  54          HB1       LYS  54  13.555   3.244  10.882
  430   2HB   LYS  54          HB2       LYS  54  14.098   2.146  12.153
  431   1HG   LYS  54          HG1       LYS  54  16.355   2.284  10.679
  432   2HG   LYS  54          HG2       LYS  54  15.683   3.885  10.359
  433   1HD   LYS  54          HD1       LYS  54  15.444   3.276  13.162
  434   2HD   LYS  54          HD2       LYS  54  17.121   3.056  12.637
  435   1HE   LYS  54          HE1       LYS  54  16.722   5.377  13.347
  436   2HE   LYS  54          HE2       LYS  54  17.103   5.293  11.625
  437   1HZ   LYS  54          HZ1       LYS  54  14.405   5.579  12.817
  438   2HZ   LYS  54          HZ2       LYS  54  14.715   5.363  11.165
  439   3HZ   LYS  54          HZ3       LYS  54  15.266   6.757  11.952
  440    H    LYS  55           HN       LYS  55  11.744   1.033   9.250
  441    HA   LYS  55           HA       LYS  55  10.579  -0.395  11.483
  442   1HB   LYS  55          HB1       LYS  55   9.502   1.513  10.301
  443   2HB   LYS  55          HB2       LYS  55   9.313   0.492   8.895
  444   1HG   LYS  55          HG1       LYS  55   7.223   0.600   9.951
  445   2HG   LYS  55          HG2       LYS  55   7.863  -1.002  10.274
  446   1HD   LYS  55          HD1       LYS  55   8.371  -0.394  12.552
  447   2HD   LYS  55          HD2       LYS  55   7.954   1.290  12.242
  448   1HE   LYS  55          HE1       LYS  55   6.110   0.313  13.404
  449   2HE   LYS  55          HE2       LYS  55   5.612   0.508  11.722
  450   1HZ   LYS  55          HZ1       LYS  55   6.200  -1.853  11.368
  451   2HZ   LYS  55          HZ2       LYS  55   4.954  -1.647  12.487
  452   3HZ   LYS  55          HZ3       LYS  55   6.515  -2.003  13.027
  453    H    ASN  56           HN       ASN  56  11.467  -1.181   8.193
  454    HA   ASN  56           HA       ASN  56  11.122  -2.938   6.808
  455   1HB   ASN  56          HB1       ASN  56  12.998  -3.548   8.974
  456   2HB   ASN  56          HB2       ASN  56  12.454  -4.958   8.092
  457   1HD2  ASN  56          HD21      ASN  56  14.017  -1.743   7.569
  458   2HD2  ASN  56          HD22      ASN  56  14.562  -2.320   6.055
  459    H    VAL  57           HN       VAL  57   8.667  -2.779   8.003
  460    HA   VAL  57           HA       VAL  57   7.870  -5.177   9.307
  461    HB   VAL  57           HB       VAL  57   6.636  -2.702   8.557
  462   1HG1  VAL  57          HG11      VAL  57   4.819  -5.082   8.193
  463   2HG1  VAL  57          HG12      VAL  57   5.285  -3.951   6.924
  464   3HG1  VAL  57          HG13      VAL  57   4.324  -3.392   8.293
  465   1HG2  VAL  57          HG21      VAL  57   6.972  -3.479  10.800
  466   2HG2  VAL  57          HG22      VAL  57   5.963  -4.895  10.502
  467   3HG2  VAL  57          HG23      VAL  57   5.243  -3.286  10.506
  468    H    LEU  58           HN       LEU  58   7.344  -7.124   8.486
  469    HA   LEU  58           HA       LEU  58   7.741  -7.578   5.689
  470   1HB   LEU  58          HB1       LEU  58   8.498  -9.199   7.380
  471   2HB   LEU  58          HB2       LEU  58   6.828  -9.494   7.846
  472    HG   LEU  58           HG       LEU  58   6.461 -10.157   5.358
  473   1HD1  LEU  58          HD11      LEU  58   8.483 -11.035   4.254
  474   2HD1  LEU  58          HD12      LEU  58   9.469 -10.381   5.562
  475   3HD1  LEU  58          HD13      LEU  58   8.576  -9.290   4.504
  476   1HD2  LEU  58          HD21      LEU  58   7.196 -12.454   5.719
  477   2HD2  LEU  58          HD22      LEU  58   6.457 -11.821   7.189
  478   3HD2  LEU  58          HD23      LEU  58   8.211 -11.940   7.067
  479    H    TRP  59           HN       TRP  59   6.257  -6.698   4.409
  480    HA   TRP  59           HA       TRP  59   3.567  -6.245   4.957
  481   1HB   TRP  59          HB1       TRP  59   5.027  -6.541   2.336
  482   2HB   TRP  59          HB2       TRP  59   3.365  -5.995   2.462
  483    HD1  TRP  59           HD1      TRP  59   6.515  -4.597   1.804
  484    HE1  TRP  59           HE1      TRP  59   6.696  -2.135   2.551
  485    HE3  TRP  59           HE3      TRP  59   2.421  -4.302   4.856
  486    HZ2  TRP  59           HZ2      TRP  59   5.387  -0.326   4.338
  487    HZ3  TRP  59           HZ3      TRP  59   1.900  -2.199   6.033
  488    HH2  TRP  59           HH2      TRP  59   3.350  -0.216   5.790
  489    H    ASP  60           HN       ASP  60   2.236  -7.769   5.500
  490    HA   ASP  60           HA       ASP  60   1.690 -10.090   3.814
  491   1HB   ASP  60          HB1       ASP  60   1.933 -11.541   5.541
  492   2HB   ASP  60          HB2       ASP  60   2.964 -10.280   6.188
  493    H    GLU  61           HN       GLU  61  -0.543 -10.993   5.190
  494    HA   GLU  61           HA       GLU  61  -2.608  -9.304   4.252
  495   1HB   GLU  61          HB1       GLU  61  -2.430 -11.967   5.078
  496   2HB   GLU  61          HB2       GLU  61  -3.504 -11.223   6.259
  497   1HG   GLU  61          HG1       GLU  61  -4.958 -11.975   4.591
  498   2HG   GLU  61          HG2       GLU  61  -4.758 -10.260   4.221
  499    H    ASN  62           HN       ASN  62  -1.400  -9.967   7.541
  500    HA   ASN  62           HA       ASN  62  -3.201  -8.114   8.784
  501   1HB   ASN  62          HB1       ASN  62  -2.534 -10.092   9.966
  502   2HB   ASN  62          HB2       ASN  62  -0.831  -9.696   9.788
  503   1HD2  ASN  62          HD21      ASN  62   0.005  -7.935  11.029
  504   2HD2  ASN  62          HD22      ASN  62  -0.799  -7.419  12.468
  505    H    ASN  63           HN       ASN  63   0.372  -8.013   8.208
  506    HA   ASN  63           HA       ASN  63   0.844  -5.487   9.244
  507   1HB   ASN  63          HB1       ASN  63   2.212  -7.180   7.190
  508   2HB   ASN  63          HB2       ASN  63   2.822  -5.576   7.546
  509   1HD2  ASN  63          HD21      ASN  63   2.344  -8.821   8.878
  510   2HD2  ASN  63          HD22      ASN  63   3.222  -8.394  10.306
  511    H    MET  64           HN       MET  64  -0.056  -6.146   5.782
  512    HA   MET  64           HA       MET  64   0.117  -3.447   4.989
  513   1HB   MET  64          HB1       MET  64   0.110  -5.006   3.261
  514   2HB   MET  64          HB2       MET  64  -1.307  -5.840   3.884
  515   1HG   MET  64          HG1       MET  64  -1.650  -3.024   3.043
  516   2HG   MET  64          HG2       MET  64  -1.369  -4.205   1.778
  517   1HE   MET  64          HE1       MET  64  -4.440  -6.675   2.828
  518   2HE   MET  64          HE2       MET  64  -2.931  -6.587   3.739
  519   3HE   MET  64          HE3       MET  64  -2.894  -6.636   1.976
  520    H    SER  65           HN       SER  65  -2.674  -5.223   6.339
  521    HA   SER  65           HA       SER  65  -4.578  -3.176   6.105
  522   1HB   SER  65          HB1       SER  65  -4.540  -5.252   8.289
  523   2HB   SER  65          HB2       SER  65  -5.936  -4.419   7.619
  524    HG   SER  65           HG       SER  65  -4.398  -6.495   6.532
  525    H    GLU  66           HN       GLU  66  -2.283  -3.825   8.737
  526    HA   GLU  66           HA       GLU  66  -3.137  -2.043  10.660
  527   1HB   GLU  66          HB1       GLU  66  -0.348  -2.898   9.852
  528   2HB   GLU  66          HB2       GLU  66  -0.691  -1.981  11.315
  529   1HG   GLU  66          HG1       GLU  66  -2.201  -3.815  12.055
  530   2HG   GLU  66          HG2       GLU  66  -1.699  -4.745  10.643
  531    H    TYR  67           HN       TYR  67  -0.590  -1.361   8.277
  532    HA   TYR  67           HA       TYR  67  -0.231   1.342   8.652
  533   1HB   TYR  67          HB1       TYR  67   1.328  -0.013   7.452
  534   2HB   TYR  67          HB2       TYR  67   0.135  -0.405   6.228
  535    HD1  TYR  67           HD1      TYR  67   0.029   0.839   4.236
  536    HD2  TYR  67           HD2      TYR  67   2.055   2.449   7.665
  537    HE1  TYR  67           HE1      TYR  67   1.012   2.627   2.808
  538    HE2  TYR  67           HE2      TYR  67   3.090   4.210   6.248
  539    HH   TYR  67           HH       TYR  67   2.141   4.767   2.970
  540    H    LEU  68           HN       LEU  68  -2.531  -0.182   6.306
  541    HA   LEU  68           HA       LEU  68  -3.332   2.173   5.061
  542   1HB   LEU  68          HB1       LEU  68  -4.962  -0.295   5.629
  543   2HB   LEU  68          HB2       LEU  68  -5.429   0.977   4.515
  544    HG   LEU  68           HG       LEU  68  -3.036  -0.859   4.239
  545   1HD1  LEU  68          HD11      LEU  68  -4.309  -1.705   2.330
  546   2HD1  LEU  68          HD12      LEU  68  -5.592  -0.537   2.646
  547   3HD1  LEU  68          HD13      LEU  68  -5.268  -1.826   3.805
  548   1HD2  LEU  68          HD21      LEU  68  -4.001   1.271   2.304
  549   2HD2  LEU  68          HD22      LEU  68  -2.638   0.176   2.075
  550   3HD2  LEU  68          HD23      LEU  68  -2.564   1.428   3.315
  551    H    THR  69           HN       THR  69  -4.578   0.876   8.153
  552    HA   THR  69           HA       THR  69  -6.798   2.576   8.390
  553    HB   THR  69           HB       THR  69  -5.590   1.972  10.958
  554    HG1  THR  69           HG1      THR  69  -4.694   0.205  10.043
  555   1HG2  THR  69          HG21      THR  69  -7.713   0.702  11.249
  556   2HG2  THR  69          HG22      THR  69  -8.130   1.077   9.577
  557   3HG2  THR  69          HG23      THR  69  -7.976   2.376  10.760
  558    H    ASN  70           HN       ASN  70  -3.420   3.124   9.361
  559    HA   ASN  70           HA       ASN  70  -3.794   5.953   9.259
  560   1HB   ASN  70          HB1       ASN  70  -4.654   5.307  11.565
  561   2HB   ASN  70          HB2       ASN  70  -2.994   4.884  11.969
  562   1HD2  ASN  70          HD21      ASN  70  -4.657   6.954  13.165
  563   2HD2  ASN  70          HD22      ASN  70  -3.603   8.314  13.011
  564    HA   PRO  71           HA       PRO  71   0.423   4.661   7.920
  565   1HB   PRO  71          HB1       PRO  71   0.738   6.902   6.343
  566   2HB   PRO  71          HB2       PRO  71   0.044   5.375   5.791
  567   1HG   PRO  71          HG1       PRO  71  -1.337   7.873   6.682
  568   2HG   PRO  71          HG2       PRO  71  -1.738   6.788   5.338
  569   1HD   PRO  71          HD1       PRO  71  -3.095   6.719   7.652
  570   2HD   PRO  71          HD2       PRO  71  -2.758   5.239   6.729
  571    H    LYS  72           HN       LYS  72  -0.613   7.934   8.853
  572    HA   LYS  72           HA       LYS  72   1.898   8.969   9.570
  573   1HB   LYS  72          HB1       LYS  72  -0.924   9.745  10.198
  574   2HB   LYS  72          HB2       LYS  72   0.400  10.539  11.035
  575   1HG   LYS  72          HG1       LYS  72   1.314  10.973   8.636
  576   2HG   LYS  72          HG2       LYS  72  -0.343  10.646   8.140
  577   1HD   LYS  72          HD1       LYS  72   0.577  12.806  10.045
  578   2HD   LYS  72          HD2       LYS  72  -0.004  13.036   8.396
  579   1HE   LYS  72          HE1       LYS  72  -2.210  12.390   8.983
  580   2HE   LYS  72          HE2       LYS  72  -1.691  11.760  10.539
  581   1HZ   LYS  72          HZ1       LYS  72  -1.133  14.100  11.145
  582   2HZ   LYS  72          HZ2       LYS  72  -2.780  13.806  10.909
  583   3HZ   LYS  72          HZ3       LYS  72  -1.892  14.594   9.709
  584    H    LYS  73           HN       LYS  73  -0.466   7.151  11.463
  585    HA   LYS  73           HA       LYS  73   1.031   7.491  13.904
  586   1HB   LYS  73          HB1       LYS  73  -1.373   7.307  14.059
  587   2HB   LYS  73          HB2       LYS  73  -1.343   5.732  13.280
  588   1HG   LYS  73          HG1       LYS  73  -1.586   5.155  15.502
  589   2HG   LYS  73          HG2       LYS  73   0.156   5.037  15.292
  590   1HD   LYS  73          HD1       LYS  73  -1.192   7.512  16.380
  591   2HD   LYS  73          HD2       LYS  73  -0.667   6.185  17.414
  592   1HE   LYS  73          HE1       LYS  73   1.106   7.836  15.604
  593   2HE   LYS  73          HE2       LYS  73   0.997   7.984  17.355
  594   1HZ   LYS  73          HZ1       LYS  73   2.893   6.704  16.914
  595   2HZ   LYS  73          HZ2       LYS  73   2.097   5.734  15.783
  596   3HZ   LYS  73          HZ3       LYS  73   1.721   5.592  17.425
  597    H    TYR  74           HN       TYR  74   0.680   4.883  11.527
  598    HA   TYR  74           HA       TYR  74   2.258   2.982  12.927
  599   1HB   TYR  74          HB1       TYR  74   0.532   2.641  11.045
  600   2HB   TYR  74          HB2       TYR  74   1.869   3.002   9.951
  601    HD1  TYR  74           HD1      TYR  74   3.076   1.149   9.118
  602    HD2  TYR  74           HD2      TYR  74   1.214   0.966  12.989
  603    HE1  TYR  74           HE1      TYR  74   3.793  -1.232   9.350
  604    HE2  TYR  74           HE2      TYR  74   1.912  -1.401  13.232
  605    HH   TYR  74           HH       TYR  74   2.442  -3.322  11.603
  606    H    ILE  75           HN       ILE  75   3.031   5.274  10.370
  607    HA   ILE  75           HA       ILE  75   5.907   4.885  10.829
  608    HB   ILE  75           HB       ILE  75   4.725   5.632   8.151
  609   1HG1  ILE  75          HG11      ILE  75   4.150   3.230   9.054
  610   2HG1  ILE  75          HG12      ILE  75   4.772   3.407   7.420
  611   1HG2  ILE  75          HG21      ILE  75   7.057   4.810   7.451
  612   2HG2  ILE  75          HG22      ILE  75   7.464   4.866   9.166
  613   3HG2  ILE  75          HG23      ILE  75   6.978   6.339   8.327
  614   1HD1  ILE  75          HD11      ILE  75   6.369   2.563   9.844
  615   2HD1  ILE  75          HD12      ILE  75   7.012   2.755   8.214
  616   3HD1  ILE  75          HD13      ILE  75   5.806   1.512   8.545
  617    HA   PRO  76           HA       PRO  76   4.753   9.182  12.021
  618   1HB   PRO  76          HB1       PRO  76   6.735   9.403  13.881
  619   2HB   PRO  76          HB2       PRO  76   5.151   8.700  14.221
  620   1HG   PRO  76          HG1       PRO  76   7.743   7.334  13.620
  621   2HG   PRO  76          HG2       PRO  76   6.508   6.915  14.821
  622   1HD   PRO  76          HD1       PRO  76   6.730   5.625  12.455
  623   2HD   PRO  76          HD2       PRO  76   5.170   5.866  13.265
  624    H    GLY  77           HN       GLY  77   5.405  10.255  10.180
  625   1HA   GLY  77          HA1       GLY  77   6.935  12.013   9.522
  626   2HA   GLY  77          HA2       GLY  77   8.260  10.967   9.994
  627    H    THR  78           HN       THR  78   5.786   9.337   8.262
  628    HA   THR  78           HA       THR  78   7.490   8.808   6.012
  629    HB   THR  78           HB       THR  78   5.745   7.295   7.274
  630    HG1  THR  78           HG1      THR  78   6.999   7.152   4.948
  631   1HG2  THR  78          HG21      THR  78   4.090   8.275   4.948
  632   2HG2  THR  78          HG22      THR  78   3.683   8.403   6.659
  633   3HG2  THR  78          HG23      THR  78   3.765   6.818   5.889
  634    H    LYS  79           HN       LYS  79   6.973   9.069   3.804
  635    HA   LYS  79           HA       LYS  79   5.962  11.670   3.152
  636   1HB   LYS  79          HB1       LYS  79   6.765   9.416   1.309
  637   2HB   LYS  79          HB2       LYS  79   6.584  11.106   0.866
  638   1HG   LYS  79          HG1       LYS  79   8.462  11.618   2.480
  639   2HG   LYS  79          HG2       LYS  79   8.718   9.869   2.599
  640   1HD   LYS  79          HD1       LYS  79   8.472  10.526  -0.167
  641   2HD   LYS  79          HD2       LYS  79   9.629  11.653   0.555
  642   1HE   LYS  79          HE1       LYS  79  11.035   9.900   0.043
  643   2HE   LYS  79          HE2       LYS  79  10.562   9.458   1.683
  644   1HZ   LYS  79          HZ1       LYS  79   9.378   7.702   0.962
  645   2HZ   LYS  79          HZ2       LYS  79  10.401   7.801  -0.378
  646   3HZ   LYS  79          HZ3       LYS  79   8.857   8.478  -0.453
  647    H    MET  80           HN       MET  80   4.230   8.764   3.590
  648    HA   MET  80           HA       MET  80   2.336   9.252   1.469
  649   1HB   MET  80          HB1       MET  80   2.611   6.984   1.694
  650   2HB   MET  80          HB2       MET  80   2.725   7.059   3.456
  651   1HG   MET  80          HG1       MET  80   0.457   7.198   3.748
  652   2HG   MET  80          HG2       MET  80   0.180   7.884   2.159
  653   1HE   MET  80          HE1       MET  80  -1.853   4.434   2.703
  654   2HE   MET  80          HE2       MET  80  -2.065   6.169   2.468
  655   3HE   MET  80          HE3       MET  80  -1.322   5.564   3.948
  656    H    ALA  81           HN       ALA  81   1.607  11.266   1.961
  657    HA   ALA  81           HA       ALA  81   0.227  11.879   4.390
  658   1HB   ALA  81          HB1       ALA  81   0.048  14.105   3.499
  659   2HB   ALA  81          HB2       ALA  81   0.561  13.542   1.909
  660   3HB   ALA  81          HB3       ALA  81   1.683  13.483   3.268
  661    H    PHE  82           HN       PHE  82  -1.032   9.834   3.104
  662    HA   PHE  82           HA       PHE  82  -3.470  10.593   1.827
  663   1HB   PHE  82          HB1       PHE  82  -2.364   8.684   0.975
  664   2HB   PHE  82          HB2       PHE  82  -2.251   7.945   2.567
  665    HD1  PHE  82           HD1      PHE  82  -4.700   8.988  -0.064
  666    HD2  PHE  82           HD2      PHE  82  -3.907   6.469   3.333
  667    HE1  PHE  82           HE1      PHE  82  -6.893   7.855  -0.389
  668    HE2  PHE  82           HE2      PHE  82  -6.101   5.347   3.017
  669    HZ   PHE  82           HZ       PHE  82  -7.603   6.055   1.168
  670    H    GLY  83           HN       GLY  83  -2.637  10.180   5.152
  671   1HA   GLY  83          HA1       GLY  83  -4.015  10.530   6.993
  672   2HA   GLY  83          HA2       GLY  83  -5.393  10.592   5.918
  673    H    GLY  84           HN       GLY  84  -5.215   8.008   4.781
  674   1HA   GLY  84          HA1       GLY  84  -5.157   5.689   5.293
  675   2HA   GLY  84          HA2       GLY  84  -5.274   6.085   6.998
  676    H    LEU  85           HN       LEU  85  -6.881   4.472   4.853
  677    HA   LEU  85           HA       LEU  85  -9.542   5.546   4.939
  678   1HB   LEU  85          HB1       LEU  85  -8.323   3.025   3.856
  679   2HB   LEU  85          HB2       LEU  85 -10.061   3.203   3.959
  680    HG   LEU  85           HG       LEU  85  -8.207   4.985   2.356
  681   1HD1  LEU  85          HD11      LEU  85  -9.269   3.910   0.425
  682   2HD1  LEU  85          HD12      LEU  85 -10.214   2.886   1.506
  683   3HD1  LEU  85          HD13      LEU  85  -8.460   2.716   1.441
  684   1HD2  LEU  85          HD21      LEU  85 -10.205   6.229   3.081
  685   2HD2  LEU  85          HD22      LEU  85 -11.235   4.933   2.471
  686   3HD2  LEU  85          HD23      LEU  85 -10.263   5.887   1.351
  687    H    LYS  86           HN       LYS  86 -10.399   5.649   6.822
  688    HA   LYS  86           HA       LYS  86 -10.178   3.834   8.993
  689   1HB   LYS  86          HB1       LYS  86 -12.163   6.087   8.708
  690   2HB   LYS  86          HB2       LYS  86 -11.520   5.396  10.191
  691   1HG   LYS  86          HG1       LYS  86  -9.689   6.720   8.210
  692   2HG   LYS  86          HG2       LYS  86 -10.601   7.677   9.380
  693   1HD   LYS  86          HD1       LYS  86  -9.587   6.420  11.223
  694   2HD   LYS  86          HD2       LYS  86  -8.710   5.413  10.073
  695   1HE   LYS  86          HE1       LYS  86  -8.378   8.410  10.188
  696   2HE   LYS  86          HE2       LYS  86  -7.404   7.314  11.165
  697   1HZ   LYS  86          HZ1       LYS  86  -6.284   7.930   9.114
  698   2HZ   LYS  86          HZ2       LYS  86  -7.559   7.300   8.201
  699   3HZ   LYS  86          HZ3       LYS  86  -6.612   6.267   9.146
  700    H    LYS  87           HN       LYS  87 -11.723   3.131   6.322
  701    HA   LYS  87           HA       LYS  87 -14.191   2.051   7.520
  702   1HB   LYS  87          HB1       LYS  87 -13.747   1.926   4.610
  703   2HB   LYS  87          HB2       LYS  87 -15.212   2.234   5.502
  704   1HG   LYS  87          HG1       LYS  87 -14.872   4.557   5.489
  705   2HG   LYS  87          HG2       LYS  87 -13.115   4.390   5.189
  706   1HD   LYS  87          HD1       LYS  87 -13.696   3.093   3.145
  707   2HD   LYS  87          HD2       LYS  87 -15.358   3.511   3.384
  708   1HE   LYS  87          HE1       LYS  87 -15.007   5.684   2.549
  709   2HE   LYS  87          HE2       LYS  87 -13.241   5.525   2.683
  710   1HZ   LYS  87          HZ1       LYS  87 -15.041   3.949   0.915
  711   2HZ   LYS  87          HZ2       LYS  87 -13.416   3.571   1.161
  712   3HZ   LYS  87          HZ3       LYS  87 -13.837   5.039   0.423
  713    H    GLU  88           HN       GLU  88 -13.660   0.036   8.255
  714    HA   GLU  88           HA       GLU  88 -11.822  -1.777   7.263
  715   1HB   GLU  88          HB1       GLU  88 -12.912  -1.816   9.490
  716   2HB   GLU  88          HB2       GLU  88 -14.375  -2.429   8.726
  717   1HG   GLU  88          HG1       GLU  88 -12.959  -4.358   7.854
  718   2HG   GLU  88          HG2       GLU  88 -11.697  -3.799   8.961
  719    H    LYS  89           HN       LYS  89 -15.348  -1.824   6.561
  720    HA   LYS  89           HA       LYS  89 -15.415  -4.124   5.024
  721   1HB   LYS  89          HB1       LYS  89 -17.166  -1.772   4.386
  722   2HB   LYS  89          HB2       LYS  89 -17.568  -3.487   4.406
  723   1HG   LYS  89          HG1       LYS  89 -16.720  -2.161   6.943
  724   2HG   LYS  89          HG2       LYS  89 -18.359  -1.917   6.353
  725   1HD   LYS  89          HD1       LYS  89 -18.517  -3.729   7.858
  726   2HD   LYS  89          HD2       LYS  89 -18.501  -4.489   6.258
  727   1HE   LYS  89          HE1       LYS  89 -16.434  -5.396   6.556
  728   2HE   LYS  89          HE2       LYS  89 -15.848  -4.014   7.481
  729   1HZ   LYS  89          HZ1       LYS  89 -17.104  -6.463   8.397
  730   2HZ   LYS  89          HZ2       LYS  89 -17.603  -5.054   9.186
  731   3HZ   LYS  89          HZ3       LYS  89 -15.965  -5.466   9.166
  732    H    ASP  90           HN       ASP  90 -14.748  -0.869   4.061
  733    HA   ASP  90           HA       ASP  90 -14.459  -1.079   1.326
  734   1HB   ASP  90          HB1       ASP  90 -14.635   0.916   2.967
  735   2HB   ASP  90          HB2       ASP  90 -12.890   0.782   3.088
  736    H    ARG  91           HN       ARG  91 -11.884  -1.374   3.868
  737    HA   ARG  91           HA       ARG  91  -9.804  -1.936   2.025
  738   1HB   ARG  91          HB1       ARG  91  -9.777  -2.913   4.883
  739   2HB   ARG  91          HB2       ARG  91  -8.399  -2.590   3.838
  740   1HG   ARG  91          HG1       ARG  91  -8.789  -0.234   3.926
  741   2HG   ARG  91          HG2       ARG  91 -10.327  -0.461   4.743
  742   1HD   ARG  91          HD1       ARG  91  -7.569  -0.957   5.870
  743   2HD   ARG  91          HD2       ARG  91  -8.669   0.339   6.308
  744    HE   ARG  91           HE       ARG  91  -9.863  -1.493   6.373
  745   1HH1  ARG  91          HH21      ARG  91  -6.819  -1.059   7.992
  746   2HH1  ARG  91          HH22      ARG  91  -7.079  -1.844   9.510
  747   1HH2  ARG  91          HH11      ARG  91 -10.319  -2.762   8.840
  748   2HH2  ARG  91          HH12      ARG  91  -9.045  -2.756  10.006
  749    H    ASN  92           HN       ASN  92 -12.086  -4.095   3.650
  750    HA   ASN  92           HA       ASN  92 -11.018  -6.556   3.241
  751   1HB   ASN  92          HB1       ASN  92 -13.885  -5.661   2.950
  752   2HB   ASN  92          HB2       ASN  92 -13.407  -7.351   2.931
  753   1HD2  ASN  92          HD21      ASN  92 -15.196  -6.403   4.767
  754   2HD2  ASN  92          HD22      ASN  92 -14.402  -6.676   6.281
  755    H    ASP  93           HN       ASP  93 -13.108  -4.999   0.756
  756    HA   ASP  93           HA       ASP  93 -12.518  -6.793  -1.318
  757   1HB   ASP  93          HB1       ASP  93 -14.271  -4.740  -1.023
  758   2HB   ASP  93          HB2       ASP  93 -13.109  -4.014  -2.122
  759    H    LEU  94           HN       LEU  94 -10.833  -3.729  -0.431
  760    HA   LEU  94           HA       LEU  94  -9.135  -3.467  -2.564
  761   1HB   LEU  94          HB1       LEU  94  -9.337  -2.491   0.186
  762   2HB   LEU  94          HB2       LEU  94  -7.717  -2.576  -0.403
  763    HG   LEU  94           HG       LEU  94  -9.852  -1.206  -2.006
  764   1HD1  LEU  94          HD11      LEU  94  -9.790  -0.263   0.283
  765   2HD1  LEU  94          HD12      LEU  94  -9.258   0.889  -0.947
  766   3HD1  LEU  94          HD13      LEU  94  -8.070   0.075   0.070
  767   1HD2  LEU  94          HD21      LEU  94  -6.914  -0.532  -1.862
  768   2HD2  LEU  94          HD22      LEU  94  -8.105   0.045  -3.025
  769   3HD2  LEU  94          HD23      LEU  94  -7.584  -1.640  -3.061
  770    H    ILE  95           HN       ILE  95  -8.703  -5.520   0.302
  771    HA   ILE  95           HA       ILE  95  -6.059  -6.354  -0.189
  772    HB   ILE  95           HB       ILE  95  -8.265  -7.742   1.350
  773   1HG1  ILE  95          HG11      ILE  95  -6.013  -5.999   2.397
  774   2HG1  ILE  95          HG12      ILE  95  -7.634  -5.392   2.072
  775   1HG2  ILE  95          HG21      ILE  95  -6.373  -9.264   0.779
  776   2HG2  ILE  95          HG22      ILE  95  -6.529  -8.974   2.511
  777   3HG2  ILE  95          HG23      ILE  95  -5.274  -8.146   1.590
  778   1HD1  ILE  95          HD11      ILE  95  -7.178  -7.709   3.932
  779   2HD1  ILE  95          HD12      ILE  95  -8.577  -6.641   3.820
  780   3HD1  ILE  95          HD13      ILE  95  -7.060  -6.038   4.486
  781    H    THR  96           HN       THR  96  -9.186  -7.872  -1.054
  782    HA   THR  96           HA       THR  96  -8.294 -10.131  -2.373
  783    HB   THR  96           HB       THR  96 -10.588  -8.666  -3.596
  784    HG1  THR  96           HG1      THR  96 -11.091  -8.291  -1.487
  785   1HG2  THR  96          HG21      THR  96 -11.608 -10.886  -3.517
  786   2HG2  THR  96          HG22      THR  96 -10.220 -11.507  -2.622
  787   3HG2  THR  96          HG23      THR  96 -10.024 -10.971  -4.291
  788    H    TYR  97           HN       TYR  97  -8.646  -6.848  -3.786
  789    HA   TYR  97           HA       TYR  97  -7.769  -7.632  -6.372
  790   1HB   TYR  97          HB1       TYR  97  -9.111  -5.612  -5.992
  791   2HB   TYR  97          HB2       TYR  97  -7.759  -4.878  -5.140
  792    HD1  TYR  97           HD1      TYR  97  -6.739  -3.205  -6.338
  793    HD2  TYR  97           HD2      TYR  97  -8.148  -6.694  -8.419
  794    HE1  TYR  97           HE1      TYR  97  -5.841  -2.291  -8.469
  795    HE2  TYR  97           HE2      TYR  97  -7.364  -5.735 -10.576
  796    HH   TYR  97           HH       TYR  97  -6.601  -3.827 -11.578
  797    H    LEU  98           HN       LEU  98  -6.001  -5.905  -3.763
  798    HA   LEU  98           HA       LEU  98  -3.517  -5.730  -5.019
  799   1HB   LEU  98          HB1       LEU  98  -4.538  -4.889  -2.661
  800   2HB   LEU  98          HB2       LEU  98  -3.536  -6.223  -2.097
  801    HG   LEU  98           HG       LEU  98  -1.569  -5.239  -3.241
  802   1HD1  LEU  98          HD11      LEU  98  -1.759  -2.899  -4.078
  803   2HD1  LEU  98          HD12      LEU  98  -3.510  -3.017  -3.910
  804   3HD1  LEU  98          HD13      LEU  98  -2.662  -4.057  -5.055
  805   1HD2  LEU  98          HD21      LEU  98  -2.960  -3.210  -1.485
  806   2HD2  LEU  98          HD22      LEU  98  -1.224  -3.377  -1.743
  807   3HD2  LEU  98          HD23      LEU  98  -2.111  -4.634  -0.881
  808    H    LYS  99           HN       LYS  99  -4.721  -8.186  -2.804
  809    HA   LYS  99           HA       LYS  99  -2.530  -9.904  -2.774
  810   1HB   LYS  99          HB1       LYS  99  -3.855 -10.648  -1.130
  811   2HB   LYS  99          HB2       LYS  99  -5.291  -9.949  -1.860
  812   1HG   LYS  99          HG1       LYS  99  -5.503 -11.929  -3.309
  813   2HG   LYS  99          HG2       LYS  99  -4.077 -12.626  -2.567
  814   1HD   LYS  99          HD1       LYS  99  -6.769 -12.141  -1.276
  815   2HD   LYS  99          HD2       LYS  99  -6.020 -13.697  -1.645
  816   1HE   LYS  99          HE1       LYS  99  -5.319 -11.713   0.483
  817   2HE   LYS  99          HE2       LYS  99  -5.634 -13.434   0.637
  818   1HZ   LYS  99          HZ1       LYS  99  -3.370 -13.239   0.917
  819   2HZ   LYS  99          HZ2       LYS  99  -3.195 -12.075  -0.300
  820   3HZ   LYS  99          HZ3       LYS  99  -3.514 -13.684  -0.719
  821    H    LYS 100           HN       LYS 100  -5.206  -9.694  -5.099
  822    HA   LYS 100           HA       LYS 100  -4.558 -12.061  -6.519
  823   1HB   LYS 100          HB1       LYS 100  -6.732 -10.456  -6.399
  824   2HB   LYS 100          HB2       LYS 100  -6.114 -10.079  -7.990
  825   1HG   LYS 100          HG1       LYS 100  -7.920 -11.938  -7.705
  826   2HG   LYS 100          HG2       LYS 100  -6.578 -12.206  -8.821
  827   1HD   LYS 100          HD1       LYS 100  -6.169 -13.020  -6.026
  828   2HD   LYS 100          HD2       LYS 100  -7.372 -13.926  -6.890
  829   1HE   LYS 100          HE1       LYS 100  -5.703 -15.328  -7.325
  830   2HE   LYS 100          HE2       LYS 100  -5.147 -14.132  -8.508
  831   1HZ   LYS 100          HZ1       LYS 100  -3.769 -13.105  -6.814
  832   2HZ   LYS 100          HZ2       LYS 100  -3.388 -14.747  -6.926
  833   3HZ   LYS 100          HZ3       LYS 100  -4.340 -14.189  -5.640
  834    H    ALA 101           HN       ALA 101  -3.483  -8.898  -6.855
  835    HA   ALA 101           HA       ALA 101  -2.211  -9.032  -9.402
  836   1HB   ALA 101          HB1       ALA 101  -1.560  -6.750  -8.905
  837   2HB   ALA 101          HB2       ALA 101  -2.038  -6.952  -7.219
  838   3HB   ALA 101          HB3       ALA 101  -3.258  -6.996  -8.494
  839    H    THR 102           HN       THR 102  -1.131  -9.359  -6.051
  840    HA   THR 102           HA       THR 102   1.682  -9.556  -6.686
  841    HB   THR 102           HB       THR 102   0.412 -10.127  -4.014
  842    HG1  THR 102           HG1      THR 102   0.002  -7.941  -5.071
  843   1HG2  THR 102          HG21      THR 102   3.164  -9.190  -4.840
  844   2HG2  THR 102          HG22      THR 102   2.747 -10.746  -4.120
  845   3HG2  THR 102          HG23      THR 102   2.592  -9.267  -3.172
  846    H    GLU 103           HN       GLU 103  -0.932 -11.785  -5.701
  847    HA   GLU 103           HA       GLU 103   0.832 -14.029  -6.461
  848   1HB   GLU 103          HB1       GLU 103  -0.786 -15.307  -4.760
  849   2HB   GLU 103          HB2       GLU 103   0.710 -14.547  -4.243
  850   1HG   GLU 103          HG1       GLU 103  -0.461 -13.418  -2.753
  851   2HG   GLU 103          HG2       GLU 103  -1.208 -12.538  -4.081
  852    HHA  HEC 104           HA       HEC 104   5.248   3.493   1.328
  853    HHB  HEC 104           HB       HEC 104  -0.445   0.574   0.204
  854    HHC  HEC 104           HC       HEC 104  -3.027   6.311  -1.354
  855    HHD  HEC 104           HD       HEC 104   2.901   8.875  -1.420
  856   1HMA  HEC 104          HMA1      HEC 104   1.384  -0.818   1.994
  857   2HMA  HEC 104          HMA2      HEC 104   2.889  -1.185   1.149
  858   3HMA  HEC 104          HMA3      HEC 104   1.384  -1.026   0.243
  859   1HAA  HEC 104          HAA1      HEC 104   4.437  -0.170   2.032
  860   2HAA  HEC 104          HAA2      HEC 104   5.119   1.405   2.393
  861   1HBA  HEC 104          HBA1      HEC 104   5.943   1.552   0.055
  862   2HBA  HEC 104          HBA2      HEC 104   5.322  -0.065  -0.241
  863   1HMB  HEC 104          HMB1      HEC 104  -2.333   0.252  -0.388
  864   2HMB  HEC 104          HMB2      HEC 104  -3.280   0.842  -1.755
  865   3HMB  HEC 104          HMB3      HEC 104  -3.915   0.983  -0.116
  866    HAB  HEC 104           HAB      HEC 104  -4.428   4.977  -1.373
  867   1HBB  HEC 104          HBB1      HEC 104  -4.716   3.763   0.924
  868   2HBB  HEC 104          HBB2      HEC 104  -5.726   2.685  -0.039
  869   3HBB  HEC 104          HBB3      HEC 104  -6.085   4.411   0.021
  870   1HMC  HEC 104          HMC1      HEC 104  -3.094   8.877  -1.524
  871   2HMC  HEC 104          HMC2      HEC 104  -2.780   8.147  -3.098
  872   3HMC  HEC 104          HMC3      HEC 104  -2.171   9.762  -2.738
  873    HAC  HEC 104           HAC      HEC 104   1.679   9.916  -2.679
  874   1HBC  HEC 104          HBC1      HEC 104   0.908  11.309  -1.000
  875   2HBC  HEC 104          HBC2      HEC 104  -0.761  11.231  -1.562
  876   3HBC  HEC 104          HBC3      HEC 104   0.451  12.092  -2.512
  877   1HMD  HEC 104          HMD1      HEC 104   5.049   9.285  -0.547
  878   2HMD  HEC 104          HMD2      HEC 104   5.480   8.295  -1.942
  879   3HMD  HEC 104          HMD3      HEC 104   6.525   8.320  -0.521
  880   1HAD  HEC 104          HAD1      HEC 104   7.350   6.453   0.251
  881   2HAD  HEC 104          HAD2      HEC 104   6.915   4.911   0.980
  882   1HBD  HEC 104          HBD1      HEC 104   6.429   5.866   3.035
  883   2HBD  HEC 104          HBD2      HEC 104   6.091   7.438   2.344
  884    H2   4NL 105           H2       4NL 105  -0.422 -12.937  -1.194
  885    H6   4NL 105           H6       4NL 105   1.780 -14.246   3.357
  886    H3   4NL 105           H3       4NL 105  -1.311 -10.349   2.179
  887    H5   4NL 105           H5       4NL 105  -2.382 -10.228   0.211
  888    H4   4NL 105           H4       4NL 105   0.459 -11.502   3.533
  889    H1   4NL 105           H1       4NL 105   1.349 -14.091   0.158
  890    H7   4NL 105           H7       4NL 105   3.016 -13.230   2.576
  Start of MODEL   15
    1   1H    THR  -5          HT1       THR  -5 -11.513  -6.509  13.396
    2   2H    THR  -5          HT2       THR  -5 -11.090  -5.956  11.852
    3   3H    THR  -5          HT3       THR  -5  -9.947  -5.930  13.100
    4    HA   THR  -5           HA       THR  -5  -9.607  -7.765  11.513
    5    HB   THR  -5           HB       THR  -5 -10.365  -9.170  14.015
    6    HG1  THR  -5           HG1      THR  -5  -8.355  -7.969  14.883
    7   1HG2  THR  -5          HG21      THR  -5  -8.785 -10.039  12.277
    8   2HG2  THR  -5          HG22      THR  -5  -8.081  -9.938  13.891
    9   3HG2  THR  -5          HG23      THR  -5  -7.691  -8.715  12.681
   10    H    GLU  -4           HN       GLU  -4 -12.225  -7.047  10.840
   11    HA   GLU  -4           HA       GLU  -4 -13.686  -9.603  10.972
   12   1HB   GLU  -4          HB1       GLU  -4 -14.701  -7.310  11.915
   13   2HB   GLU  -4          HB2       GLU  -4 -15.071  -7.047  10.215
   14   1HG   GLU  -4          HG1       GLU  -4 -15.886  -9.543  11.694
   15   2HG   GLU  -4          HG2       GLU  -4 -16.899  -8.106  11.619
   16    H    PHE  -3           HN       PHE  -3 -11.739  -9.689   9.289
   17    HA   PHE  -3           HA       PHE  -3 -12.042  -8.472   6.776
   18   1HB   PHE  -3          HB1       PHE  -3  -9.871  -9.252   7.430
   19   2HB   PHE  -3          HB2       PHE  -3 -10.447 -10.910   7.555
   20    HD1  PHE  -3           HD1      PHE  -3  -9.781  -8.146   5.130
   21    HD2  PHE  -3           HD2      PHE  -3 -10.414 -12.363   5.683
   22    HE1  PHE  -3           HE1      PHE  -3  -9.242  -8.538   2.734
   23    HE2  PHE  -3           HE2      PHE  -3  -9.925 -12.752   3.275
   24    HZ   PHE  -3           HZ       PHE  -3  -9.369 -10.834   1.790
   25    H    LYS  -2           HN       LYS  -2 -12.533  -9.371   4.781
   26    HA   LYS  -2           HA       LYS  -2 -14.042 -11.779   4.439
   27   1HB   LYS  -2          HB1       LYS  -2 -15.583  -9.803   5.369
   28   2HB   LYS  -2          HB2       LYS  -2 -15.559  -9.314   3.675
   29   1HG   LYS  -2          HG1       LYS  -2 -16.764 -11.122   2.980
   30   2HG   LYS  -2          HG2       LYS  -2 -16.107 -12.177   4.228
   31   1HD   LYS  -2          HD1       LYS  -2 -18.035  -9.961   4.897
   32   2HD   LYS  -2          HD2       LYS  -2 -18.603 -11.541   4.361
   33   1HE   LYS  -2          HE1       LYS  -2 -18.644 -11.546   6.748
   34   2HE   LYS  -2          HE2       LYS  -2 -17.294 -12.559   6.249
   35   1HZ   LYS  -2          HZ1       LYS  -2 -15.756 -11.012   6.966
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.957 -10.885   8.147
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.863  -9.726   6.924
   38    H    ALA  -1           HN       ALA  -1 -13.612 -12.486   2.484
   39    HA   ALA  -1           HA       ALA  -1 -11.746 -11.299   0.791
   40   1HB   ALA  -1          HB1       ALA  -1 -12.157 -13.722   1.031
   41   2HB   ALA  -1          HB2       ALA  -1 -12.143 -13.199  -0.654
   42   3HB   ALA  -1          HB3       ALA  -1 -13.676 -13.531   0.153
   43    H    GLY   1           HN       GLY   1 -11.863 -10.285  -1.169
   44   1HA   GLY   1          HA1       GLY   1 -14.457  -9.168  -2.020
   45   2HA   GLY   1          HA2       GLY   1 -12.907  -8.364  -2.211
   46    H    SER   2           HN       SER   2 -12.878  -8.119  -4.353
   47    HA   SER   2           HA       SER   2 -12.315 -10.380  -6.055
   48   1HB   SER   2          HB1       SER   2 -14.448  -8.636  -7.170
   49   2HB   SER   2          HB2       SER   2 -14.152 -10.361  -7.419
   50    HG   SER   2           HG       SER   2 -14.872 -10.628  -5.187
   51    H    ALA   3           HN       ALA   3 -11.079  -9.788  -7.826
   52    HA   ALA   3           HA       ALA   3  -9.581  -7.495  -7.798
   53   1HB   ALA   3          HB1       ALA   3  -8.956  -9.516  -8.982
   54   2HB   ALA   3          HB2       ALA   3  -8.866  -8.116 -10.052
   55   3HB   ALA   3          HB3       ALA   3 -10.224  -9.232 -10.175
   56    H    LYS   4           HN       LYS   4 -12.609  -7.909  -9.719
   57    HA   LYS   4           HA       LYS   4 -12.386  -5.347 -10.922
   58   1HB   LYS   4          HB1       LYS   4 -13.538  -7.348 -11.907
   59   2HB   LYS   4          HB2       LYS   4 -14.898  -6.978 -10.847
   60   1HG   LYS   4          HG1       LYS   4 -14.216  -4.541 -12.059
   61   2HG   LYS   4          HG2       LYS   4 -14.140  -5.738 -13.345
   62   1HD   LYS   4          HD1       LYS   4 -16.391  -6.100 -13.319
   63   2HD   LYS   4          HD2       LYS   4 -16.519  -5.843 -11.575
   64   1HE   LYS   4          HE1       LYS   4 -16.066  -3.642 -13.606
   65   2HE   LYS   4          HE2       LYS   4 -17.637  -4.056 -12.917
   66   1HZ   LYS   4          HZ1       LYS   4 -17.060  -3.240 -10.878
   67   2HZ   LYS   4          HZ2       LYS   4 -16.211  -2.177 -11.879
   68   3HZ   LYS   4          HZ3       LYS   4 -15.396  -3.450 -11.124
   69    H    LYS   5           HN       LYS   5 -12.895  -5.769  -7.792
   70    HA   LYS   5           HA       LYS   5 -14.748  -3.481  -7.572
   71   1HB   LYS   5          HB1       LYS   5 -14.212  -5.640  -5.517
   72   2HB   LYS   5          HB2       LYS   5 -15.210  -4.218  -5.245
   73   1HG   LYS   5          HG1       LYS   5 -16.505  -5.104  -7.366
   74   2HG   LYS   5          HG2       LYS   5 -15.777  -6.642  -6.895
   75   1HD   LYS   5          HD1       LYS   5 -16.927  -5.232  -4.618
   76   2HD   LYS   5          HD2       LYS   5 -18.125  -5.543  -5.874
   77   1HE   LYS   5          HE1       LYS   5 -18.135  -7.402  -4.345
   78   2HE   LYS   5          HE2       LYS   5 -17.419  -7.943  -5.863
   79   1HZ   LYS   5          HZ1       LYS   5 -15.571  -6.916  -3.866
   80   2HZ   LYS   5          HZ2       LYS   5 -15.414  -8.228  -4.932
   81   3HZ   LYS   5          HZ3       LYS   5 -16.317  -8.398  -3.511
   82    H    GLY   6           HN       GLY   6 -11.866  -4.977  -6.077
   83   1HA   GLY   6          HA1       GLY   6 -11.108  -2.809  -4.470
   84   2HA   GLY   6          HA2       GLY   6 -10.015  -4.033  -5.094
   85    H    ALA   7           HN       ALA   7 -10.481  -3.394  -7.911
   86    HA   ALA   7           HA       ALA   7  -8.549  -1.435  -8.357
   87   1HB   ALA   7          HB1       ALA   7 -10.624  -2.536 -10.253
   88   2HB   ALA   7          HB2       ALA   7  -8.993  -3.154  -9.992
   89   3HB   ALA   7          HB3       ALA   7  -9.226  -1.570 -10.729
   90    H    THR   8           HN       THR   8 -12.157  -1.080  -8.559
   91    HA   THR   8           HA       THR   8 -12.178   1.568  -9.424
   92    HB   THR   8           HB       THR   8 -14.347   1.550  -7.767
   93    HG1  THR   8           HG1      THR   8 -13.926  -0.623  -7.175
   94   1HG2  THR   8          HG21      THR   8 -15.643   1.069  -9.725
   95   2HG2  THR   8          HG22      THR   8 -14.267   0.281 -10.503
   96   3HG2  THR   8          HG23      THR   8 -14.244   2.023 -10.223
   97    H    LEU   9           HN       LEU   9 -11.669   0.397  -6.135
   98    HA   LEU   9           HA       LEU   9 -11.869   2.864  -4.785
   99   1HB   LEU   9          HB1       LEU   9 -10.951   0.124  -4.156
  100   2HB   LEU   9          HB2       LEU   9 -10.170   1.397  -3.222
  101    HG   LEU   9           HG       LEU   9 -12.084   0.724  -1.970
  102   1HD1  LEU   9          HD11      LEU   9 -12.828   3.228  -3.486
  103   2HD1  LEU   9          HD12      LEU   9 -11.700   3.166  -2.133
  104   3HD1  LEU   9          HD13      LEU   9 -13.399   2.767  -1.882
  105   1HD2  LEU   9          HD21      LEU   9 -14.404   0.956  -2.996
  106   2HD2  LEU   9          HD22      LEU   9 -13.457  -0.430  -3.535
  107   3HD2  LEU   9          HD23      LEU   9 -13.598   0.993  -4.567
  108    H    PHE  10           HN       PHE  10  -8.847   1.036  -4.977
  109    HA   PHE  10           HA       PHE  10  -6.982   2.943  -4.611
  110   1HB   PHE  10          HB1       PHE  10  -5.680   1.177  -4.987
  111   2HB   PHE  10          HB2       PHE  10  -7.055   0.317  -5.663
  112    HD1  PHE  10           HD1      PHE  10  -7.327   0.064  -8.081
  113    HD2  PHE  10           HD2      PHE  10  -4.019   2.245  -6.407
  114    HE1  PHE  10           HE1      PHE  10  -6.151  -0.025 -10.277
  115    HE2  PHE  10           HE2      PHE  10  -2.908   2.267  -8.629
  116    HZ   PHE  10           HZ       PHE  10  -3.956   1.112 -10.561
  117    H    LYS  11           HN       LYS  11  -8.695   2.409  -7.655
  118    HA   LYS  11           HA       LYS  11  -7.201   3.822  -9.454
  119   1HB   LYS  11          HB1       LYS  11  -9.387   2.446  -9.733
  120   2HB   LYS  11          HB2       LYS  11 -10.186   4.012  -9.583
  121   1HG   LYS  11          HG1       LYS  11  -9.032   4.885 -11.482
  122   2HG   LYS  11          HG2       LYS  11  -7.960   3.489 -11.550
  123   1HD   LYS  11          HD1       LYS  11 -10.927   3.522 -12.135
  124   2HD   LYS  11          HD2       LYS  11  -9.624   3.329 -13.308
  125   1HE   LYS  11          HE1       LYS  11 -10.459   1.395 -11.139
  126   2HE   LYS  11          HE2       LYS  11 -10.549   1.155 -12.881
  127   1HZ   LYS  11          HZ1       LYS  11  -8.122   1.169 -12.961
  128   2HZ   LYS  11          HZ2       LYS  11  -8.693  -0.049 -11.939
  129   3HZ   LYS  11          HZ3       LYS  11  -8.056   1.370 -11.278
  130    H    THR  12           HN       THR  12  -9.220   5.278  -7.000
  131    HA   THR  12           HA       THR  12  -8.247   7.929  -7.722
  132    HB   THR  12           HB       THR  12 -10.420   7.727  -8.722
  133    HG1  THR  12           HG1      THR  12  -9.665   9.598  -6.983
  134   1HG2  THR  12          HG21      THR  12 -12.484   7.764  -7.353
  135   2HG2  THR  12          HG22      THR  12 -11.517   7.326  -5.943
  136   3HG2  THR  12          HG23      THR  12 -11.638   6.216  -7.310
  137    H    ARG  13           HN       ARG  13  -7.394   6.080  -5.746
  138    HA   ARG  13           HA       ARG  13  -7.550   7.700  -3.306
  139   1HB   ARG  13          HB1       ARG  13  -7.893   4.699  -3.404
  140   2HB   ARG  13          HB2       ARG  13  -7.681   5.631  -1.937
  141   1HG   ARG  13          HG1       ARG  13 -10.021   5.772  -3.826
  142   2HG   ARG  13          HG2       ARG  13  -9.994   4.998  -2.248
  143   1HD   ARG  13          HD1       ARG  13 -10.523   6.920  -1.240
  144   2HD   ARG  13          HD2       ARG  13  -9.189   7.764  -2.036
  145    HE   ARG  13           HE       ARG  13 -10.315   8.198  -3.722
  146   1HH1  ARG  13          HH11      ARG  13 -12.382   6.624  -1.382
  147   2HH1  ARG  13          HH12      ARG  13 -13.877   7.403  -1.754
  148   1HH2  ARG  13          HH21      ARG  13 -12.626   9.359  -4.266
  149   2HH2  ARG  13          HH22      ARG  13 -14.012   8.895  -3.344
  150    H    CYS  14           HN       CYS  14  -5.837   5.364  -5.251
  151    HA   CYS  14           HA       CYS  14  -3.358   5.854  -3.737
  152   1HB   CYS  14          HB1       CYS  14  -3.860   3.248  -5.106
  153   2HB   CYS  14          HB2       CYS  14  -2.765   3.610  -3.790
  154    H    LEU  15           HN       LEU  15  -4.837   5.311  -6.886
  155    HA   LEU  15           HA       LEU  15  -2.652   5.030  -8.530
  156   1HB   LEU  15          HB1       LEU  15  -5.131   4.865  -9.077
  157   2HB   LEU  15          HB2       LEU  15  -5.110   6.614  -9.261
  158    HG   LEU  15           HG       LEU  15  -3.355   6.386 -11.014
  159   1HD1  LEU  15          HD11      LEU  15  -2.468   4.188 -10.251
  160   2HD1  LEU  15          HD12      LEU  15  -2.820   4.253 -11.978
  161   3HD1  LEU  15          HD13      LEU  15  -3.930   3.430 -10.881
  162   1HD2  LEU  15          HD21      LEU  15  -5.594   6.602 -11.807
  163   2HD2  LEU  15          HD22      LEU  15  -5.948   4.911 -11.451
  164   3HD2  LEU  15          HD23      LEU  15  -4.832   5.324 -12.754
  165    H    GLN  16           HN       GLN  16  -3.962   8.053  -7.243
  166    HA   GLN  16           HA       GLN  16  -2.793   9.997  -8.708
  167   1HB   GLN  16          HB1       GLN  16  -2.700  11.276  -6.453
  168   2HB   GLN  16          HB2       GLN  16  -4.248  10.746  -7.093
  169   1HG   GLN  16          HG1       GLN  16  -3.513   8.604  -5.537
  170   2HG   GLN  16          HG2       GLN  16  -2.877   9.974  -4.623
  171   1HE2  GLN  16          HE21      GLN  16  -4.376  11.497  -3.757
  172   2HE2  GLN  16          HE22      GLN  16  -6.066  11.159  -3.691
  173    H    CYS  17           HN       CYS  17  -1.042   8.015  -6.357
  174    HA   CYS  17           HA       CYS  17   1.448   9.414  -7.057
  175   1HB   CYS  17          HB1       CYS  17   1.299   8.063  -4.427
  176   2HB   CYS  17          HB2       CYS  17   2.116   9.536  -4.919
  177    H    HIS  18           HN       HIS  18  -0.002   6.272  -6.371
  178    HA   HIS  18           HA       HIS  18   2.535   4.855  -6.657
  179   1HB   HIS  18          HB1       HIS  18  -0.191   4.133  -5.646
  180   2HB   HIS  18          HB2       HIS  18   0.977   2.883  -6.032
  181    HD1  HIS  18           HD1      HIS  18   3.432   3.311  -4.607
  182    HD2  HIS  18           HD2      HIS  18  -0.176   4.876  -3.171
  183    HE1  HIS  18           HE1      HIS  18   3.759   3.662  -2.116
  184    H    THR  19           HN       THR  19   2.052   2.558  -7.567
  185    HA   THR  19           HA       THR  19   0.472   2.487 -10.009
  186    HB   THR  19           HB       THR  19   2.757   1.220 -10.817
  187    HG1  THR  19           HG1      THR  19   4.338   2.985 -10.434
  188   1HG2  THR  19          HG21      THR  19   2.020   4.115 -11.254
  189   2HG2  THR  19          HG22      THR  19   1.474   2.740 -12.214
  190   3HG2  THR  19          HG23      THR  19   3.175   3.201 -12.223
  191    H    VAL  20           HN       VAL  20  -0.708   0.640 -10.001
  192    HA   VAL  20           HA       VAL  20  -0.401  -1.323  -7.957
  193    HB   VAL  20           HB       VAL  20  -2.471  -0.344  -9.293
  194   1HG1  VAL  20          HG11      VAL  20  -2.104  -1.451 -11.381
  195   2HG1  VAL  20          HG12      VAL  20  -3.560  -2.097 -10.623
  196   3HG1  VAL  20          HG13      VAL  20  -2.061  -3.027 -10.587
  197   1HG2  VAL  20          HG21      VAL  20  -2.797  -1.381  -7.204
  198   2HG2  VAL  20          HG22      VAL  20  -2.354  -2.967  -7.833
  199   3HG2  VAL  20          HG23      VAL  20  -3.859  -2.207  -8.344
  200    H    GLU  21           HN       GLU  21   0.333  -1.362 -11.364
  201    HA   GLU  21           HA       GLU  21   1.188  -4.171 -11.295
  202   1HB   GLU  21          HB1       GLU  21   1.347  -3.564 -13.905
  203   2HB   GLU  21          HB2       GLU  21  -0.152  -4.099 -13.169
  204   1HG   GLU  21          HG1       GLU  21  -0.394  -2.157 -14.722
  205   2HG   GLU  21          HG2       GLU  21  -1.011  -1.864 -13.099
  206    H    LYS  22           HN       LYS  22   3.200  -4.286 -13.189
  207    HA   LYS  22           HA       LYS  22   5.143  -2.372 -12.142
  208   1HB   LYS  22          HB1       LYS  22   5.252  -5.166 -12.546
  209   2HB   LYS  22          HB2       LYS  22   6.475  -4.420 -13.588
  210   1HG   LYS  22          HG1       LYS  22   7.644  -3.533 -11.841
  211   2HG   LYS  22          HG2       LYS  22   6.203  -3.309 -10.851
  212   1HD   LYS  22          HD1       LYS  22   6.165  -5.611 -10.249
  213   2HD   LYS  22          HD2       LYS  22   7.413  -6.002 -11.433
  214   1HE   LYS  22          HE1       LYS  22   8.428  -5.976  -9.251
  215   2HE   LYS  22          HE2       LYS  22   9.016  -4.591 -10.153
  216   1HZ   LYS  22          HZ1       LYS  22   7.087  -4.604  -7.889
  217   2HZ   LYS  22          HZ2       LYS  22   7.311  -3.254  -8.873
  218   3HZ   LYS  22          HZ3       LYS  22   8.602  -3.850  -7.964
  219    H    GLY  23           HN       GLY  23   3.317  -1.913 -14.619
  220   1HA   GLY  23          HA1       GLY  23   5.343  -1.524 -16.698
  221   2HA   GLY  23          HA2       GLY  23   3.612  -1.295 -16.880
  222    H    GLY  24           HN       GLY  24   3.589   0.393 -14.374
  223   1HA   GLY  24          HA1       GLY  24   4.242   2.952 -15.580
  224   2HA   GLY  24          HA2       GLY  24   3.293   2.681 -14.127
  225    HA   PRO  25           HA       PRO  25   8.097   3.222 -13.270
  226   1HB   PRO  25          HB1       PRO  25   8.431   5.939 -13.611
  227   2HB   PRO  25          HB2       PRO  25   8.937   4.715 -14.780
  228   1HG   PRO  25          HG1       PRO  25   6.475   6.411 -14.753
  229   2HG   PRO  25          HG2       PRO  25   7.500   5.941 -16.122
  230   1HD   PRO  25          HD1       PRO  25   5.140   4.743 -15.640
  231   2HD   PRO  25          HD2       PRO  25   6.528   3.846 -16.291
  232    H    HIS  26           HN       HIS  26   8.819   4.213 -11.292
  233    HA   HIS  26           HA       HIS  26   6.895   4.491  -9.295
  234   1HB   HIS  26          HB1       HIS  26   9.761   5.462  -9.390
  235   2HB   HIS  26          HB2       HIS  26   8.797   5.344  -7.928
  236    HD2  HIS  26           HD2      HIS  26  11.054   3.325 -10.189
  237    HE1  HIS  26           HE1      HIS  26   9.610   0.593  -7.277
  238    HE2  HIS  26           HE2      HIS  26  11.308   0.952  -9.130
  239    H    LYS  27           HN       LYS  27   5.544   6.173  -8.870
  240    HA   LYS  27           HA       LYS  27   6.109   8.813  -9.994
  241   1HB   LYS  27          HB1       LYS  27   3.999   7.509 -10.548
  242   2HB   LYS  27          HB2       LYS  27   3.465   7.852  -8.906
  243   1HG   LYS  27          HG1       LYS  27   3.815  10.315  -9.446
  244   2HG   LYS  27          HG2       LYS  27   3.985   9.818 -11.133
  245   1HD   LYS  27          HD1       LYS  27   1.567   9.507  -9.341
  246   2HD   LYS  27          HD2       LYS  27   1.690  10.418 -10.851
  247   1HE   LYS  27          HE1       LYS  27   0.942   8.597 -11.923
  248   2HE   LYS  27          HE2       LYS  27   2.465   7.808 -11.509
  249   1HZ   LYS  27          HZ1       LYS  27   1.451   7.029  -9.452
  250   2HZ   LYS  27          HZ2       LYS  27   0.587   6.486 -10.797
  251   3HZ   LYS  27          HZ3       LYS  27  -0.016   7.768  -9.876
  252    H    VAL  28           HN       VAL  28   3.995   9.687  -7.794
  253    HA   VAL  28           HA       VAL  28   5.797  10.928  -6.028
  254    HB   VAL  28           HB       VAL  28   2.891  10.390  -5.432
  255   1HG1  VAL  28          HG11      VAL  28   4.747  12.645  -4.649
  256   2HG1  VAL  28          HG12      VAL  28   4.149  11.368  -3.590
  257   3HG1  VAL  28          HG13      VAL  28   3.030  12.556  -4.259
  258   1HG2  VAL  28          HG21      VAL  28   2.961  11.346  -7.676
  259   2HG2  VAL  28          HG22      VAL  28   4.029  12.633  -7.117
  260   3HG2  VAL  28          HG23      VAL  28   2.370  12.546  -6.526
  261    H    GLY  29           HN       GLY  29   4.317   7.809  -6.022
  262   1HA   GLY  29          HA1       GLY  29   5.580   7.086  -3.457
  263   2HA   GLY  29          HA2       GLY  29   3.988   6.500  -3.911
  264    HA   PRO  30           HA       PRO  30   7.525   3.667  -5.491
  265   1HB   PRO  30          HB1       PRO  30   7.240   1.619  -3.739
  266   2HB   PRO  30          HB2       PRO  30   8.325   2.986  -3.459
  267   1HG   PRO  30          HG1       PRO  30   5.561   2.515  -2.400
  268   2HG   PRO  30          HG2       PRO  30   7.003   3.091  -1.542
  269   1HD   PRO  30          HD1       PRO  30   5.073   4.771  -2.395
  270   2HD   PRO  30          HD2       PRO  30   6.786   5.240  -2.360
  271    H    ASN  31           HN       ASN  31   7.265   1.324  -6.192
  272    HA   ASN  31           HA       ASN  31   4.668   0.976  -7.392
  273   1HB   ASN  31          HB1       ASN  31   6.838   0.612  -8.584
  274   2HB   ASN  31          HB2       ASN  31   7.150  -0.770  -7.543
  275   1HD2  ASN  31          HD21      ASN  31   5.003   0.438 -10.087
  276   2HD2  ASN  31          HD22      ASN  31   4.550  -1.140 -10.641
  277    H    LEU  32           HN       LEU  32   3.112  -0.486  -6.791
  278    HA   LEU  32           HA       LEU  32   3.202  -1.708  -4.180
  279   1HB   LEU  32          HB1       LEU  32   0.931  -1.536  -6.162
  280   2HB   LEU  32          HB2       LEU  32   0.805  -1.933  -4.460
  281    HG   LEU  32           HG       LEU  32   1.867   0.745  -5.355
  282   1HD1  LEU  32          HD11      LEU  32  -0.385   0.333  -6.369
  283   2HD1  LEU  32          HD12      LEU  32  -0.345   1.673  -5.224
  284   3HD1  LEU  32          HD13      LEU  32  -1.023   0.120  -4.737
  285   1HD2  LEU  32          HD21      LEU  32   0.519  -0.199  -2.818
  286   2HD2  LEU  32          HD22      LEU  32   0.981   1.468  -3.161
  287   3HD2  LEU  32          HD23      LEU  32   2.221   0.223  -3.007
  288    H    HIS  33           HN       HIS  33   3.359  -2.817  -7.471
  289    HA   HIS  33           HA       HIS  33   2.507  -5.479  -7.268
  290   1HB   HIS  33          HB1       HIS  33   2.938  -3.932  -9.320
  291   2HB   HIS  33          HB2       HIS  33   4.593  -4.525  -9.209
  292    HD2  HIS  33           HD2      HIS  33   1.715  -6.941  -8.441
  293    HE1  HIS  33           HE1      HIS  33   3.167  -7.976 -12.299
  294    HE2  HIS  33           HE2      HIS  33   1.664  -8.698 -10.380
  295    H    GLY  34           HN       GLY  34   3.436  -6.469  -5.477
  296   1HA   GLY  34          HA1       GLY  34   5.106  -8.257  -5.162
  297   2HA   GLY  34          HA2       GLY  34   6.322  -7.079  -5.611
  298    H    ILE  35           HN       ILE  35   4.058  -5.513  -3.597
  299    HA   ILE  35           HA       ILE  35   5.961  -5.379  -1.500
  300    HB   ILE  35           HB       ILE  35   4.353  -4.139  -0.181
  301   1HG1  ILE  35          HG11      ILE  35   2.380  -4.952  -2.281
  302   2HG1  ILE  35          HG12      ILE  35   2.158  -4.756  -0.545
  303   1HG2  ILE  35          HG21      ILE  35   4.786  -3.291  -3.032
  304   2HG2  ILE  35          HG22      ILE  35   5.809  -2.977  -1.630
  305   3HG2  ILE  35          HG23      ILE  35   4.228  -2.206  -1.758
  306   1HD1  ILE  35          HD11      ILE  35   2.412  -2.519  -2.563
  307   2HD1  ILE  35          HD12      ILE  35   2.219  -2.308  -0.822
  308   3HD1  ILE  35          HD13      ILE  35   0.927  -3.045  -1.767
  309    H    PHE  36           HN       PHE  36   2.977  -7.314  -1.757
  310    HA   PHE  36           HA       PHE  36   2.863  -8.255   0.849
  311   1HB   PHE  36          HB1       PHE  36   1.900  -9.392  -1.758
  312   2HB   PHE  36          HB2       PHE  36   1.698 -10.283  -0.250
  313    HD1  PHE  36           HD1      PHE  36   1.057  -8.273   1.712
  314    HD2  PHE  36           HD2      PHE  36  -0.190  -8.557  -2.395
  315    HE1  PHE  36           HE1      PHE  36  -0.955  -6.906   2.236
  316    HE2  PHE  36           HE2      PHE  36  -2.203  -7.191  -1.875
  317    HZ   PHE  36           HZ       PHE  36  -2.581  -6.355   0.437
  318    H    GLY  37           HN       GLY  37   4.309  -9.213   1.976
  319   1HA   GLY  37          HA1       GLY  37   5.534 -11.125   2.640
  320   2HA   GLY  37          HA2       GLY  37   5.904 -11.454   0.958
  321    H    ARG  38           HN       ARG  38   6.467  -8.256   1.115
  322    HA   ARG  38           HA       ARG  38   9.335  -8.545   1.649
  323   1HB   ARG  38          HB1       ARG  38   7.673  -6.488   0.173
  324   2HB   ARG  38          HB2       ARG  38   9.367  -6.216   0.556
  325   1HG   ARG  38          HG1       ARG  38   9.777  -8.458  -0.670
  326   2HG   ARG  38          HG2       ARG  38   8.160  -8.209  -1.332
  327   1HD   ARG  38          HD1       ARG  38   9.093  -5.811  -1.896
  328   2HD   ARG  38          HD2       ARG  38  10.658  -6.616  -1.770
  329    HE   ARG  38           HE       ARG  38   8.994  -7.967  -2.792
  330   1HH1  ARG  38          HH21      ARG  38  10.717  -5.115  -3.675
  331   2HH1  ARG  38          HH22      ARG  38  11.079  -5.636  -5.239
  332   1HH2  ARG  38          HH11      ARG  38   9.130  -8.242  -5.622
  333   2HH2  ARG  38          HH12      ARG  38   9.640  -6.754  -6.299
  334    H    HIS  39           HN       HIS  39  10.330  -6.490   2.606
  335    HA   HIS  39           HA       HIS  39   8.857  -5.767   5.032
  336   1HB   HIS  39          HB1       HIS  39  11.786  -5.333   4.367
  337   2HB   HIS  39          HB2       HIS  39  11.024  -5.135   5.947
  338    HD2  HIS  39           HD2      HIS  39   9.709  -7.580   6.810
  339    HE1  HIS  39           HE1      HIS  39  12.642 -10.040   4.954
  340    HE2  HIS  39           HE2      HIS  39  10.699  -9.991   6.589
  341    H    SER  40           HN       SER  40   8.892  -3.493   5.752
  342    HA   SER  40           HA       SER  40   8.085  -1.649   3.878
  343   1HB   SER  40          HB1       SER  40   9.496  -0.605   6.297
  344   2HB   SER  40          HB2       SER  40   8.030  -0.023   5.522
  345    HG   SER  40           HG       SER  40   7.171  -2.176   6.316
  346    H    GLY  41           HN       GLY  41   9.058  -0.593   2.323
  347   1HA   GLY  41          HA1       GLY  41  10.700   0.822   1.403
  348   2HA   GLY  41          HA2       GLY  41  11.822   0.310   2.639
  349    H    GLN  42           HN       GLN  42  10.070  -1.628   0.090
  350    HA   GLN  42           HA       GLN  42  12.730  -2.455  -0.834
  351   1HB   GLN  42          HB1       GLN  42  10.339  -4.195  -0.371
  352   2HB   GLN  42          HB2       GLN  42  11.686  -4.710  -1.379
  353   1HG   GLN  42          HG1       GLN  42  13.160  -4.086   0.661
  354   2HG   GLN  42          HG2       GLN  42  11.652  -4.145   1.570
  355   1HE2  GLN  42          HE21      GLN  42  12.564  -5.950   2.777
  356   2HE2  GLN  42          HE22      GLN  42  12.616  -7.524   2.073
  357    H    ALA  43           HN       ALA  43  11.076  -0.356  -2.197
  358    HA   ALA  43           HA       ALA  43  10.159  -1.495  -4.655
  359   1HB   ALA  43          HB1       ALA  43   9.180   0.525  -3.760
  360   2HB   ALA  43          HB2       ALA  43   9.851   0.828  -5.362
  361   3HB   ALA  43          HB3       ALA  43  10.717   1.372  -3.927
  362    H    GLU  44           HN       GLU  44  11.151  -1.867  -6.531
  363    HA   GLU  44           HA       GLU  44  13.966  -1.717  -6.796
  364   1HB   GLU  44          HB1       GLU  44  12.096  -2.477  -9.043
  365   2HB   GLU  44          HB2       GLU  44  13.734  -3.046  -8.735
  366   1HG   GLU  44          HG1       GLU  44  12.575  -4.866  -7.984
  367   2HG   GLU  44          HG2       GLU  44  12.661  -3.947  -6.494
  368    H    GLY  45           HN       GLY  45  14.135   0.631  -6.490
  369   1HA   GLY  45          HA1       GLY  45  15.353   2.233  -7.933
  370   2HA   GLY  45          HA2       GLY  45  13.992   2.140  -9.028
  371    H    TYR  46           HN       TYR  46  13.398   2.335  -5.583
  372    HA   TYR  46           HA       TYR  46  12.919   5.205  -5.664
  373   1HB   TYR  46          HB1       TYR  46  10.834   4.203  -6.345
  374   2HB   TYR  46          HB2       TYR  46  10.823   3.176  -4.918
  375    HD1  TYR  46           HD1      TYR  46  10.185   6.539  -6.237
  376    HD2  TYR  46           HD2      TYR  46  10.403   4.126  -2.690
  377    HE1  TYR  46           HE1      TYR  46   8.829   8.234  -5.017
  378    HE2  TYR  46           HE2      TYR  46   8.953   5.753  -1.483
  379    HH   TYR  46           HH       TYR  46   7.347   8.375  -3.156
  380    H    SER  47           HN       SER  47  13.076   6.303  -3.746
  381    HA   SER  47           HA       SER  47  14.344   4.901  -1.521
  382   1HB   SER  47          HB1       SER  47  14.338   7.740  -1.154
  383   2HB   SER  47          HB2       SER  47  15.707   6.662  -1.434
  384    HG   SER  47           HG       SER  47  15.745   7.237  -3.464
  385    H    TYR  48           HN       TYR  48  13.680   4.968   0.520
  386    HA   TYR  48           HA       TYR  48  11.033   5.970   1.269
  387   1HB   TYR  48          HB1       TYR  48  12.681   3.607   2.177
  388   2HB   TYR  48          HB2       TYR  48  11.178   4.097   2.955
  389    HD1  TYR  48           HD1      TYR  48   9.046   3.751   1.920
  390    HD2  TYR  48           HD2      TYR  48  12.666   2.695  -0.146
  391    HE1  TYR  48           HE1      TYR  48   7.730   2.334   0.356
  392    HE2  TYR  48           HE2      TYR  48  11.362   1.276  -1.716
  393    HH   TYR  48           HH       TYR  48   8.277   0.195  -1.008
  394    H    THR  49           HN       THR  49  10.773   6.679   3.606
  395    HA   THR  49           HA       THR  49  12.750   8.552   4.448
  396    HB   THR  49           HB       THR  49  11.251   8.643   6.561
  397    HG1  THR  49           HG1      THR  49   9.228   7.664   4.944
  398   1HG2  THR  49          HG21      THR  49  10.175   9.445   3.868
  399   2HG2  THR  49          HG22      THR  49  11.294  10.374   4.867
  400   3HG2  THR  49          HG23      THR  49   9.645  10.085   5.425
  401    H    ASP  50           HN       ASP  50  13.569   8.724   6.685
  402    HA   ASP  50           HA       ASP  50  15.221   6.667   7.480
  403   1HB   ASP  50          HB1       ASP  50  15.546   9.009   8.070
  404   2HB   ASP  50          HB2       ASP  50  14.106   8.979   9.084
  405    H    ALA  51           HN       ALA  51  11.906   7.286   8.478
  406    HA   ALA  51           HA       ALA  51  11.930   5.405  10.654
  407   1HB   ALA  51          HB1       ALA  51   9.657   7.020   9.501
  408   2HB   ALA  51          HB2       ALA  51  10.742   7.553  10.786
  409   3HB   ALA  51          HB3       ALA  51   9.668   6.180  11.054
  410    H    ASN  52           HN       ASN  52  10.707   5.342   7.288
  411    HA   ASN  52           HA       ASN  52   9.072   3.034   7.682
  412   1HB   ASN  52          HB1       ASN  52   8.341   4.312   5.909
  413   2HB   ASN  52          HB2       ASN  52   9.969   4.656   5.339
  414   1HD2  ASN  52          HD21      ASN  52   7.248   2.532   5.015
  415   2HD2  ASN  52          HD22      ASN  52   7.927   1.665   3.687
  416    H    ILE  53           HN       ILE  53  12.394   3.486   6.534
  417    HA   ILE  53           HA       ILE  53  12.899   0.783   5.881
  418    HB   ILE  53           HB       ILE  53  14.759   3.038   6.572
  419   1HG1  ILE  53          HG11      ILE  53  14.083   1.839   3.864
  420   2HG1  ILE  53          HG12      ILE  53  13.301   3.275   4.519
  421   1HG2  ILE  53          HG21      ILE  53  15.433   0.336   5.374
  422   2HG2  ILE  53          HG22      ILE  53  15.947   0.942   6.949
  423   3HG2  ILE  53          HG23      ILE  53  16.545   1.703   5.475
  424   1HD1  ILE  53          HD11      ILE  53  14.986   4.028   3.019
  425   2HD1  ILE  53          HD12      ILE  53  16.193   2.952   3.723
  426   3HD1  ILE  53          HD13      ILE  53  15.596   4.330   4.646
  427    H    LYS  54           HN       LYS  54  14.370   2.508   8.692
  428    HA   LYS  54           HA       LYS  54  15.043   0.530  10.352
  429   1HB   LYS  54          HB1       LYS  54  13.639   3.111  11.000
  430   2HB   LYS  54          HB2       LYS  54  14.306   2.051  12.245
  431   1HG   LYS  54          HG1       LYS  54  16.525   2.208  11.217
  432   2HG   LYS  54          HG2       LYS  54  15.872   3.253   9.952
  433   1HD   LYS  54          HD1       LYS  54  15.157   4.840  11.797
  434   2HD   LYS  54          HD2       LYS  54  16.128   3.853  12.901
  435   1HE   LYS  54          HE1       LYS  54  18.136   4.390  11.811
  436   2HE   LYS  54          HE2       LYS  54  17.304   4.921  10.347
  437   1HZ   LYS  54          HZ1       LYS  54  17.373   6.318  12.958
  438   2HZ   LYS  54          HZ2       LYS  54  16.383   6.775  11.659
  439   3HZ   LYS  54          HZ3       LYS  54  18.067   6.828  11.497
  440    H    LYS  55           HN       LYS  55  11.815   0.956   9.322
  441    HA   LYS  55           HA       LYS  55  10.504  -0.236  11.600
  442   1HB   LYS  55          HB1       LYS  55   9.375   1.502  10.453
  443   2HB   LYS  55          HB2       LYS  55   9.575   0.716   8.905
  444   1HG   LYS  55          HG1       LYS  55   7.387   0.307   9.247
  445   2HG   LYS  55          HG2       LYS  55   8.054  -1.121  10.015
  446   1HD   LYS  55          HD1       LYS  55   7.185   1.381  11.474
  447   2HD   LYS  55          HD2       LYS  55   6.201  -0.070  11.288
  448   1HE   LYS  55          HE1       LYS  55   8.872   0.088  12.704
  449   2HE   LYS  55          HE2       LYS  55   7.293   0.007  13.489
  450   1HZ   LYS  55          HZ1       LYS  55   6.951  -2.166  12.423
  451   2HZ   LYS  55          HZ2       LYS  55   8.299  -2.164  13.438
  452   3HZ   LYS  55          HZ3       LYS  55   8.511  -2.086  11.764
  453    H    ASN  56           HN       ASN  56  11.502  -1.372   8.445
  454    HA   ASN  56           HA       ASN  56  11.318  -3.255   7.254
  455   1HB   ASN  56          HB1       ASN  56  13.300  -3.424   8.833
  456   2HB   ASN  56          HB2       ASN  56  12.345  -4.553   9.768
  457   1HD2  ASN  56          HD21      ASN  56  13.863  -4.109   6.535
  458   2HD2  ASN  56          HD22      ASN  56  13.656  -5.784   6.258
  459    H    VAL  57           HN       VAL  57   8.729  -2.769   8.307
  460    HA   VAL  57           HA       VAL  57   7.654  -5.124   9.504
  461    HB   VAL  57           HB       VAL  57   6.751  -2.537   9.107
  462   1HG1  VAL  57          HG11      VAL  57   4.805  -4.391   7.735
  463   2HG1  VAL  57          HG12      VAL  57   5.666  -3.056   6.969
  464   3HG1  VAL  57          HG13      VAL  57   4.484  -2.731   8.237
  465   1HG2  VAL  57          HG21      VAL  57   6.499  -4.038  11.028
  466   2HG2  VAL  57          HG22      VAL  57   5.257  -4.931  10.149
  467   3HG2  VAL  57          HG23      VAL  57   4.986  -3.245  10.587
  468    H    LEU  58           HN       LEU  58   6.695  -6.897   8.578
  469    HA   LEU  58           HA       LEU  58   7.186  -7.224   5.731
  470   1HB   LEU  58          HB1       LEU  58   7.961  -8.938   7.387
  471   2HB   LEU  58          HB2       LEU  58   6.276  -9.312   7.720
  472    HG   LEU  58           HG       LEU  58   7.118  -9.406   4.861
  473   1HD1  LEU  58          HD11      LEU  58   8.009 -11.684   5.119
  474   2HD1  LEU  58          HD12      LEU  58   7.890 -11.528   6.871
  475   3HD1  LEU  58          HD13      LEU  58   9.003 -10.500   5.970
  476   1HD2  LEU  58          HD21      LEU  58   5.404 -11.228   6.566
  477   2HD2  LEU  58          HD22      LEU  58   5.656 -11.383   4.828
  478   3HD2  LEU  58          HD23      LEU  58   4.812  -9.976   5.473
  479    H    TRP  59           HN       TRP  59   5.652  -6.217   4.605
  480    HA   TRP  59           HA       TRP  59   2.988  -5.814   5.222
  481   1HB   TRP  59          HB1       TRP  59   4.220  -6.149   2.487
  482   2HB   TRP  59          HB2       TRP  59   2.678  -5.386   2.827
  483    HD1  TRP  59           HD1      TRP  59   5.923  -4.427   1.851
  484    HE1  TRP  59           HE1      TRP  59   6.523  -2.036   2.610
  485    HE3  TRP  59           HE3      TRP  59   2.233  -3.647   5.306
  486    HZ2  TRP  59           HZ2      TRP  59   5.667  -0.113   4.546
  487    HZ3  TRP  59           HZ3      TRP  59   2.134  -1.527   6.560
  488    HH2  TRP  59           HH2      TRP  59   3.820   0.240   6.199
  489    H    ASP  60           HN       ASP  60   1.657  -7.329   5.772
  490    HA   ASP  60           HA       ASP  60   1.279  -9.804   4.255
  491   1HB   ASP  60          HB1       ASP  60   1.729 -10.804   6.207
  492   2HB   ASP  60          HB2       ASP  60   1.755  -9.267   7.048
  493    H    GLU  61           HN       GLU  61  -1.140 -10.598   5.140
  494    HA   GLU  61           HA       GLU  61  -2.955  -9.049   3.626
  495   1HB   GLU  61          HB1       GLU  61  -2.934 -11.638   4.613
  496   2HB   GLU  61          HB2       GLU  61  -4.220 -10.875   5.542
  497   1HG   GLU  61          HG1       GLU  61  -5.412 -11.625   3.725
  498   2HG   GLU  61          HG2       GLU  61  -4.986 -10.003   3.175
  499    H    ASN  62           HN       ASN  62  -2.779  -9.580   7.165
  500    HA   ASN  62           HA       ASN  62  -4.721  -7.525   7.696
  501   1HB   ASN  62          HB1       ASN  62  -4.685  -9.542   9.024
  502   2HB   ASN  62          HB2       ASN  62  -3.020  -9.257   9.498
  503   1HD2  ASN  62          HD21      ASN  62  -2.593  -7.512  10.951
  504   2HD2  ASN  62          HD22      ASN  62  -3.839  -6.921  11.989
  505    H    ASN  63           HN       ASN  63  -1.163  -7.795   8.212
  506    HA   ASN  63           HA       ASN  63  -0.667  -5.431   9.498
  507   1HB   ASN  63          HB1       ASN  63   1.068  -6.985   9.252
  508   2HB   ASN  63          HB2       ASN  63   0.931  -7.007   7.504
  509   1HD2  ASN  63          HD21      ASN  63   1.872  -4.814  10.191
  510   2HD2  ASN  63          HD22      ASN  63   2.858  -3.916   9.090
  511    H    MET  64           HN       MET  64  -0.998  -5.654   5.887
  512    HA   MET  64           HA       MET  64  -0.419  -2.951   5.398
  513   1HB   MET  64          HB1       MET  64  -0.515  -4.722   3.679
  514   2HB   MET  64          HB2       MET  64  -2.267  -4.742   3.820
  515   1HG   MET  64          HG1       MET  64  -2.244  -2.317   3.173
  516   2HG   MET  64          HG2       MET  64  -0.534  -2.492   2.827
  517   1HE   MET  64          HE1       MET  64  -4.046  -4.249   0.408
  518   2HE   MET  64          HE2       MET  64  -4.181  -3.037   1.683
  519   3HE   MET  64          HE3       MET  64  -3.757  -4.701   2.090
  520    H    SER  65           HN       SER  65  -3.510  -4.424   6.358
  521    HA   SER  65           HA       SER  65  -5.093  -2.097   5.996
  522   1HB   SER  65          HB1       SER  65  -5.841  -4.227   7.959
  523   2HB   SER  65          HB2       SER  65  -6.868  -3.297   6.877
  524    HG   SER  65           HG       SER  65  -5.403  -5.604   6.411
  525    H    GLU  66           HN       GLU  66  -3.493  -3.418   8.890
  526    HA   GLU  66           HA       GLU  66  -4.481  -1.612  10.782
  527   1HB   GLU  66          HB1       GLU  66  -2.817  -2.491  12.218
  528   2HB   GLU  66          HB2       GLU  66  -3.187  -3.804  11.104
  529   1HG   GLU  66          HG1       GLU  66  -1.197  -2.945   9.724
  530   2HG   GLU  66          HG2       GLU  66  -0.761  -2.034  11.170
  531    H    TYR  67           HN       TYR  67  -1.728  -1.405   8.614
  532    HA   TYR  67           HA       TYR  67  -0.727   1.120   9.513
  533   1HB   TYR  67          HB1       TYR  67   0.874  -0.342   8.669
  534   2HB   TYR  67          HB2       TYR  67  -0.113  -0.785   7.289
  535    HD1  TYR  67           HD1      TYR  67   0.217   0.246   5.192
  536    HD2  TYR  67           HD2      TYR  67   1.861   2.014   8.745
  537    HE1  TYR  67           HE1      TYR  67   1.622   1.748   3.787
  538    HE2  TYR  67           HE2      TYR  67   3.312   3.485   7.363
  539    HH   TYR  67           HH       TYR  67   4.179   3.734   5.254
  540    H    LEU  68           HN       LEU  68  -2.614   0.118   6.586
  541    HA   LEU  68           HA       LEU  68  -2.606   2.590   5.322
  542   1HB   LEU  68          HB1       LEU  68  -4.628   0.376   5.338
  543   2HB   LEU  68          HB2       LEU  68  -4.852   1.822   4.370
  544    HG   LEU  68           HG       LEU  68  -2.653  -0.236   4.100
  545   1HD1  LEU  68          HD11      LEU  68  -4.883  -0.736   3.164
  546   2HD1  LEU  68          HD12      LEU  68  -3.678  -0.519   1.895
  547   3HD1  LEU  68          HD13      LEU  68  -4.828   0.770   2.248
  548   1HD2  LEU  68          HD21      LEU  68  -1.760   2.101   3.729
  549   2HD2  LEU  68          HD22      LEU  68  -2.972   2.297   2.464
  550   3HD2  LEU  68          HD23      LEU  68  -1.716   1.070   2.298
  551    H    THR  69           HN       THR  69  -4.830   1.566   7.934
  552    HA   THR  69           HA       THR  69  -6.658   3.668   7.741
  553    HB   THR  69           HB       THR  69  -5.955   2.591  10.430
  554    HG1  THR  69           HG1      THR  69  -5.999   0.698   9.422
  555   1HG2  THR  69          HG21      THR  69  -8.582   3.077   9.004
  556   2HG2  THR  69          HG22      THR  69  -7.880   4.105  10.253
  557   3HG2  THR  69          HG23      THR  69  -8.406   2.470  10.651
  558    H    ASN  70           HN       ASN  70  -3.418   3.702   9.053
  559    HA   ASN  70           HA       ASN  70  -3.421   6.545   9.182
  560   1HB   ASN  70          HB1       ASN  70  -4.531   5.868  11.366
  561   2HB   ASN  70          HB2       ASN  70  -2.979   5.190  11.846
  562   1HD2  ASN  70          HD21      ASN  70  -4.501   7.430  13.016
  563   2HD2  ASN  70          HD22      ASN  70  -3.251   8.621  13.079
  564    HA   PRO  71           HA       PRO  71   0.670   4.671   8.092
  565   1HB   PRO  71          HB1       PRO  71   1.359   6.787   6.470
  566   2HB   PRO  71          HB2       PRO  71   0.508   5.339   5.923
  567   1HG   PRO  71          HG1       PRO  71  -0.590   8.027   6.642
  568   2HG   PRO  71          HG2       PRO  71  -1.045   6.949   5.309
  569   1HD   PRO  71          HD1       PRO  71  -2.532   7.149   7.539
  570   2HD   PRO  71          HD2       PRO  71  -2.350   5.608   6.675
  571    H    LYS  72           HN       LYS  72  -0.159   7.925   9.170
  572    HA   LYS  72           HA       LYS  72   2.454   8.774   9.873
  573   1HB   LYS  72          HB1       LYS  72  -0.262   9.833  10.094
  574   2HB   LYS  72          HB2       LYS  72   0.758  10.270  11.455
  575   1HG   LYS  72          HG1       LYS  72   0.739  11.963   9.659
  576   2HG   LYS  72          HG2       LYS  72   2.347  11.338  10.006
  577   1HD   LYS  72          HD1       LYS  72   2.317   9.986   8.015
  578   2HD   LYS  72          HD2       LYS  72   0.621  10.370   7.723
  579   1HE   LYS  72          HE1       LYS  72   1.120  12.610   7.161
  580   2HE   LYS  72          HE2       LYS  72   2.742  12.501   7.826
  581   1HZ   LYS  72          HZ1       LYS  72   1.882  10.940   5.463
  582   2HZ   LYS  72          HZ2       LYS  72   3.457  11.230   6.004
  583   3HZ   LYS  72          HZ3       LYS  72   2.553  12.495   5.346
  584    H    LYS  73           HN       LYS  73  -0.097   7.146  11.697
  585    HA   LYS  73           HA       LYS  73   1.304   7.371  14.192
  586   1HB   LYS  73          HB1       LYS  73  -1.117   7.249  14.197
  587   2HB   LYS  73          HB2       LYS  73  -1.071   5.666  13.435
  588   1HG   LYS  73          HG1       LYS  73  -1.540   5.395  15.780
  589   2HG   LYS  73          HG2       LYS  73   0.065   4.759  15.442
  590   1HD   LYS  73          HD1       LYS  73   0.629   7.346  16.159
  591   2HD   LYS  73          HD2       LYS  73  -0.763   6.988  17.179
  592   1HE   LYS  73          HE1       LYS  73   0.963   6.294  18.538
  593   2HE   LYS  73          HE2       LYS  73   0.569   4.789  17.713
  594   1HZ   LYS  73          HZ1       LYS  73   2.379   5.332  16.121
  595   2HZ   LYS  73          HZ2       LYS  73   2.908   5.040  17.699
  596   3HZ   LYS  73          HZ3       LYS  73   2.816   6.626  17.125
  597    H    TYR  74           HN       TYR  74   0.994   4.788  11.779
  598    HA   TYR  74           HA       TYR  74   2.463   2.839  13.230
  599   1HB   TYR  74          HB1       TYR  74   0.823   2.623  11.211
  600   2HB   TYR  74          HB2       TYR  74   2.283   2.845  10.245
  601    HD1  TYR  74           HD1      TYR  74   3.855   1.027   9.946
  602    HD2  TYR  74           HD2      TYR  74   0.717   0.803  12.876
  603    HE1  TYR  74           HE1      TYR  74   4.333  -1.403  10.270
  604    HE2  TYR  74           HE2      TYR  74   1.174  -1.612  13.204
  605    HH   TYR  74           HH       TYR  74   2.148  -3.482  11.867
  606    H    ILE  75           HN       ILE  75   3.410   5.128  10.728
  607    HA   ILE  75           HA       ILE  75   6.250   4.679  11.316
  608    HB   ILE  75           HB       ILE  75   5.062   5.132   8.566
  609   1HG1  ILE  75          HG11      ILE  75   6.417   2.702   9.793
  610   2HG1  ILE  75          HG12      ILE  75   4.744   2.805   9.263
  611   1HG2  ILE  75          HG21      ILE  75   7.194   6.283   8.846
  612   2HG2  ILE  75          HG22      ILE  75   7.413   4.882   7.799
  613   3HG2  ILE  75          HG23      ILE  75   7.934   4.814   9.482
  614   1HD1  ILE  75          HD11      ILE  75   5.513   3.028   6.930
  615   2HD1  ILE  75          HD12      ILE  75   6.077   1.533   7.675
  616   3HD1  ILE  75          HD13      ILE  75   7.183   2.892   7.478
  617    HA   PRO  76           HA       PRO  76   5.287   9.050  12.256
  618   1HB   PRO  76          HB1       PRO  76   7.393   9.349  13.963
  619   2HB   PRO  76          HB2       PRO  76   5.832   8.677  14.448
  620   1HG   PRO  76          HG1       PRO  76   8.371   7.260  13.743
  621   2HG   PRO  76          HG2       PRO  76   7.219   6.914  15.046
  622   1HD   PRO  76          HD1       PRO  76   7.274   5.503  12.737
  623   2HD   PRO  76          HD2       PRO  76   5.776   5.793  13.643
  624    H    GLY  77           HN       GLY  77   5.825   9.993  10.303
  625   1HA   GLY  77          HA1       GLY  77   7.416  11.723   9.553
  626   2HA   GLY  77          HA2       GLY  77   8.683  10.538   9.803
  627    H    THR  78           HN       THR  78   6.078   8.918   8.480
  628    HA   THR  78           HA       THR  78   7.293   8.399   5.991
  629    HB   THR  78           HB       THR  78   5.434   7.163   7.491
  630    HG1  THR  78           HG1      THR  78   6.667   6.708   5.216
  631   1HG2  THR  78          HG21      THR  78   3.520   8.491   6.796
  632   2HG2  THR  78          HG22      THR  78   3.390   6.845   6.174
  633   3HG2  THR  78          HG23      THR  78   3.881   8.157   5.102
  634    H    LYS  79           HN       LYS  79   6.792   8.956   3.910
  635    HA   LYS  79           HA       LYS  79   5.851  11.609   3.452
  636   1HB   LYS  79          HB1       LYS  79   6.255   9.518   1.328
  637   2HB   LYS  79          HB2       LYS  79   6.445  11.258   1.192
  638   1HG   LYS  79          HG1       LYS  79   8.434  11.098   2.696
  639   2HG   LYS  79          HG2       LYS  79   8.273   9.335   2.630
  640   1HD   LYS  79          HD1       LYS  79   8.152   9.954  -0.021
  641   2HD   LYS  79          HD2       LYS  79   9.239  11.220   0.564
  642   1HE   LYS  79          HE1       LYS  79  10.783   9.571   0.175
  643   2HE   LYS  79          HE2       LYS  79  10.347   9.165   1.835
  644   1HZ   LYS  79          HZ1       LYS  79   8.812   7.963  -0.354
  645   2HZ   LYS  79          HZ2       LYS  79   9.164   7.346   1.179
  646   3HZ   LYS  79          HZ3       LYS  79  10.358   7.356  -0.015
  647    H    MET  80           HN       MET  80   4.149   8.514   3.367
  648    HA   MET  80           HA       MET  80   2.106   9.372   1.587
  649   1HB   MET  80          HB1       MET  80   2.302   7.092   1.524
  650   2HB   MET  80          HB2       MET  80   2.551   6.951   3.268
  651   1HG   MET  80          HG1       MET  80   0.324   7.065   3.750
  652   2HG   MET  80          HG2       MET  80  -0.056   7.997   2.315
  653   1HE   MET  80          HE1       MET  80   0.341   4.472   3.927
  654   2HE   MET  80          HE2       MET  80   1.776   4.598   2.910
  655   3HE   MET  80          HE3       MET  80   0.517   3.428   2.516
  656    H    ALA  81           HN       ALA  81   0.925  11.019   2.026
  657    HA   ALA  81           HA       ALA  81  -0.241  11.439   4.663
  658   1HB   ALA  81          HB1       ALA  81  -0.067  13.459   2.457
  659   2HB   ALA  81          HB2       ALA  81   1.232  13.167   3.612
  660   3HB   ALA  81          HB3       ALA  81  -0.339  13.733   4.178
  661    H    PHE  82           HN       PHE  82  -1.338   9.651   2.658
  662    HA   PHE  82           HA       PHE  82  -3.636  10.390   1.371
  663   1HB   PHE  82          HB1       PHE  82  -2.630   8.387   0.753
  664   2HB   PHE  82          HB2       PHE  82  -2.593   7.779   2.403
  665    HD1  PHE  82           HD1      PHE  82  -5.058   8.801  -0.246
  666    HD2  PHE  82           HD2      PHE  82  -4.151   6.191   3.051
  667    HE1  PHE  82           HE1      PHE  82  -7.239   7.644  -0.560
  668    HE2  PHE  82           HE2      PHE  82  -6.334   5.044   2.747
  669    HZ   PHE  82           HZ       PHE  82  -7.886   5.785   0.954
  670    H    GLY  83           HN       GLY  83  -3.349   9.942   4.830
  671   1HA   GLY  83          HA1       GLY  83  -5.026  10.700   6.329
  672   2HA   GLY  83          HA2       GLY  83  -6.220  10.495   5.067
  673    H    GLY  84           HN       GLY  84  -5.714   7.774   4.421
  674   1HA   GLY  84          HA1       GLY  84  -5.728   5.575   5.208
  675   2HA   GLY  84          HA2       GLY  84  -5.868   6.174   6.850
  676    H    LEU  85           HN       LEU  85  -7.443   4.458   4.596
  677    HA   LEU  85           HA       LEU  85 -10.138   5.384   4.798
  678   1HB   LEU  85          HB1       LEU  85  -8.926   2.821   3.771
  679   2HB   LEU  85          HB2       LEU  85 -10.650   3.127   3.766
  680    HG   LEU  85           HG       LEU  85  -8.552   4.666   2.216
  681   1HD1  LEU  85          HD11      LEU  85  -9.633   3.698   0.276
  682   2HD1  LEU  85          HD12      LEU  85 -10.848   2.925   1.294
  683   3HD1  LEU  85          HD13      LEU  85  -9.165   2.401   1.377
  684   1HD2  LEU  85          HD21      LEU  85 -11.551   5.071   2.348
  685   2HD2  LEU  85          HD22      LEU  85 -10.498   5.776   1.122
  686   3HD2  LEU  85          HD23      LEU  85 -10.310   6.234   2.814
  687    H    LYS  86           HN       LYS  86 -10.826   5.503   6.771
  688    HA   LYS  86           HA       LYS  86 -10.410   3.899   8.993
  689   1HB   LYS  86          HB1       LYS  86 -12.746   5.739   8.446
  690   2HB   LYS  86          HB2       LYS  86 -12.191   5.200  10.025
  691   1HG   LYS  86          HG1       LYS  86 -10.528   6.856   8.118
  692   2HG   LYS  86          HG2       LYS  86 -11.479   7.519   9.448
  693   1HD   LYS  86          HD1       LYS  86 -10.156   6.264  11.065
  694   2HD   LYS  86          HD2       LYS  86  -9.255   5.487   9.764
  695   1HE   LYS  86          HE1       LYS  86  -9.283   8.480  10.030
  696   2HE   LYS  86          HE2       LYS  86  -8.191   7.505  11.011
  697   1HZ   LYS  86          HZ1       LYS  86  -7.086   6.727   9.118
  698   2HZ   LYS  86          HZ2       LYS  86  -7.298   8.380   8.835
  699   3HZ   LYS  86          HZ3       LYS  86  -8.304   7.261   8.067
  700    H    LYS  87           HN       LYS  87 -12.602   3.351   6.389
  701    HA   LYS  87           HA       LYS  87 -14.440   1.633   7.833
  702   1HB   LYS  87          HB1       LYS  87 -14.112   2.284   4.913
  703   2HB   LYS  87          HB2       LYS  87 -15.348   1.226   5.539
  704   1HG   LYS  87          HG1       LYS  87 -16.171   3.347   6.843
  705   2HG   LYS  87          HG2       LYS  87 -15.206   4.222   5.615
  706   1HD   LYS  87          HD1       LYS  87 -16.296   2.169   4.199
  707   2HD   LYS  87          HD2       LYS  87 -17.583   2.517   5.303
  708   1HE   LYS  87          HE1       LYS  87 -18.170   4.433   4.173
  709   2HE   LYS  87          HE2       LYS  87 -16.549   4.641   3.473
  710   1HZ   LYS  87          HZ1       LYS  87 -18.370   3.624   1.990
  711   2HZ   LYS  87          HZ2       LYS  87 -18.158   2.221   2.902
  712   3HZ   LYS  87          HZ3       LYS  87 -16.856   2.853   2.019
  713    H    GLU  88           HN       GLU  88 -13.616  -0.319   8.398
  714    HA   GLU  88           HA       GLU  88 -11.639  -1.830   7.202
  715   1HB   GLU  88          HB1       GLU  88 -12.661  -2.089   9.485
  716   2HB   GLU  88          HB2       GLU  88 -13.985  -2.958   8.712
  717   1HG   GLU  88          HG1       GLU  88 -12.215  -4.524   7.749
  718   2HG   GLU  88          HG2       GLU  88 -11.085  -3.767   8.880
  719    H    LYS  89           HN       LYS  89 -15.165  -2.240   6.644
  720    HA   LYS  89           HA       LYS  89 -15.084  -4.476   5.030
  721   1HB   LYS  89          HB1       LYS  89 -17.041  -2.253   4.528
  722   2HB   LYS  89          HB2       LYS  89 -17.298  -3.994   4.472
  723   1HG   LYS  89          HG1       LYS  89 -16.522  -2.673   7.044
  724   2HG   LYS  89          HG2       LYS  89 -18.195  -2.639   6.502
  725   1HD   LYS  89          HD1       LYS  89 -18.537  -4.790   7.097
  726   2HD   LYS  89          HD2       LYS  89 -16.982  -5.313   6.429
  727   1HE   LYS  89          HE1       LYS  89 -16.266  -3.738   8.598
  728   2HE   LYS  89          HE2       LYS  89 -17.685  -4.610   9.178
  729   1HZ   LYS  89          HZ1       LYS  89 -16.648  -6.669   8.772
  730   2HZ   LYS  89          HZ2       LYS  89 -15.485  -5.720   9.552
  731   3HZ   LYS  89          HZ3       LYS  89 -15.391  -5.959   7.883
  732    H    ASP  90           HN       ASP  90 -14.813  -1.142   4.111
  733    HA   ASP  90           HA       ASP  90 -14.578  -1.284   1.370
  734   1HB   ASP  90          HB1       ASP  90 -13.827   0.625   3.543
  735   2HB   ASP  90          HB2       ASP  90 -13.285   0.954   1.908
  736    H    ARG  91           HN       ARG  91 -11.938  -1.406   3.852
  737    HA   ARG  91           HA       ARG  91  -9.885  -1.713   1.878
  738   1HB   ARG  91          HB1       ARG  91  -9.587  -2.499   4.781
  739   2HB   ARG  91          HB2       ARG  91  -8.307  -2.125   3.633
  740   1HG   ARG  91          HG1       ARG  91  -8.973   0.189   3.565
  741   2HG   ARG  91          HG2       ARG  91 -10.378  -0.142   4.564
  742   1HD   ARG  91          HD1       ARG  91  -7.475  -0.174   5.379
  743   2HD   ARG  91          HD2       ARG  91  -8.728   0.929   5.921
  744    HE   ARG  91           HE       ARG  91  -8.326  -1.535   6.102
  745   1HH1  ARG  91          HH21      ARG  91  -9.604   1.272   7.700
  746   2HH1  ARG  91          HH22      ARG  91 -10.263   0.614   9.158
  747   1HH2  ARG  91          HH11      ARG  91  -9.355  -2.626   8.480
  748   2HH2  ARG  91          HH12      ARG  91 -10.170  -1.568   9.575
  749    H    ASN  92           HN       ASN  92 -11.777  -4.036   3.762
  750    HA   ASN  92           HA       ASN  92 -10.442  -6.369   3.411
  751   1HB   ASN  92          HB1       ASN  92 -13.380  -5.755   3.373
  752   2HB   ASN  92          HB2       ASN  92 -12.813  -7.405   3.172
  753   1HD2  ASN  92          HD21      ASN  92 -14.450  -6.649   5.254
  754   2HD2  ASN  92          HD22      ASN  92 -13.495  -7.008   6.651
  755    H    ASP  93           HN       ASP  93 -12.589  -4.943   0.918
  756    HA   ASP  93           HA       ASP  93 -12.022  -6.881  -1.074
  757   1HB   ASP  93          HB1       ASP  93 -13.909  -4.974  -0.840
  758   2HB   ASP  93          HB2       ASP  93 -12.810  -4.155  -1.938
  759    H    LEU  94           HN       LEU  94 -10.476  -3.705  -0.362
  760    HA   LEU  94           HA       LEU  94  -8.904  -3.429  -2.596
  761   1HB   LEU  94          HB1       LEU  94  -9.058  -2.321   0.108
  762   2HB   LEU  94          HB2       LEU  94  -7.467  -2.314  -0.560
  763    HG   LEU  94           HG       LEU  94  -9.779  -1.201  -2.116
  764   1HD1  LEU  94          HD11      LEU  94  -9.639  -0.150   0.143
  765   2HD1  LEU  94          HD12      LEU  94  -9.350   0.974  -1.188
  766   3HD1  LEU  94          HD13      LEU  94  -7.994   0.358  -0.246
  767   1HD2  LEU  94          HD21      LEU  94  -8.171   0.152  -3.261
  768   2HD2  LEU  94          HD22      LEU  94  -7.574  -1.507  -3.296
  769   3HD2  LEU  94          HD23      LEU  94  -6.882  -0.345  -2.165
  770    H    ILE  95           HN       ILE  95  -8.214  -5.292   0.345
  771    HA   ILE  95           HA       ILE  95  -5.540  -5.977  -0.217
  772    HB   ILE  95           HB       ILE  95  -7.469  -7.656   1.388
  773   1HG1  ILE  95          HG11      ILE  95  -5.875  -5.333   2.491
  774   2HG1  ILE  95          HG12      ILE  95  -7.525  -5.129   1.911
  775   1HG2  ILE  95          HG21      ILE  95  -5.445  -8.079   2.788
  776   2HG2  ILE  95          HG22      ILE  95  -4.486  -7.193   1.603
  777   3HG2  ILE  95          HG23      ILE  95  -5.294  -8.690   1.139
  778   1HD1  ILE  95          HD11      ILE  95  -6.726  -7.069   4.082
  779   2HD1  ILE  95          HD12      ILE  95  -8.364  -6.650   3.578
  780   3HD1  ILE  95          HD13      ILE  95  -7.352  -5.446   4.375
  781    H    THR  96           HN       THR  96  -8.563  -7.819  -0.811
  782    HA   THR  96           HA       THR  96  -7.510 -10.044  -2.073
  783    HB   THR  96           HB       THR  96 -10.084  -8.859  -3.067
  784    HG1  THR  96           HG1      THR  96 -10.290  -8.672  -0.850
  785   1HG2  THR  96          HG21      THR  96  -9.247 -11.677  -2.347
  786   2HG2  THR  96          HG22      THR  96  -9.314 -11.022  -3.984
  787   3HG2  THR  96          HG23      THR  96 -10.796 -11.197  -3.044
  788    H    TYR  97           HN       TYR  97  -8.339  -6.907  -3.608
  789    HA   TYR  97           HA       TYR  97  -7.718  -7.652  -6.238
  790   1HB   TYR  97          HB1       TYR  97  -8.940  -5.631  -5.826
  791   2HB   TYR  97          HB2       TYR  97  -7.601  -4.948  -4.912
  792    HD1  TYR  97           HD1      TYR  97  -6.411  -3.291  -5.965
  793    HD2  TYR  97           HD2      TYR  97  -8.106  -6.459  -8.328
  794    HE1  TYR  97           HE1      TYR  97  -5.492  -2.242  -8.023
  795    HE2  TYR  97           HE2      TYR  97  -7.297  -5.354 -10.406
  796    HH   TYR  97           HH       TYR  97  -4.953  -3.140 -10.524
  797    H    LEU  98           HN       LEU  98  -5.580  -5.847  -3.971
  798    HA   LEU  98           HA       LEU  98  -3.271  -5.903  -5.544
  799   1HB   LEU  98          HB1       LEU  98  -3.977  -4.808  -3.151
  800   2HB   LEU  98          HB2       LEU  98  -2.888  -6.087  -2.621
  801    HG   LEU  98           HG       LEU  98  -1.094  -5.224  -4.032
  802   1HD1  LEU  98          HD11      LEU  98  -2.394  -4.409  -5.920
  803   2HD1  LEU  98          HD12      LEU  98  -1.413  -3.094  -5.271
  804   3HD1  LEU  98          HD13      LEU  98  -3.138  -3.171  -4.907
  805   1HD2  LEU  98          HD21      LEU  98  -2.449  -3.044  -2.435
  806   2HD2  LEU  98          HD22      LEU  98  -0.781  -2.990  -3.006
  807   3HD2  LEU  98          HD23      LEU  98  -1.271  -4.210  -1.831
  808    H    LYS  99           HN       LYS  99  -4.270  -8.060  -2.946
  809    HA   LYS  99           HA       LYS  99  -2.215  -9.895  -2.932
  810   1HB   LYS  99          HB1       LYS  99  -3.508 -10.530  -1.226
  811   2HB   LYS  99          HB2       LYS  99  -4.915  -9.736  -1.907
  812   1HG   LYS  99          HG1       LYS  99  -5.410 -11.714  -3.246
  813   2HG   LYS  99          HG2       LYS  99  -3.969 -12.508  -2.643
  814   1HD   LYS  99          HD1       LYS  99  -5.779 -11.667  -0.504
  815   2HD   LYS  99          HD2       LYS  99  -6.530 -12.786  -1.646
  816   1HE   LYS  99          HE1       LYS  99  -5.327 -13.810   0.347
  817   2HE   LYS  99          HE2       LYS  99  -4.934 -14.453  -1.241
  818   1HZ   LYS  99          HZ1       LYS  99  -3.208 -12.322  -0.465
  819   2HZ   LYS  99          HZ2       LYS  99  -2.827 -13.886  -0.997
  820   3HZ   LYS  99          HZ3       LYS  99  -3.188 -13.615   0.637
  821    H    LYS 100           HN       LYS 100  -5.035  -9.815  -5.118
  822    HA   LYS 100           HA       LYS 100  -4.440 -12.238  -6.451
  823   1HB   LYS 100          HB1       LYS 100  -6.636 -10.776  -6.267
  824   2HB   LYS 100          HB2       LYS 100  -6.096 -10.228  -7.837
  825   1HG   LYS 100          HG1       LYS 100  -7.802 -12.148  -7.748
  826   2HG   LYS 100          HG2       LYS 100  -6.413 -12.349  -8.819
  827   1HD   LYS 100          HD1       LYS 100  -6.062 -13.285  -6.065
  828   2HD   LYS 100          HD2       LYS 100  -7.271 -14.147  -6.964
  829   1HE   LYS 100          HE1       LYS 100  -5.547 -15.544  -7.301
  830   2HE   LYS 100          HE2       LYS 100  -5.154 -14.426  -8.617
  831   1HZ   LYS 100          HZ1       LYS 100  -4.123 -14.039  -5.850
  832   2HZ   LYS 100          HZ2       LYS 100  -3.601 -13.289  -7.274
  833   3HZ   LYS 100          HZ3       LYS 100  -3.277 -14.931  -7.020
  834    H    ALA 101           HN       ALA 101  -3.443  -9.076  -7.054
  835    HA   ALA 101           HA       ALA 101  -2.275  -9.376  -9.635
  836   1HB   ALA 101          HB1       ALA 101  -1.969  -7.127  -7.647
  837   2HB   ALA 101          HB2       ALA 101  -3.341  -7.301  -8.741
  838   3HB   ALA 101          HB3       ALA 101  -1.719  -7.061  -9.392
  839    H    THR 102           HN       THR 102  -1.030  -9.393  -6.319
  840    HA   THR 102           HA       THR 102   1.750  -9.578  -7.024
  841    HB   THR 102           HB       THR 102   0.629 -10.215  -4.308
  842    HG1  THR 102           HG1      THR 102  -0.135  -8.124  -5.255
  843   1HG2  THR 102          HG21      THR 102   3.219  -9.000  -5.282
  844   2HG2  THR 102          HG22      THR 102   3.003 -10.566  -4.498
  845   3HG2  THR 102          HG23      THR 102   2.740  -9.080  -3.586
  846    H    GLU 103           HN       GLU 103  -0.774 -11.874  -5.985
  847    HA   GLU 103           HA       GLU 103   1.035 -14.074  -6.761
  848   1HB   GLU 103          HB1       GLU 103  -0.472 -15.380  -4.984
  849   2HB   GLU 103          HB2       GLU 103   1.012 -14.558  -4.532
  850   1HG   GLU 103          HG1       GLU 103  -0.165 -13.490  -2.996
  851   2HG   GLU 103          HG2       GLU 103  -0.935 -12.603  -4.306
  852    HHA  HEC 104           HA       HEC 104   5.083   3.320   1.399
  853    HHB  HEC 104           HB       HEC 104  -0.568   0.453  -0.030
  854    HHC  HEC 104           HC       HEC 104  -3.088   6.246  -1.477
  855    HHD  HEC 104           HD       HEC 104   2.841   8.799  -1.242
  856   1HMA  HEC 104          HMA1      HEC 104   1.195  -1.004   1.775
  857   2HMA  HEC 104          HMA2      HEC 104   2.729  -1.345   0.972
  858   3HMA  HEC 104          HMA3      HEC 104   1.257  -1.151   0.018
  859   1HAA  HEC 104          HAA1      HEC 104   4.245  -0.365   1.944
  860   2HAA  HEC 104          HAA2      HEC 104   4.915   1.196   2.384
  861   1HBA  HEC 104          HBA1      HEC 104   5.822   1.422   0.084
  862   2HBA  HEC 104          HBA2      HEC 104   5.211  -0.181  -0.291
  863   1HMB  HEC 104          HMB1      HEC 104  -2.434   0.156  -0.700
  864   2HMB  HEC 104          HMB2      HEC 104  -3.331   0.795  -2.078
  865   3HMB  HEC 104          HMB3      HEC 104  -4.024   0.880  -0.459
  866    HAB  HEC 104           HAB      HEC 104  -4.488   4.917  -1.593
  867   1HBB  HEC 104          HBB1      HEC 104  -4.860   3.623   0.649
  868   2HBB  HEC 104          HBB2      HEC 104  -5.835   2.582  -0.387
  869   3HBB  HEC 104          HBB3      HEC 104  -6.194   4.306  -0.280
  870   1HMC  HEC 104          HMC1      HEC 104  -3.147   8.817  -1.559
  871   2HMC  HEC 104          HMC2      HEC 104  -2.777   8.141  -3.146
  872   3HMC  HEC 104          HMC3      HEC 104  -2.180   9.742  -2.708
  873    HAC  HEC 104           HAC      HEC 104   1.665   9.886  -2.508
  874   1HBC  HEC 104          HBC1      HEC 104   0.836  11.221  -0.809
  875   2HBC  HEC 104          HBC2      HEC 104  -0.812  11.166  -1.432
  876   3HBC  HEC 104          HBC3      HEC 104   0.433  12.057  -2.307
  877   1HMD  HEC 104          HMD1      HEC 104   4.956   9.174  -0.279
  878   2HMD  HEC 104          HMD2      HEC 104   5.436   8.233  -1.691
  879   3HMD  HEC 104          HMD3      HEC 104   6.430   8.206  -0.234
  880   1HAD  HEC 104          HAD1      HEC 104   7.225   6.311   0.501
  881   2HAD  HEC 104          HAD2      HEC 104   6.763   4.746   1.160
  882   1HBD  HEC 104          HBD1      HEC 104   6.205   5.629   3.228
  883   2HBD  HEC 104          HBD2      HEC 104   5.893   7.225   2.581
  884    H2   4NL 105           H2       4NL 105   0.262 -13.292  -0.900
  885    H6   4NL 105           H6       4NL 105   1.584 -13.201   4.419
  886    H3   4NL 105           H3       4NL 105  -1.359 -10.354   1.859
  887    H5   4NL 105           H5       4NL 105  -1.911 -10.451  -0.323
  888    H4   4NL 105           H4       4NL 105   0.120 -11.244   3.680
  889    H1   4NL 105           H1       4NL 105   1.742 -14.183   0.919
  890    H7   4NL 105           H7       4NL 105   2.790 -13.670   3.197
  Start of MODEL   16
    1   1H    THR  -5          HT1       THR  -5  -9.769  -5.814  13.282
    2   2H    THR  -5          HT2       THR  -5 -11.323  -6.481  13.353
    3   3H    THR  -5          HT3       THR  -5 -10.774  -5.780  11.914
    4    HA   THR  -5           HA       THR  -5  -9.273  -7.487  11.485
    5    HB   THR  -5           HB       THR  -5  -9.864  -9.001  13.988
    6    HG1  THR  -5           HG1      THR  -5  -7.865  -7.761  14.776
    7   1HG2  THR  -5          HG21      THR  -5  -7.278  -8.458  12.520
    8   2HG2  THR  -5          HG22      THR  -5  -8.361  -9.798  12.140
    9   3HG2  THR  -5          HG23      THR  -5  -7.582  -9.715  13.721
   10    H    GLU  -4           HN       GLU  -4 -11.656  -7.175  10.484
   11    HA   GLU  -4           HA       GLU  -4 -12.960  -9.799  10.650
   12   1HB   GLU  -4          HB1       GLU  -4 -14.242  -7.862  11.870
   13   2HB   GLU  -4          HB2       GLU  -4 -14.588  -7.282  10.245
   14   1HG   GLU  -4          HG1       GLU  -4 -15.193 -10.121  10.989
   15   2HG   GLU  -4          HG2       GLU  -4 -16.294  -8.831  11.456
   16    H    PHE  -3           HN       PHE  -3 -11.242  -9.806   8.888
   17    HA   PHE  -3           HA       PHE  -3 -11.751  -8.373   6.476
   18   1HB   PHE  -3          HB1       PHE  -3  -9.479  -8.845   6.861
   19   2HB   PHE  -3          HB2       PHE  -3  -9.791 -10.552   7.148
   20    HD1  PHE  -3           HD1      PHE  -3  -9.929  -7.938   4.457
   21    HD2  PHE  -3           HD2      PHE  -3  -9.505 -12.109   5.417
   22    HE1  PHE  -3           HE1      PHE  -3  -9.531  -8.449   2.056
   23    HE2  PHE  -3           HE2      PHE  -3  -9.157 -12.628   3.009
   24    HZ   PHE  -3           HZ       PHE  -3  -9.200 -10.800   1.322
   25    H    LYS  -2           HN       LYS  -2 -13.226  -8.709   5.124
   26    HA   LYS  -2           HA       LYS  -2 -14.324 -11.376   4.581
   27   1HB   LYS  -2          HB1       LYS  -2 -15.534  -8.720   4.963
   28   2HB   LYS  -2          HB2       LYS  -2 -16.107  -9.548   3.516
   29   1HG   LYS  -2          HG1       LYS  -2 -16.616 -11.546   4.912
   30   2HG   LYS  -2          HG2       LYS  -2 -16.161 -10.622   6.341
   31   1HD   LYS  -2          HD1       LYS  -2 -17.957  -8.967   5.736
   32   2HD   LYS  -2          HD2       LYS  -2 -18.465 -10.071   4.460
   33   1HE   LYS  -2          HE1       LYS  -2 -19.915 -10.536   6.248
   34   2HE   LYS  -2          HE2       LYS  -2 -18.718 -11.825   6.309
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.574 -10.602   8.079
   36   2HZ   LYS  -2          HZ2       LYS  -2 -19.161 -10.992   8.508
   37   3HZ   LYS  -2          HZ3       LYS  -2 -18.787  -9.416   8.036
   38    H    ALA  -1           HN       ALA  -1 -13.862 -12.193   2.690
   39    HA   ALA  -1           HA       ALA  -1 -12.056 -11.141   0.879
   40   1HB   ALA  -1          HB1       ALA  -1 -12.666 -13.063  -0.525
   41   2HB   ALA  -1          HB2       ALA  -1 -14.084 -13.343   0.487
   42   3HB   ALA  -1          HB3       ALA  -1 -12.467 -13.519   1.169
   43    H    GLY   1           HN       GLY   1 -12.189 -10.175  -1.100
   44   1HA   GLY   1          HA1       GLY   1 -14.773  -9.040  -1.954
   45   2HA   GLY   1          HA2       GLY   1 -13.223  -8.236  -2.145
   46    H    SER   2           HN       SER   2 -13.265  -8.008  -4.301
   47    HA   SER   2           HA       SER   2 -12.620 -10.271  -5.972
   48   1HB   SER   2          HB1       SER   2 -14.880  -8.606  -7.005
   49   2HB   SER   2          HB2       SER   2 -14.440 -10.273  -7.399
   50    HG   SER   2           HG       SER   2 -15.044 -10.710  -5.112
   51    H    ALA   3           HN       ALA   3 -11.411  -9.661  -7.751
   52    HA   ALA   3           HA       ALA   3  -9.997  -7.314  -7.741
   53   1HB   ALA   3          HB1       ALA   3  -9.190  -7.948  -9.933
   54   2HB   ALA   3          HB2       ALA   3 -10.548  -9.056 -10.137
   55   3HB   ALA   3          HB3       ALA   3  -9.336  -9.369  -8.897
   56    H    LYS   4           HN       LYS   4 -13.084  -7.819  -9.496
   57    HA   LYS   4           HA       LYS   4 -12.892  -5.364 -10.913
   58   1HB   LYS   4          HB1       LYS   4 -14.124  -7.466 -11.634
   59   2HB   LYS   4          HB2       LYS   4 -15.444  -6.891 -10.616
   60   1HG   LYS   4          HG1       LYS   4 -14.575  -4.691 -12.180
   61   2HG   LYS   4          HG2       LYS   4 -14.737  -6.066 -13.265
   62   1HD   LYS   4          HD1       LYS   4 -17.005  -6.133 -13.050
   63   2HD   LYS   4          HD2       LYS   4 -16.965  -5.621 -11.359
   64   1HE   LYS   4          HE1       LYS   4 -16.327  -3.753 -13.647
   65   2HE   LYS   4          HE2       LYS   4 -17.959  -3.948 -13.005
   66   1HZ   LYS   4          HZ1       LYS   4 -15.645  -3.217 -11.311
   67   2HZ   LYS   4          HZ2       LYS   4 -17.287  -3.124 -10.924
   68   3HZ   LYS   4          HZ3       LYS   4 -16.633  -2.064 -12.066
   69    H    LYS   5           HN       LYS   5 -13.304  -5.570  -7.737
   70    HA   LYS   5           HA       LYS   5 -15.073  -3.208  -7.624
   71   1HB   LYS   5          HB1       LYS   5 -14.675  -5.337  -5.508
   72   2HB   LYS   5          HB2       LYS   5 -15.536  -3.827  -5.240
   73   1HG   LYS   5          HG1       LYS   5 -17.084  -4.503  -7.131
   74   2HG   LYS   5          HG2       LYS   5 -16.318  -6.093  -7.071
   75   1HD   LYS   5          HD1       LYS   5 -17.187  -5.095  -4.448
   76   2HD   LYS   5          HD2       LYS   5 -18.510  -5.328  -5.591
   77   1HE   LYS   5          HE1       LYS   5 -18.259  -7.376  -4.388
   78   2HE   LYS   5          HE2       LYS   5 -17.611  -7.648  -6.005
   79   1HZ   LYS   5          HZ1       LYS   5 -15.376  -7.121  -5.004
   80   2HZ   LYS   5          HZ2       LYS   5 -16.084  -8.584  -4.522
   81   3HZ   LYS   5          HZ3       LYS   5 -16.119  -7.245  -3.485
   82    H    GLY   6           HN       GLY   6 -12.345  -4.783  -5.915
   83   1HA   GLY   6          HA1       GLY   6 -11.451  -2.536  -4.503
   84   2HA   GLY   6          HA2       GLY   6 -10.443  -3.894  -4.977
   85    H    ALA   7           HN       ALA   7 -10.862  -3.448  -7.868
   86    HA   ALA   7           HA       ALA   7  -8.741  -1.735  -8.450
   87   1HB   ALA   7          HB1       ALA   7  -9.314  -2.048 -10.780
   88   2HB   ALA   7          HB2       ALA   7 -10.916  -2.638 -10.337
   89   3HB   ALA   7          HB3       ALA   7  -9.485  -3.575  -9.913
   90    H    THR   8           HN       THR   8 -12.292  -1.050  -8.864
   91    HA   THR   8           HA       THR   8 -11.977   1.532  -9.869
   92    HB   THR   8           HB       THR   8 -14.271   1.824  -8.424
   93    HG1  THR   8           HG1      THR   8 -14.104  -0.343  -7.674
   94   1HG2  THR   8          HG21      THR   8 -14.006   2.175 -10.843
   95   2HG2  THR   8          HG22      THR   8 -15.441   1.217 -10.475
   96   3HG2  THR   8          HG23      THR   8 -13.987   0.428 -11.088
   97    H    LEU   9           HN       LEU   9 -11.952   0.534  -6.479
   98    HA   LEU   9           HA       LEU   9 -11.987   3.118  -5.326
   99   1HB   LEU   9          HB1       LEU   9 -10.852   0.577  -4.119
  100   2HB   LEU   9          HB2       LEU   9 -11.404   2.009  -3.252
  101    HG   LEU   9           HG       LEU   9 -13.213   0.285  -4.960
  102   1HD1  LEU   9          HD11      LEU   9 -13.011   0.372  -1.948
  103   2HD1  LEU   9          HD12      LEU   9 -12.300  -0.895  -2.947
  104   3HD1  LEU   9          HD13      LEU   9 -14.048  -0.672  -2.921
  105   1HD2  LEU   9          HD21      LEU   9 -15.012   1.447  -3.704
  106   2HD2  LEU   9          HD22      LEU   9 -14.065   2.552  -4.700
  107   3HD2  LEU   9          HD23      LEU   9 -13.793   2.482  -2.958
  108    H    PHE  10           HN       PHE  10  -9.289   0.789  -5.603
  109    HA   PHE  10           HA       PHE  10  -7.162   2.388  -4.909
  110   1HB   PHE  10          HB1       PHE  10  -7.131  -0.070  -5.279
  111   2HB   PHE  10          HB2       PHE  10  -7.175   0.215  -7.012
  112    HD1  PHE  10           HD1      PHE  10  -5.212   1.738  -7.962
  113    HD2  PHE  10           HD2      PHE  10  -5.103  -0.418  -4.243
  114    HE1  PHE  10           HE1      PHE  10  -2.720   1.771  -8.011
  115    HE2  PHE  10           HE2      PHE  10  -2.622  -0.271  -4.230
  116    HZ   PHE  10           HZ       PHE  10  -1.424   0.799  -6.122
  117    H    LYS  11           HN       LYS  11  -8.781   2.204  -8.043
  118    HA   LYS  11           HA       LYS  11  -6.892   3.513  -9.625
  119   1HB   LYS  11          HB1       LYS  11  -9.285   2.276 -10.069
  120   2HB   LYS  11          HB2       LYS  11  -9.672   3.956 -10.441
  121   1HG   LYS  11          HG1       LYS  11  -8.702   3.713 -12.429
  122   2HG   LYS  11          HG2       LYS  11  -7.161   3.463 -11.613
  123   1HD   LYS  11          HD1       LYS  11  -9.148   1.266 -12.225
  124   2HD   LYS  11          HD2       LYS  11  -7.755   1.657 -13.234
  125   1HE   LYS  11          HE1       LYS  11  -6.241   1.117 -11.393
  126   2HE   LYS  11          HE2       LYS  11  -7.611   0.805 -10.331
  127   1HZ   LYS  11          HZ1       LYS  11  -8.244  -1.043 -11.789
  128   2HZ   LYS  11          HZ2       LYS  11  -6.696  -1.255 -11.144
  129   3HZ   LYS  11          HZ3       LYS  11  -6.875  -0.757 -12.749
  130    H    THR  12           HN       THR  12  -9.120   4.960  -7.397
  131    HA   THR  12           HA       THR  12  -8.112   7.620  -8.038
  132    HB   THR  12           HB       THR  12 -10.291   7.258  -9.138
  133    HG1  THR  12           HG1      THR  12  -9.354   9.318  -7.930
  134   1HG2  THR  12          HG21      THR  12 -11.504   6.014  -7.395
  135   2HG2  THR  12          HG22      THR  12 -12.362   7.466  -7.912
  136   3HG2  THR  12          HG23      THR  12 -11.490   7.456  -6.378
  137    H    ARG  13           HN       ARG  13  -7.455   5.702  -5.998
  138    HA   ARG  13           HA       ARG  13  -7.745   7.343  -3.578
  139   1HB   ARG  13          HB1       ARG  13  -8.167   4.370  -3.820
  140   2HB   ARG  13          HB2       ARG  13  -7.781   5.131  -2.291
  141   1HG   ARG  13          HG1       ARG  13 -10.218   5.709  -3.964
  142   2HG   ARG  13          HG2       ARG  13 -10.170   4.656  -2.559
  143   1HD   ARG  13          HD1       ARG  13 -10.831   6.480  -1.421
  144   2HD   ARG  13          HD2       ARG  13  -9.147   7.000  -1.561
  145    HE   ARG  13           HE       ARG  13  -9.927   7.641  -3.763
  146   1HH1  ARG  13          HH11      ARG  13 -11.658   8.105  -0.761
  147   2HH1  ARG  13          HH12      ARG  13 -12.259   9.701  -1.025
  148   1HH2  ARG  13          HH21      ARG  13 -10.884  10.074  -4.135
  149   2HH2  ARG  13          HH22      ARG  13 -11.857  10.770  -2.887
  150    H    CYS  14           HN       CYS  14  -5.872   5.038  -5.414
  151    HA   CYS  14           HA       CYS  14  -3.477   5.657  -3.817
  152   1HB   CYS  14          HB1       CYS  14  -3.873   2.968  -5.063
  153   2HB   CYS  14          HB2       CYS  14  -2.800   3.428  -3.759
  154    H    LEU  15           HN       LEU  15  -4.791   4.767  -6.980
  155    HA   LEU  15           HA       LEU  15  -2.559   4.578  -8.540
  156   1HB   LEU  15          HB1       LEU  15  -5.099   4.376  -9.082
  157   2HB   LEU  15          HB2       LEU  15  -4.963   6.072  -9.528
  158    HG   LEU  15           HG       LEU  15  -3.104   5.446 -11.106
  159   1HD1  LEU  15          HD11      LEU  15  -4.037   2.619 -10.626
  160   2HD1  LEU  15          HD12      LEU  15  -2.525   3.286 -10.012
  161   3HD1  LEU  15          HD13      LEU  15  -2.787   3.152 -11.751
  162   1HD2  LEU  15          HD21      LEU  15  -5.791   4.150 -11.561
  163   2HD2  LEU  15          HD22      LEU  15  -4.580   4.418 -12.815
  164   3HD2  LEU  15          HD23      LEU  15  -5.325   5.793 -11.998
  165    H    GLN  16           HN       GLN  16  -4.086   7.602  -7.494
  166    HA   GLN  16           HA       GLN  16  -2.980   9.550  -8.945
  167   1HB   GLN  16          HB1       GLN  16  -2.905  10.872  -6.712
  168   2HB   GLN  16          HB2       GLN  16  -4.438  10.273  -7.325
  169   1HG   GLN  16          HG1       GLN  16  -3.709   8.183  -5.766
  170   2HG   GLN  16          HG2       GLN  16  -2.948   9.514  -4.892
  171   1HE2  GLN  16          HE21      GLN  16  -4.286  11.012  -3.822
  172   2HE2  GLN  16          HE22      GLN  16  -5.993  10.802  -3.698
  173    H    CYS  17           HN       CYS  17  -1.130   7.779  -6.476
  174    HA   CYS  17           HA       CYS  17   1.305   9.179  -7.348
  175   1HB   CYS  17          HB1       CYS  17   1.319   8.000  -4.646
  176   2HB   CYS  17          HB2       CYS  17   1.988   9.506  -5.250
  177    H    HIS  18           HN       HIS  18  -0.017   6.052  -6.353
  178    HA   HIS  18           HA       HIS  18   2.530   4.676  -6.608
  179   1HB   HIS  18          HB1       HIS  18  -0.202   3.950  -5.623
  180   2HB   HIS  18          HB2       HIS  18   0.979   2.698  -5.957
  181    HD1  HIS  18           HD1      HIS  18   3.395   3.138  -4.498
  182    HD2  HIS  18           HD2      HIS  18  -0.209   4.814  -3.185
  183    HE1  HIS  18           HE1      HIS  18   3.688   3.582  -2.018
  184    H    THR  19           HN       THR  19   2.205   2.378  -7.479
  185    HA   THR  19           HA       THR  19   0.828   2.266 -10.059
  186    HB   THR  19           HB       THR  19   3.151   0.841 -10.470
  187    HG1  THR  19           HG1      THR  19   4.642   2.763 -10.020
  188   1HG2  THR  19          HG21      THR  19   2.024   2.347 -12.082
  189   2HG2  THR  19          HG22      THR  19   3.769   2.593 -12.019
  190   3HG2  THR  19          HG23      THR  19   2.689   3.729 -11.213
  191    H    VAL  20           HN       VAL  20  -0.431   0.472 -10.189
  192    HA   VAL  20           HA       VAL  20  -0.436  -1.502  -8.113
  193    HB   VAL  20           HB       VAL  20  -2.327  -0.388  -9.615
  194   1HG1  VAL  20          HG11      VAL  20  -1.807  -1.566 -11.656
  195   2HG1  VAL  20          HG12      VAL  20  -3.400  -2.027 -11.055
  196   3HG1  VAL  20          HG13      VAL  20  -2.030  -3.118 -10.844
  197   1HG2  VAL  20          HG21      VAL  20  -2.900  -1.379  -7.566
  198   2HG2  VAL  20          HG22      VAL  20  -2.479  -2.994  -8.132
  199   3HG2  VAL  20          HG23      VAL  20  -3.893  -2.174  -8.787
  200    H    GLU  21           HN       GLU  21   0.597  -1.530 -11.437
  201    HA   GLU  21           HA       GLU  21   1.327  -4.376 -11.324
  202   1HB   GLU  21          HB1       GLU  21   1.657  -3.793 -13.921
  203   2HB   GLU  21          HB2       GLU  21   0.101  -4.274 -13.274
  204   1HG   GLU  21          HG1       GLU  21   0.084  -2.310 -14.864
  205   2HG   GLU  21          HG2       GLU  21  -0.725  -2.052 -13.321
  206    H    LYS  22           HN       LYS  22   3.439  -4.538 -13.120
  207    HA   LYS  22           HA       LYS  22   5.373  -2.690 -11.943
  208   1HB   LYS  22          HB1       LYS  22   5.422  -5.486 -12.347
  209   2HB   LYS  22          HB2       LYS  22   6.730  -4.775 -13.306
  210   1HG   LYS  22          HG1       LYS  22   7.778  -3.853 -11.476
  211   2HG   LYS  22          HG2       LYS  22   6.281  -3.725 -10.553
  212   1HD   LYS  22          HD1       LYS  22   6.306  -6.025 -10.014
  213   2HD   LYS  22          HD2       LYS  22   7.564  -6.363 -11.204
  214   1HE   LYS  22          HE1       LYS  22   8.548  -6.403  -8.999
  215   2HE   LYS  22          HE2       LYS  22   9.156  -5.007  -9.870
  216   1HZ   LYS  22          HZ1       LYS  22   7.470  -3.664  -8.589
  217   2HZ   LYS  22          HZ2       LYS  22   8.715  -4.322  -7.658
  218   3HZ   LYS  22          HZ3       LYS  22   7.185  -5.036  -7.641
  219    H    GLY  23           HN       GLY  23   3.716  -2.197 -14.540
  220   1HA   GLY  23          HA1       GLY  23   5.916  -1.818 -16.448
  221   2HA   GLY  23          HA2       GLY  23   4.204  -1.648 -16.799
  222    H    GLY  24           HN       GLY  24   3.938   0.067 -14.300
  223   1HA   GLY  24          HA1       GLY  24   4.419   2.632 -15.523
  224   2HA   GLY  24          HA2       GLY  24   3.579   2.319 -14.013
  225    HA   PRO  25           HA       PRO  25   8.351   3.263 -13.432
  226   1HB   PRO  25          HB1       PRO  25   8.441   5.992 -13.796
  227   2HB   PRO  25          HB2       PRO  25   8.965   4.809 -14.999
  228   1HG   PRO  25          HG1       PRO  25   6.381   6.300 -14.805
  229   2HG   PRO  25          HG2       PRO  25   7.349   5.914 -16.240
  230   1HD   PRO  25          HD1       PRO  25   5.132   4.526 -15.605
  231   2HD   PRO  25          HD2       PRO  25   6.540   3.748 -16.357
  232    H    HIS  26           HN       HIS  26   9.091   4.297 -11.491
  233    HA   HIS  26           HA       HIS  26   7.237   4.451  -9.405
  234   1HB   HIS  26          HB1       HIS  26  10.077   5.448  -9.677
  235   2HB   HIS  26          HB2       HIS  26   9.192   5.494  -8.163
  236    HD2  HIS  26           HD2      HIS  26  11.513   3.342 -10.101
  237    HE1  HIS  26           HE1      HIS  26   9.813   0.737  -7.211
  238    HE2  HIS  26           HE2      HIS  26  11.679   1.025  -8.908
  239    H    LYS  27           HN       LYS  27   5.755   6.038  -9.065
  240    HA   LYS  27           HA       LYS  27   6.214   8.727 -10.114
  241   1HB   LYS  27          HB1       LYS  27   4.174   7.263 -10.684
  242   2HB   LYS  27          HB2       LYS  27   3.584   7.690  -9.082
  243   1HG   LYS  27          HG1       LYS  27   3.933  10.132  -9.789
  244   2HG   LYS  27          HG2       LYS  27   4.080   9.505 -11.434
  245   1HD   LYS  27          HD1       LYS  27   1.694   9.348  -9.584
  246   2HD   LYS  27          HD2       LYS  27   1.787  10.089 -11.187
  247   1HE   LYS  27          HE1       LYS  27   1.014   8.155 -12.023
  248   2HE   LYS  27          HE2       LYS  27   2.568   7.439 -11.591
  249   1HZ   LYS  27          HZ1       LYS  27   0.131   7.508  -9.895
  250   2HZ   LYS  27          HZ2       LYS  27   1.628   6.895  -9.408
  251   3HZ   LYS  27          HZ3       LYS  27   0.785   6.146 -10.666
  252    H    VAL  28           HN       VAL  28   4.074   9.618  -8.042
  253    HA   VAL  28           HA       VAL  28   5.799  10.800  -6.165
  254    HB   VAL  28           HB       VAL  28   2.844  10.362  -5.755
  255   1HG1  VAL  28          HG11      VAL  28   4.206  11.320  -3.878
  256   2HG1  VAL  28          HG12      VAL  28   2.918  12.376  -4.458
  257   3HG1  VAL  28          HG13      VAL  28   4.590  12.684  -4.930
  258   1HG2  VAL  28          HG21      VAL  28   3.007  11.311  -7.964
  259   2HG2  VAL  28          HG22      VAL  28   4.190  12.499  -7.419
  260   3HG2  VAL  28          HG23      VAL  28   2.524  12.592  -6.852
  261    H    GLY  29           HN       GLY  29   4.225   7.731  -6.251
  262   1HA   GLY  29          HA1       GLY  29   5.256   6.990  -3.588
  263   2HA   GLY  29          HA2       GLY  29   3.715   6.413  -4.199
  264    HA   PRO  30           HA       PRO  30   7.482   3.675  -5.508
  265   1HB   PRO  30          HB1       PRO  30   7.323   1.730  -3.622
  266   2HB   PRO  30          HB2       PRO  30   8.334   3.169  -3.449
  267   1HG   PRO  30          HG1       PRO  30   5.609   2.626  -2.327
  268   2HG   PRO  30          HG2       PRO  30   7.026   3.334  -1.527
  269   1HD   PRO  30          HD1       PRO  30   5.007   4.852  -2.459
  270   2HD   PRO  30          HD2       PRO  30   6.694   5.406  -2.497
  271    H    ASN  31           HN       ASN  31   7.371   1.382  -6.214
  272    HA   ASN  31           HA       ASN  31   4.814   0.773  -7.339
  273   1HB   ASN  31          HB1       ASN  31   6.948   0.454  -8.544
  274   2HB   ASN  31          HB2       ASN  31   7.435  -0.764  -7.374
  275   1HD2  ASN  31          HD21      ASN  31   5.264  -0.097 -10.062
  276   2HD2  ASN  31          HD22      ASN  31   4.916  -1.763 -10.384
  277    H    LEU  32           HN       LEU  32   3.251  -0.460  -6.453
  278    HA   LEU  32           HA       LEU  32   3.563  -1.744  -3.882
  279   1HB   LEU  32          HB1       LEU  32   1.157  -1.093  -5.585
  280   2HB   LEU  32          HB2       LEU  32   1.063  -1.860  -4.012
  281    HG   LEU  32           HG       LEU  32   2.147   0.921  -4.547
  282   1HD1  LEU  32          HD11      LEU  32   0.151   1.738  -3.495
  283   2HD1  LEU  32          HD12      LEU  32  -0.374   0.103  -3.097
  284   3HD1  LEU  32          HD13      LEU  32  -0.336   0.629  -4.779
  285   1HD2  LEU  32          HD21      LEU  32   2.256   1.202  -2.154
  286   2HD2  LEU  32          HD22      LEU  32   3.214  -0.211  -2.596
  287   3HD2  LEU  32          HD23      LEU  32   1.611  -0.419  -1.890
  288    H    HIS  33           HN       HIS  33   3.502  -2.787  -7.130
  289    HA   HIS  33           HA       HIS  33   2.269  -5.299  -7.038
  290   1HB   HIS  33          HB1       HIS  33   2.876  -3.857  -9.052
  291   2HB   HIS  33          HB2       HIS  33   4.518  -4.467  -8.872
  292    HD2  HIS  33           HD2      HIS  33   1.211  -6.521  -8.621
  293    HE1  HIS  33           HE1      HIS  33   3.467  -8.076 -11.869
  294    HE2  HIS  33           HE2      HIS  33   1.398  -8.403 -10.429
  295    H    GLY  34           HN       GLY  34   2.985  -6.463  -5.253
  296   1HA   GLY  34          HA1       GLY  34   4.351  -8.466  -4.889
  297   2HA   GLY  34          HA2       GLY  34   5.745  -7.506  -5.338
  298    H    ILE  35           HN       ILE  35   3.528  -5.795  -3.264
  299    HA   ILE  35           HA       ILE  35   5.473  -5.635  -1.234
  300    HB   ILE  35           HB       ILE  35   3.794  -4.587   0.208
  301   1HG1  ILE  35          HG11      ILE  35   1.880  -5.353  -1.965
  302   2HG1  ILE  35          HG12      ILE  35   1.635  -5.291  -0.221
  303   1HG2  ILE  35          HG21      ILE  35   3.650  -2.553  -1.163
  304   2HG2  ILE  35          HG22      ILE  35   4.113  -3.496  -2.579
  305   3HG2  ILE  35          HG23      ILE  35   5.235  -3.324  -1.230
  306   1HD1  ILE  35          HD11      ILE  35   1.558  -2.838  -0.314
  307   2HD1  ILE  35          HD12      ILE  35   0.332  -3.561  -1.357
  308   3HD1  ILE  35          HD13      ILE  35   1.806  -2.898  -2.061
  309    H    PHE  36           HN       PHE  36   2.713  -7.846  -1.500
  310    HA   PHE  36           HA       PHE  36   2.711  -8.817   1.112
  311   1HB   PHE  36          HB1       PHE  36   1.925 -10.274  -1.418
  312   2HB   PHE  36          HB2       PHE  36   1.499 -10.760   0.222
  313    HD1  PHE  36           HD1      PHE  36   0.527  -8.590   1.630
  314    HD2  PHE  36           HD2      PHE  36   0.172  -9.309  -2.597
  315    HE1  PHE  36           HE1      PHE  36  -1.463  -7.099   1.551
  316    HE2  PHE  36           HE2      PHE  36  -1.819  -7.819  -2.679
  317    HZ   PHE  36           HZ       PHE  36  -2.631  -6.705  -0.608
  318    H    GLY  37           HN       GLY  37   4.452  -9.430   2.095
  319   1HA   GLY  37          HA1       GLY  37   5.876 -11.245   2.732
  320   2HA   GLY  37          HA2       GLY  37   6.155 -11.581   1.034
  321    H    ARG  38           HN       ARG  38   6.339  -8.295   1.236
  322    HA   ARG  38           HA       ARG  38   9.266  -8.278   1.377
  323   1HB   ARG  38          HB1       ARG  38   7.170  -6.570   0.085
  324   2HB   ARG  38          HB2       ARG  38   8.694  -5.811   0.523
  325   1HG   ARG  38          HG1       ARG  38   9.898  -7.482  -0.841
  326   2HG   ARG  38          HG2       ARG  38   8.348  -8.183  -1.313
  327   1HD   ARG  38          HD1       ARG  38   7.729  -6.276  -2.549
  328   2HD   ARG  38          HD2       ARG  38   8.944  -5.266  -1.763
  329    HE   ARG  38           HE       ARG  38   9.720  -7.360  -2.716
  330   1HH1  ARG  38          HH21      ARG  38   8.819  -4.214  -3.801
  331   2HH1  ARG  38          HH22      ARG  38  10.149  -4.031  -4.820
  332   1HH2  ARG  38          HH11      ARG  38  11.304  -7.096  -5.066
  333   2HH2  ARG  38          HH12      ARG  38  10.742  -5.748  -5.959
  334    H    HIS  39           HN       HIS  39  10.158  -6.161   2.300
  335    HA   HIS  39           HA       HIS  39   8.879  -5.637   4.896
  336   1HB   HIS  39          HB1       HIS  39  11.774  -5.338   4.031
  337   2HB   HIS  39          HB2       HIS  39  11.154  -4.956   5.640
  338    HD2  HIS  39           HD2      HIS  39  10.071  -7.103   7.055
  339    HE1  HIS  39           HE1      HIS  39  12.126 -10.097   4.837
  340    HE2  HIS  39           HE2      HIS  39  10.712  -9.634   6.896
  341    H    SER  40           HN       SER  40   8.867  -3.422   5.692
  342    HA   SER  40           HA       SER  40   8.059  -1.489   3.898
  343   1HB   SER  40          HB1       SER  40   9.389  -0.685   6.473
  344   2HB   SER  40          HB2       SER  40   8.067   0.106   5.627
  345    HG   SER  40           HG       SER  40   6.888  -1.940   6.145
  346    H    GLY  41           HN       GLY  41   9.063  -0.374   2.407
  347   1HA   GLY  41          HA1       GLY  41  10.721   1.104   1.604
  348   2HA   GLY  41          HA2       GLY  41  11.821   0.519   2.829
  349    H    GLN  42           HN       GLN  42  10.110  -1.495   0.342
  350    HA   GLN  42           HA       GLN  42  12.777  -2.241  -0.620
  351   1HB   GLN  42          HB1       GLN  42  10.308  -3.896  -0.323
  352   2HB   GLN  42          HB2       GLN  42  11.614  -4.401  -1.388
  353   1HG   GLN  42          HG1       GLN  42  13.158  -4.072   0.636
  354   2HG   GLN  42          HG2       GLN  42  11.683  -4.019   1.596
  355   1HE2  GLN  42          HE21      GLN  42  12.441  -5.966   2.685
  356   2HE2  GLN  42          HE22      GLN  42  12.340  -7.500   1.903
  357    H    ALA  43           HN       ALA  43  11.130  -0.016  -1.901
  358    HA   ALA  43           HA       ALA  43  10.349  -0.925  -4.474
  359   1HB   ALA  43          HB1       ALA  43   9.612   1.170  -3.271
  360   2HB   ALA  43          HB2       ALA  43   9.955   1.330  -4.992
  361   3HB   ALA  43          HB3       ALA  43  11.129   1.894  -3.805
  362    H    GLU  44           HN       GLU  44  11.431  -1.311  -6.287
  363    HA   GLU  44           HA       GLU  44  14.248  -1.337  -6.405
  364   1HB   GLU  44          HB1       GLU  44  12.411  -1.821  -8.761
  365   2HB   GLU  44          HB2       GLU  44  14.023  -2.475  -8.486
  366   1HG   GLU  44          HG1       GLU  44  12.811  -4.302  -7.865
  367   2HG   GLU  44          HG2       GLU  44  12.872  -3.483  -6.317
  368    H    GLY  45           HN       GLY  45  14.666   0.928  -5.962
  369   1HA   GLY  45          HA1       GLY  45  16.055   2.517  -7.246
  370   2HA   GLY  45          HA2       GLY  45  14.728   2.626  -8.382
  371    H    TYR  46           HN       TYR  46  12.879   2.685  -5.868
  372    HA   TYR  46           HA       TYR  46  12.932   5.569  -5.533
  373   1HB   TYR  46          HB1       TYR  46  10.888   4.573  -6.319
  374   2HB   TYR  46          HB2       TYR  46  10.816   3.520  -4.913
  375    HD1  TYR  46           HD1      TYR  46  10.115   6.847  -6.237
  376    HD2  TYR  46           HD2      TYR  46  10.379   4.483  -2.660
  377    HE1  TYR  46           HE1      TYR  46   8.686   8.507  -5.051
  378    HE2  TYR  46           HE2      TYR  46   8.861   6.072  -1.487
  379    HH   TYR  46           HH       TYR  46   7.143   8.571  -3.196
  380    H    SER  47           HN       SER  47  13.052   6.668  -3.628
  381    HA   SER  47           HA       SER  47  14.268   5.284  -1.375
  382   1HB   SER  47          HB1       SER  47  14.090   8.164  -1.086
  383   2HB   SER  47          HB2       SER  47  15.514   7.123  -1.120
  384    HG   SER  47           HG       SER  47  15.512   7.221  -3.347
  385    H    TYR  48           HN       TYR  48  13.588   5.356   0.674
  386    HA   TYR  48           HA       TYR  48  10.885   6.238   1.376
  387   1HB   TYR  48          HB1       TYR  48  12.614   3.933   2.269
  388   2HB   TYR  48          HB2       TYR  48  11.125   4.379   3.096
  389    HD1  TYR  48           HD1      TYR  48   8.970   3.986   2.125
  390    HD2  TYR  48           HD2      TYR  48  12.549   3.021  -0.053
  391    HE1  TYR  48           HE1      TYR  48   7.642   2.540   0.600
  392    HE2  TYR  48           HE2      TYR  48  11.232   1.573  -1.585
  393    HH   TYR  48           HH       TYR  48   8.229   0.394  -0.786
  394    H    THR  49           HN       THR  49  10.567   6.926   3.717
  395    HA   THR  49           HA       THR  49  12.422   8.910   4.567
  396    HB   THR  49           HB       THR  49  10.908   8.796   6.718
  397    HG1  THR  49           HG1      THR  49   9.061   7.801   4.861
  398   1HG2  THR  49          HG21      THR  49  10.015   9.828   4.041
  399   2HG2  THR  49          HG22      THR  49  10.921  10.694   5.282
  400   3HG2  THR  49          HG23      THR  49   9.241  10.238   5.572
  401    H    ASP  50           HN       ASP  50  13.300   9.130   6.753
  402    HA   ASP  50           HA       ASP  50  15.057   7.158   7.540
  403   1HB   ASP  50          HB1       ASP  50  15.533   9.347   8.202
  404   2HB   ASP  50          HB2       ASP  50  13.921   9.603   8.864
  405    H    ALA  51           HN       ALA  51  11.741   7.645   8.599
  406    HA   ALA  51           HA       ALA  51  11.877   5.748  10.760
  407   1HB   ALA  51          HB1       ALA  51   9.560   7.330   9.648
  408   2HB   ALA  51          HB2       ALA  51  10.601   7.808  10.989
  409   3HB   ALA  51          HB3       ALA  51   9.550   6.401  11.149
  410    H    ASN  52           HN       ASN  52  10.628   5.664   7.406
  411    HA   ASN  52           HA       ASN  52   9.078   3.294   7.814
  412   1HB   ASN  52          HB1       ASN  52   8.239   4.574   6.089
  413   2HB   ASN  52          HB2       ASN  52   9.833   4.988   5.472
  414   1HD2  ASN  52          HD21      ASN  52   7.168   2.818   5.152
  415   2HD2  ASN  52          HD22      ASN  52   7.859   1.945   3.833
  416    H    ILE  53           HN       ILE  53  12.346   3.896   6.595
  417    HA   ILE  53           HA       ILE  53  12.937   1.262   5.795
  418    HB   ILE  53           HB       ILE  53  14.744   3.512   6.630
  419   1HG1  ILE  53          HG11      ILE  53  14.036   2.519   3.849
  420   2HG1  ILE  53          HG12      ILE  53  13.253   3.890   4.628
  421   1HG2  ILE  53          HG21      ILE  53  16.566   2.337   5.487
  422   2HG2  ILE  53          HG22      ILE  53  15.490   0.983   5.138
  423   3HG2  ILE  53          HG23      ILE  53  15.929   1.351   6.805
  424   1HD1  ILE  53          HD11      ILE  53  15.414   5.065   4.719
  425   2HD1  ILE  53          HD12      ILE  53  14.967   4.644   3.067
  426   3HD1  ILE  53          HD13      ILE  53  16.185   3.695   3.918
  427    H    LYS  54           HN       LYS  54  14.334   2.857   8.722
  428    HA   LYS  54           HA       LYS  54  15.060   0.784  10.252
  429   1HB   LYS  54          HB1       LYS  54  13.558   3.251  11.112
  430   2HB   LYS  54          HB2       LYS  54  14.373   2.156  12.232
  431   1HG   LYS  54          HG1       LYS  54  16.392   2.552  10.521
  432   2HG   LYS  54          HG2       LYS  54  15.533   4.076  10.283
  433   1HD   LYS  54          HD1       LYS  54  15.543   3.774  13.037
  434   2HD   LYS  54          HD2       LYS  54  17.139   3.184  12.548
  435   1HE   LYS  54          HE1       LYS  54  17.236   5.590  12.953
  436   2HE   LYS  54          HE2       LYS  54  17.483   5.252  11.237
  437   1HZ   LYS  54          HZ1       LYS  54  15.025   6.265  12.537
  438   2HZ   LYS  54          HZ2       LYS  54  15.061   5.678  10.948
  439   3HZ   LYS  54          HZ3       LYS  54  15.982   7.035  11.367
  440    H    LYS  55           HN       LYS  55  11.833   1.200   9.227
  441    HA   LYS  55           HA       LYS  55  10.560  -0.178  11.433
  442   1HB   LYS  55          HB1       LYS  55   9.456   1.703  10.441
  443   2HB   LYS  55          HB2       LYS  55   9.531   0.982   8.851
  444   1HG   LYS  55          HG1       LYS  55   7.347   0.657   9.354
  445   2HG   LYS  55          HG2       LYS  55   8.023  -0.856   9.930
  446   1HD   LYS  55          HD1       LYS  55   7.459   1.510  11.719
  447   2HD   LYS  55          HD2       LYS  55   6.300   0.216  11.420
  448   1HE   LYS  55          HE1       LYS  55   9.033  -0.070  12.687
  449   2HE   LYS  55          HE2       LYS  55   7.477  -0.181  13.513
  450   1HZ   LYS  55          HZ1       LYS  55   8.315  -2.378  13.081
  451   2HZ   LYS  55          HZ2       LYS  55   8.513  -2.038  11.439
  452   3HZ   LYS  55          HZ3       LYS  55   6.959  -2.114  12.099
  453    H    ASN  56           HN       ASN  56  11.442  -0.975   8.136
  454    HA   ASN  56           HA       ASN  56  11.016  -2.743   6.767
  455   1HB   ASN  56          HB1       ASN  56  13.050  -3.216   8.790
  456   2HB   ASN  56          HB2       ASN  56  12.463  -4.705   8.083
  457   1HD2  ASN  56          HD21      ASN  56  13.948  -1.542   7.183
  458   2HD2  ASN  56          HD22      ASN  56  14.360  -2.227   5.672
  459    H    VAL  57           HN       VAL  57   8.615  -2.643   8.040
  460    HA   VAL  57           HA       VAL  57   7.961  -5.102   9.349
  461    HB   VAL  57           HB       VAL  57   6.729  -2.627   9.076
  462   1HG1  VAL  57          HG11      VAL  57   4.889  -4.728   7.934
  463   2HG1  VAL  57          HG12      VAL  57   5.430  -3.260   7.120
  464   3HG1  VAL  57          HG13      VAL  57   4.389  -3.149   8.540
  465   1HG2  VAL  57          HG21      VAL  57   6.856  -3.949  11.059
  466   2HG2  VAL  57          HG22      VAL  57   5.847  -5.206  10.344
  467   3HG2  VAL  57          HG23      VAL  57   5.158  -3.625  10.707
  468    H    LEU  58           HN       LEU  58   6.940  -6.925   8.519
  469    HA   LEU  58           HA       LEU  58   7.313  -7.284   5.666
  470   1HB   LEU  58          HB1       LEU  58   8.144  -8.963   7.334
  471   2HB   LEU  58          HB2       LEU  58   6.469  -9.346   7.710
  472    HG   LEU  58           HG       LEU  58   7.345  -9.495   4.846
  473   1HD1  LEU  58          HD11      LEU  58   7.812 -11.723   6.833
  474   2HD1  LEU  58          HD12      LEU  58   9.085 -10.677   6.203
  475   3HD1  LEU  58          HD13      LEU  58   8.189 -11.731   5.109
  476   1HD2  LEU  58          HD21      LEU  58   5.766 -11.388   4.799
  477   2HD2  LEU  58          HD22      LEU  58   4.988  -9.907   5.355
  478   3HD2  LEU  58          HD23      LEU  58   5.442 -11.153   6.517
  479    H    TRP  59           HN       TRP  59   5.742  -6.304   4.569
  480    HA   TRP  59           HA       TRP  59   3.073  -5.967   5.282
  481   1HB   TRP  59          HB1       TRP  59   4.249  -6.140   2.508
  482   2HB   TRP  59          HB2       TRP  59   2.705  -5.421   2.926
  483    HD1  TRP  59           HD1      TRP  59   5.962  -4.396   1.973
  484    HE1  TRP  59           HE1      TRP  59   6.525  -2.022   2.808
  485    HE3  TRP  59           HE3      TRP  59   2.227  -3.765   5.409
  486    HZ2  TRP  59           HZ2      TRP  59   5.624  -0.167   4.789
  487    HZ3  TRP  59           HZ3      TRP  59   2.089  -1.683   6.723
  488    HH2  TRP  59           HH2      TRP  59   3.756   0.114   6.432
  489    H    ASP  60           HN       ASP  60   1.653  -7.437   5.642
  490    HA   ASP  60           HA       ASP  60   1.359  -9.875   4.049
  491   1HB   ASP  60          HB1       ASP  60   1.832 -10.955   5.954
  492   2HB   ASP  60          HB2       ASP  60   1.792  -9.467   6.880
  493    H    GLU  61           HN       GLU  61  -1.054 -10.737   4.866
  494    HA   GLU  61           HA       GLU  61  -2.858  -9.071   3.433
  495   1HB   GLU  61          HB1       GLU  61  -2.840 -11.701   3.819
  496   2HB   GLU  61          HB2       GLU  61  -3.881 -11.282   5.175
  497   1HG   GLU  61          HG1       GLU  61  -5.577 -11.366   3.714
  498   2HG   GLU  61          HG2       GLU  61  -4.968  -9.831   3.089
  499    H    ASN  62           HN       ASN  62  -2.622  -9.916   6.898
  500    HA   ASN  62           HA       ASN  62  -4.634  -8.001   7.654
  501   1HB   ASN  62          HB1       ASN  62  -4.467 -10.098   8.832
  502   2HB   ASN  62          HB2       ASN  62  -2.790  -9.789   9.248
  503   1HD2  ASN  62          HD21      ASN  62  -2.348  -8.140  10.806
  504   2HD2  ASN  62          HD22      ASN  62  -3.563  -7.651  11.930
  505    H    ASN  63           HN       ASN  63  -1.051  -8.148   8.050
  506    HA   ASN  63           HA       ASN  63  -0.631  -5.836   9.458
  507   1HB   ASN  63          HB1       ASN  63   1.165  -7.295   9.130
  508   2HB   ASN  63          HB2       ASN  63   0.998  -7.269   7.385
  509   1HD2  ASN  63          HD21      ASN  63   1.925  -5.149  10.131
  510   2HD2  ASN  63          HD22      ASN  63   2.836  -4.163   9.043
  511    H    MET  64           HN       MET  64  -0.904  -5.895   5.829
  512    HA   MET  64           HA       MET  64  -0.413  -3.166   5.468
  513   1HB   MET  64          HB1       MET  64  -0.420  -4.786   3.647
  514   2HB   MET  64          HB2       MET  64  -2.157  -4.993   3.817
  515   1HG   MET  64          HG1       MET  64  -2.428  -2.580   3.264
  516   2HG   MET  64          HG2       MET  64  -0.706  -2.505   2.944
  517   1HE   MET  64          HE1       MET  64  -3.334  -5.290   2.116
  518   2HE   MET  64          HE2       MET  64  -3.733  -4.939   0.433
  519   3HE   MET  64          HE3       MET  64  -4.224  -3.822   1.707
  520    H    SER  65           HN       SER  65  -3.465  -4.741   6.370
  521    HA   SER  65           HA       SER  65  -5.100  -2.434   6.095
  522   1HB   SER  65          HB1       SER  65  -5.871  -4.589   7.997
  523   2HB   SER  65          HB2       SER  65  -6.847  -3.725   6.817
  524    HG   SER  65           HG       SER  65  -5.330  -6.015   6.545
  525    H    GLU  66           HN       GLU  66  -3.414  -3.816   8.903
  526    HA   GLU  66           HA       GLU  66  -4.466  -2.139  10.889
  527   1HB   GLU  66          HB1       GLU  66  -2.849  -3.092  12.281
  528   2HB   GLU  66          HB2       GLU  66  -3.033  -4.311  11.024
  529   1HG   GLU  66          HG1       GLU  66  -1.060  -3.083   9.871
  530   2HG   GLU  66          HG2       GLU  66  -0.777  -2.391  11.468
  531    H    TYR  67           HN       TYR  67  -1.733  -1.744   8.722
  532    HA   TYR  67           HA       TYR  67  -0.734   0.719   9.741
  533   1HB   TYR  67          HB1       TYR  67   0.865  -0.532   8.675
  534   2HB   TYR  67          HB2       TYR  67  -0.228  -1.056   7.407
  535    HD1  TYR  67           HD1      TYR  67  -0.432   0.172   5.340
  536    HD2  TYR  67           HD2      TYR  67   1.935   1.690   8.587
  537    HE1  TYR  67           HE1      TYR  67   0.701   1.740   3.772
  538    HE2  TYR  67           HE2      TYR  67   3.117   3.225   7.030
  539    HH   TYR  67           HH       TYR  67   2.090   3.772   3.802
  540    H    LEU  68           HN       LEU  68  -2.933  -0.045   6.981
  541    HA   LEU  68           HA       LEU  68  -2.949   2.519   5.872
  542   1HB   LEU  68          HB1       LEU  68  -5.026   0.351   5.893
  543   2HB   LEU  68          HB2       LEU  68  -5.251   1.856   5.020
  544    HG   LEU  68           HG       LEU  68  -3.076  -0.192   4.521
  545   1HD1  LEU  68          HD11      LEU  68  -4.308  -0.453   2.392
  546   2HD1  LEU  68          HD12      LEU  68  -5.509   0.707   2.959
  547   3HD1  LEU  68          HD13      LEU  68  -5.314  -0.837   3.788
  548   1HD2  LEU  68          HD21      LEU  68  -2.338   2.195   4.073
  549   2HD2  LEU  68          HD22      LEU  68  -3.660   2.308   2.912
  550   3HD2  LEU  68          HD23      LEU  68  -2.358   1.147   2.655
  551    H    THR  69           HN       THR  69  -4.894   1.347   8.625
  552    HA   THR  69           HA       THR  69  -6.785   3.363   8.774
  553    HB   THR  69           HB       THR  69  -5.789   2.613  11.406
  554    HG1  THR  69           HG1      THR  69  -5.188   0.703  10.600
  555   1HG2  THR  69          HG21      THR  69  -8.081   3.417  11.053
  556   2HG2  THR  69          HG22      THR  69  -8.089   1.762  11.662
  557   3HG2  THR  69          HG23      THR  69  -8.389   2.073   9.953
  558    H    ASN  70           HN       ASN  70  -3.393   3.532   9.737
  559    HA   ASN  70           HA       ASN  70  -3.419   6.366   9.712
  560   1HB   ASN  70          HB1       ASN  70  -4.467   5.972  11.935
  561   2HB   ASN  70          HB2       ASN  70  -3.009   5.127  12.444
  562   1HD2  ASN  70          HD21      ASN  70  -2.912   6.765  14.148
  563   2HD2  ASN  70          HD22      ASN  70  -2.008   8.166  13.696
  564    HA   PRO  71           HA       PRO  71   0.660   4.501   8.591
  565   1HB   PRO  71          HB1       PRO  71   1.283   6.608   6.921
  566   2HB   PRO  71          HB2       PRO  71   0.454   5.134   6.413
  567   1HG   PRO  71          HG1       PRO  71  -0.686   7.810   7.105
  568   2HG   PRO  71          HG2       PRO  71  -1.148   6.695   5.805
  569   1HD   PRO  71          HD1       PRO  71  -2.596   6.908   8.055
  570   2HD   PRO  71          HD2       PRO  71  -2.388   5.350   7.228
  571    H    LYS  72           HN       LYS  72  -0.261   7.644   9.792
  572    HA   LYS  72           HA       LYS  72   2.322   8.677  10.361
  573   1HB   LYS  72          HB1       LYS  72  -0.420   9.410  11.378
  574   2HB   LYS  72          HB2       LYS  72   1.034  10.251  11.888
  575   1HG   LYS  72          HG1       LYS  72   1.467  10.936   9.585
  576   2HG   LYS  72          HG2       LYS  72   0.041  10.056   9.045
  577   1HD   LYS  72          HD1       LYS  72  -0.185  12.234  11.103
  578   2HD   LYS  72          HD2       LYS  72  -0.120  12.619   9.383
  579   1HE   LYS  72          HE1       LYS  72  -2.411  12.499   9.889
  580   2HE   LYS  72          HE2       LYS  72  -2.041  10.978   9.092
  581   1HZ   LYS  72          HZ1       LYS  72  -2.106  11.234  12.037
  582   2HZ   LYS  72          HZ2       LYS  72  -2.168   9.825  11.107
  583   3HZ   LYS  72          HZ3       LYS  72  -3.490  10.875  11.123
  584    H    LYS  73           HN       LYS  73   0.077   6.691  12.220
  585    HA   LYS  73           HA       LYS  73   1.673   6.891  14.616
  586   1HB   LYS  73          HB1       LYS  73  -0.699   6.657  14.901
  587   2HB   LYS  73          HB2       LYS  73  -0.720   5.176  13.956
  588   1HG   LYS  73          HG1       LYS  73  -0.923   4.644  16.304
  589   2HG   LYS  73          HG2       LYS  73   0.619   4.055  15.698
  590   1HD   LYS  73          HD1       LYS  73   1.402   6.463  16.622
  591   2HD   LYS  73          HD2       LYS  73   0.039   6.172  17.700
  592   1HE   LYS  73          HE1       LYS  73   1.846   5.278  18.871
  593   2HE   LYS  73          HE2       LYS  73   1.127   3.864  18.107
  594   1HZ   LYS  73          HZ1       LYS  73   2.834   4.358  16.259
  595   2HZ   LYS  73          HZ2       LYS  73   3.352   3.597  17.677
  596   3HZ   LYS  73          HZ3       LYS  73   3.636   5.248  17.458
  597    H    TYR  74           HN       TYR  74   1.225   4.427  12.095
  598    HA   TYR  74           HA       TYR  74   2.946   2.494  13.264
  599   1HB   TYR  74          HB1       TYR  74   1.104   2.370  11.362
  600   2HB   TYR  74          HB2       TYR  74   2.513   2.580  10.322
  601    HD1  TYR  74           HD1      TYR  74   3.875   0.692   9.771
  602    HD2  TYR  74           HD2      TYR  74   1.217   0.577  13.148
  603    HE1  TYR  74           HE1      TYR  74   4.331  -1.748  10.045
  604    HE2  TYR  74           HE2      TYR  74   1.654  -1.847  13.430
  605    HH   TYR  74           HH       TYR  74   2.373  -3.772  11.808
  606    H    ILE  75           HN       ILE  75   3.485   4.951  10.797
  607    HA   ILE  75           HA       ILE  75   6.393   4.668  11.087
  608    HB   ILE  75           HB       ILE  75   4.907   5.220   8.505
  609   1HG1  ILE  75          HG11      ILE  75   6.574   2.825   9.364
  610   2HG1  ILE  75          HG12      ILE  75   4.834   2.826   9.122
  611   1HG2  ILE  75          HG21      ILE  75   7.863   5.099   9.160
  612   2HG2  ILE  75          HG22      ILE  75   6.953   6.500   8.597
  613   3HG2  ILE  75          HG23      ILE  75   7.215   5.129   7.519
  614   1HD1  ILE  75          HD11      ILE  75   5.078   3.051   6.761
  615   2HD1  ILE  75          HD12      ILE  75   6.199   1.790   7.273
  616   3HD1  ILE  75          HD13      ILE  75   6.800   3.406   6.907
  617    HA   PRO  76           HA       PRO  76   5.107   8.895  12.397
  618   1HB   PRO  76          HB1       PRO  76   7.155   9.176  14.176
  619   2HB   PRO  76          HB2       PRO  76   5.619   8.397  14.571
  620   1HG   PRO  76          HG1       PRO  76   8.240   7.157  13.839
  621   2HG   PRO  76          HG2       PRO  76   7.078   6.667  15.085
  622   1HD   PRO  76          HD1       PRO  76   7.255   5.422  12.690
  623   2HD   PRO  76          HD2       PRO  76   5.723   5.580  13.572
  624    H    GLY  77           HN       GLY  77   5.638  10.026  10.553
  625   1HA   GLY  77          HA1       GLY  77   7.127  11.859   9.914
  626   2HA   GLY  77          HA2       GLY  77   8.471  10.767  10.183
  627    H    THR  78           HN       THR  78   5.889   9.187   8.626
  628    HA   THR  78           HA       THR  78   7.300   8.831   6.172
  629    HB   THR  78           HB       THR  78   5.532   7.346   7.523
  630    HG1  THR  78           HG1      THR  78   6.764   7.196   5.184
  631   1HG2  THR  78          HG21      THR  78   3.902   8.269   5.158
  632   2HG2  THR  78          HG22      THR  78   3.552   8.682   6.837
  633   3HG2  THR  78          HG23      THR  78   3.490   6.999   6.313
  634    H    LYS  79           HN       LYS  79   6.776   9.434   4.096
  635    HA   LYS  79           HA       LYS  79   5.362  11.976   3.847
  636   1HB   LYS  79          HB1       LYS  79   6.335  11.952   1.540
  637   2HB   LYS  79          HB2       LYS  79   7.516  11.917   2.839
  638   1HG   LYS  79          HG1       LYS  79   7.899   9.546   2.476
  639   2HG   LYS  79          HG2       LYS  79   6.637   9.512   1.235
  640   1HD   LYS  79          HD1       LYS  79   7.923  10.651  -0.305
  641   2HD   LYS  79          HD2       LYS  79   8.827  11.523   0.941
  642   1HE   LYS  79          HE1       LYS  79  10.256   9.882  -0.198
  643   2HE   LYS  79          HE2       LYS  79  10.045   9.472   1.505
  644   1HZ   LYS  79          HZ1       LYS  79   8.355   8.289  -0.615
  645   2HZ   LYS  79          HZ2       LYS  79   8.573   7.752   0.972
  646   3HZ   LYS  79          HZ3       LYS  79   9.829   7.599  -0.145
  647    H    MET  80           HN       MET  80   3.908   9.167   3.959
  648    HA   MET  80           HA       MET  80   2.622   9.124   1.379
  649   1HB   MET  80          HB1       MET  80   2.911   6.961   2.092
  650   2HB   MET  80          HB2       MET  80   2.552   7.350   3.778
  651   1HG   MET  80          HG1       MET  80   0.276   7.373   3.443
  652   2HG   MET  80          HG2       MET  80   0.422   7.693   1.725
  653   1HE   MET  80          HE1       MET  80  -1.631   5.648   3.184
  654   2HE   MET  80          HE2       MET  80  -1.627   4.358   1.981
  655   3HE   MET  80          HE3       MET  80  -1.635   6.043   1.465
  656    H    ALA  81           HN       ALA  81   1.667  11.075   1.224
  657    HA   ALA  81           HA       ALA  81  -0.256  12.087   3.050
  658   1HB   ALA  81          HB1       ALA  81  -0.390  13.960   1.607
  659   2HB   ALA  81          HB2       ALA  81   0.318  13.058   0.268
  660   3HB   ALA  81          HB3       ALA  81   1.297  13.450   1.681
  661    H    PHE  82           HN       PHE  82  -1.656  10.295   3.092
  662    HA   PHE  82           HA       PHE  82  -3.941  10.438   1.318
  663   1HB   PHE  82          HB1       PHE  82  -2.745   8.537   0.539
  664   2HB   PHE  82          HB2       PHE  82  -2.543   7.914   2.172
  665    HD1  PHE  82           HD1      PHE  82  -5.147   8.694  -0.404
  666    HD2  PHE  82           HD2      PHE  82  -4.082   6.398   3.075
  667    HE1  PHE  82           HE1      PHE  82  -7.295   7.447  -0.567
  668    HE2  PHE  82           HE2      PHE  82  -6.232   5.162   2.920
  669    HZ   PHE  82           HZ       PHE  82  -7.847   5.701   1.112
  670    H    GLY  83           HN       GLY  83  -2.894  10.494   4.566
  671   1HA   GLY  83          HA1       GLY  83  -4.180  10.914   6.453
  672   2HA   GLY  83          HA2       GLY  83  -5.621  10.709   5.482
  673    H    GLY  84           HN       GLY  84  -5.367   8.061   4.660
  674   1HA   GLY  84          HA1       GLY  84  -4.946   5.831   5.473
  675   2HA   GLY  84          HA2       GLY  84  -5.120   6.440   7.108
  676    H    LEU  85           HN       LEU  85  -6.550   4.487   5.022
  677    HA   LEU  85           HA       LEU  85  -9.314   5.224   5.150
  678   1HB   LEU  85          HB1       LEU  85  -7.811   2.820   4.172
  679   2HB   LEU  85          HB2       LEU  85  -9.552   2.758   4.350
  680    HG   LEU  85           HG       LEU  85  -8.061   4.710   2.574
  681   1HD1  LEU  85          HD11      LEU  85  -9.617   2.190   1.953
  682   2HD1  LEU  85          HD12      LEU  85  -7.883   2.434   1.742
  683   3HD1  LEU  85          HD13      LEU  85  -9.027   3.335   0.748
  684   1HD2  LEU  85          HD21      LEU  85 -11.014   4.177   2.957
  685   2HD2  LEU  85          HD22      LEU  85 -10.352   5.003   1.547
  686   3HD2  LEU  85          HD23      LEU  85 -10.164   5.711   3.150
  687    H    LYS  86           HN       LYS  86 -10.335   5.215   6.921
  688    HA   LYS  86           HA       LYS  86  -9.814   3.598   9.233
  689   1HB   LYS  86          HB1       LYS  86 -12.077   5.556   8.896
  690   2HB   LYS  86          HB2       LYS  86 -11.268   5.066  10.378
  691   1HG   LYS  86          HG1       LYS  86  -9.649   6.425   8.268
  692   2HG   LYS  86          HG2       LYS  86 -10.751   7.397   9.246
  693   1HD   LYS  86          HD1       LYS  86  -9.670   6.517  11.295
  694   2HD   LYS  86          HD2       LYS  86  -8.541   5.608  10.292
  695   1HE   LYS  86          HE1       LYS  86  -8.823   8.605  10.105
  696   2HE   LYS  86          HE2       LYS  86  -7.710   7.831  11.230
  697   1HZ   LYS  86          HZ1       LYS  86  -6.517   6.871   9.434
  698   2HZ   LYS  86          HZ2       LYS  86  -6.708   8.512   9.080
  699   3HZ   LYS  86          HZ3       LYS  86  -7.677   7.369   8.302
  700    H    LYS  87           HN       LYS  87 -11.890   3.251   6.553
  701    HA   LYS  87           HA       LYS  87 -13.937   1.677   7.910
  702   1HB   LYS  87          HB1       LYS  87 -13.525   2.444   5.030
  703   2HB   LYS  87          HB2       LYS  87 -14.852   1.466   5.595
  704   1HG   LYS  87          HG1       LYS  87 -14.786   4.075   6.930
  705   2HG   LYS  87          HG2       LYS  87 -14.954   4.179   5.151
  706   1HD   LYS  87          HD1       LYS  87 -16.355   1.927   5.796
  707   2HD   LYS  87          HD2       LYS  87 -16.710   2.940   7.153
  708   1HE   LYS  87          HE1       LYS  87 -18.561   2.979   5.714
  709   2HE   LYS  87          HE2       LYS  87 -17.746   4.540   5.466
  710   1HZ   LYS  87          HZ1       LYS  87 -18.315   3.247   3.376
  711   2HZ   LYS  87          HZ2       LYS  87 -17.128   2.137   3.828
  712   3HZ   LYS  87          HZ3       LYS  87 -16.699   3.746   3.513
  713    H    GLU  88           HN       GLU  88 -13.002  -0.280   8.466
  714    HA   GLU  88           HA       GLU  88 -11.243  -1.878   7.081
  715   1HB   GLU  88          HB1       GLU  88 -12.042  -2.112   9.446
  716   2HB   GLU  88          HB2       GLU  88 -13.488  -2.893   8.812
  717   1HG   GLU  88          HG1       GLU  88 -11.902  -4.541   7.655
  718   2HG   GLU  88          HG2       GLU  88 -10.642  -3.877   8.705
  719    H    LYS  89           HN       LYS  89 -14.818  -2.102   6.841
  720    HA   LYS  89           HA       LYS  89 -14.944  -4.355   5.217
  721   1HB   LYS  89          HB1       LYS  89 -16.958  -2.156   4.936
  722   2HB   LYS  89          HB2       LYS  89 -17.204  -3.900   5.006
  723   1HG   LYS  89          HG1       LYS  89 -16.071  -2.506   7.390
  724   2HG   LYS  89          HG2       LYS  89 -17.795  -2.374   7.066
  725   1HD   LYS  89          HD1       LYS  89 -17.625  -4.194   8.543
  726   2HD   LYS  89          HD2       LYS  89 -17.748  -4.963   6.952
  727   1HE   LYS  89          HE1       LYS  89 -15.570  -5.658   6.961
  728   2HE   LYS  89          HE2       LYS  89 -15.016  -4.258   7.878
  729   1HZ   LYS  89          HZ1       LYS  89 -14.802  -5.825   9.469
  730   2HZ   LYS  89          HZ2       LYS  89 -16.004  -6.827   8.827
  731   3HZ   LYS  89          HZ3       LYS  89 -16.440  -5.470   9.734
  732    H    ASP  90           HN       ASP  90 -14.581  -1.025   4.381
  733    HA   ASP  90           HA       ASP  90 -14.691  -1.102   1.609
  734   1HB   ASP  90          HB1       ASP  90 -13.527   0.744   3.678
  735   2HB   ASP  90          HB2       ASP  90 -13.403   1.100   1.970
  736    H    ARG  91           HN       ARG  91 -11.860  -1.463   3.829
  737    HA   ARG  91           HA       ARG  91 -10.011  -1.712   1.636
  738   1HB   ARG  91          HB1       ARG  91  -9.362  -2.623   4.435
  739   2HB   ARG  91          HB2       ARG  91  -8.258  -2.079   3.177
  740   1HG   ARG  91          HG1       ARG  91  -8.994   0.183   3.405
  741   2HG   ARG  91          HG2       ARG  91 -10.307  -0.290   4.469
  742   1HD   ARG  91          HD1       ARG  91  -7.350  -0.328   5.081
  743   2HD   ARG  91          HD2       ARG  91  -8.556   0.758   5.753
  744    HE   ARG  91           HE       ARG  91  -8.851  -1.676   5.703
  745   1HH1  ARG  91          HH21      ARG  91  -7.583   0.835   7.744
  746   2HH1  ARG  91          HH22      ARG  91  -7.772   0.170   9.329
  747   1HH2  ARG  91          HH11      ARG  91  -9.154  -2.789   8.266
  748   2HH2  ARG  91          HH12      ARG  91  -8.684  -1.836   9.628
  749    H    ASN  92           HN       ASN  92 -11.730  -4.041   3.673
  750    HA   ASN  92           HA       ASN  92 -10.503  -6.391   3.192
  751   1HB   ASN  92          HB1       ASN  92 -13.454  -5.777   3.223
  752   2HB   ASN  92          HB2       ASN  92 -12.836  -7.420   3.155
  753   1HD2  ASN  92          HD21      ASN  92 -14.465  -6.616   5.189
  754   2HD2  ASN  92          HD22      ASN  92 -13.473  -6.800   6.594
  755    H    ASP  93           HN       ASP  93 -12.859  -4.996   0.863
  756    HA   ASP  93           HA       ASP  93 -12.354  -6.865  -1.198
  757   1HB   ASP  93          HB1       ASP  93 -14.203  -4.872  -0.789
  758   2HB   ASP  93          HB2       ASP  93 -13.233  -4.216  -2.098
  759    H    LEU  94           HN       LEU  94 -10.883  -3.624  -0.580
  760    HA   LEU  94           HA       LEU  94  -9.362  -3.370  -2.854
  761   1HB   LEU  94          HB1       LEU  94  -9.492  -2.192  -0.176
  762   2HB   LEU  94          HB2       LEU  94  -7.917  -2.161  -0.880
  763    HG   LEU  94           HG       LEU  94 -10.296  -1.150  -2.406
  764   1HD1  LEU  94          HD11      LEU  94 -10.120  -0.030  -0.185
  765   2HD1  LEU  94          HD12      LEU  94  -9.886   1.062  -1.555
  766   3HD1  LEU  94          HD13      LEU  94  -8.494   0.499  -0.631
  767   1HD2  LEU  94          HD21      LEU  94  -8.752   0.206  -3.634
  768   2HD2  LEU  94          HD22      LEU  94  -8.123  -1.440  -3.643
  769   3HD2  LEU  94          HD23      LEU  94  -7.421  -0.235  -2.565
  770    H    ILE  95           HN       ILE  95  -8.611  -5.178   0.099
  771    HA   ILE  95           HA       ILE  95  -5.923  -5.806  -0.461
  772    HB   ILE  95           HB       ILE  95  -7.876  -7.426   1.186
  773   1HG1  ILE  95          HG11      ILE  95  -6.065  -5.213   2.188
  774   2HG1  ILE  95          HG12      ILE  95  -7.742  -4.926   1.733
  775   1HG2  ILE  95          HG21      ILE  95  -5.612  -8.454   0.666
  776   2HG2  ILE  95          HG22      ILE  95  -5.990  -8.269   2.378
  777   3HG2  ILE  95          HG23      ILE  95  -4.895  -7.132   1.591
  778   1HD1  ILE  95          HD11      ILE  95  -6.769  -6.764   3.924
  779   2HD1  ILE  95          HD12      ILE  95  -8.454  -6.576   3.437
  780   3HD1  ILE  95          HD13      ILE  95  -7.581  -5.211   4.131
  781    H    THR  96           HN       THR  96  -8.943  -7.589  -1.167
  782    HA   THR  96           HA       THR  96  -7.837  -9.845  -2.381
  783    HB   THR  96           HB       THR  96 -10.430  -8.680  -3.359
  784    HG1  THR  96           HG1      THR  96  -9.873  -9.047  -0.823
  785   1HG2  THR  96          HG21      THR  96 -11.102 -11.039  -3.384
  786   2HG2  THR  96          HG22      THR  96  -9.525 -11.502  -2.741
  787   3HG2  THR  96          HG23      THR  96  -9.648 -10.795  -4.353
  788    H    TYR  97           HN       TYR  97  -8.628  -6.687  -3.872
  789    HA   TYR  97           HA       TYR  97  -8.007  -7.396  -6.516
  790   1HB   TYR  97          HB1       TYR  97  -9.190  -5.371  -6.140
  791   2HB   TYR  97          HB2       TYR  97  -7.912  -4.736  -5.111
  792    HD1  TYR  97           HD1      TYR  97  -6.797  -2.957  -6.040
  793    HD2  TYR  97           HD2      TYR  97  -8.042  -6.192  -8.585
  794    HE1  TYR  97           HE1      TYR  97  -5.736  -1.829  -7.985
  795    HE2  TYR  97           HE2      TYR  97  -7.091  -5.016 -10.560
  796    HH   TYR  97           HH       TYR  97  -4.897  -2.826 -10.525
  797    H    LEU  98           HN       LEU  98  -5.856  -5.703  -4.178
  798    HA   LEU  98           HA       LEU  98  -3.531  -5.782  -5.742
  799   1HB   LEU  98          HB1       LEU  98  -4.274  -4.778  -3.268
  800   2HB   LEU  98          HB2       LEU  98  -3.063  -5.993  -2.864
  801    HG   LEU  98           HG       LEU  98  -2.148  -3.652  -3.278
  802   1HD1  LEU  98          HD11      LEU  98  -0.250  -4.460  -4.655
  803   2HD1  LEU  98          HD12      LEU  98  -1.170  -5.917  -5.030
  804   3HD1  LEU  98          HD13      LEU  98  -0.674  -5.590  -3.369
  805   1HD2  LEU  98          HD21      LEU  98  -3.585  -3.089  -5.196
  806   2HD2  LEU  98          HD22      LEU  98  -2.819  -4.369  -6.138
  807   3HD2  LEU  98          HD23      LEU  98  -1.874  -2.975  -5.613
  808    H    LYS  99           HN       LYS  99  -4.700  -7.977  -3.258
  809    HA   LYS  99           HA       LYS  99  -2.672  -9.863  -3.220
  810   1HB   LYS  99          HB1       LYS  99  -4.021 -10.477  -1.548
  811   2HB   LYS  99          HB2       LYS  99  -5.397  -9.650  -2.254
  812   1HG   LYS  99          HG1       LYS  99  -5.832 -11.622  -3.672
  813   2HG   LYS  99          HG2       LYS  99  -4.475 -12.448  -2.931
  814   1HD   LYS  99          HD1       LYS  99  -6.453 -11.509  -0.984
  815   2HD   LYS  99          HD2       LYS  99  -7.114 -12.646  -2.162
  816   1HE   LYS  99          HE1       LYS  99  -6.032 -13.541   0.027
  817   2HE   LYS  99          HE2       LYS  99  -5.726 -14.358  -1.498
  818   1HZ   LYS  99          HZ1       LYS  99  -3.573 -13.893  -1.373
  819   2HZ   LYS  99          HZ2       LYS  99  -3.855 -13.537   0.261
  820   3HZ   LYS  99          HZ3       LYS  99  -3.845 -12.288  -0.881
  821    H    LYS 100           HN       LYS 100  -5.443  -9.635  -5.457
  822    HA   LYS 100           HA       LYS 100  -4.901 -12.042  -6.842
  823   1HB   LYS 100          HB1       LYS 100  -7.036 -10.439  -6.677
  824   2HB   LYS 100          HB2       LYS 100  -6.451  -9.993  -8.263
  825   1HG   LYS 100          HG1       LYS 100  -8.264 -11.836  -8.055
  826   2HG   LYS 100          HG2       LYS 100  -6.920 -12.099  -9.171
  827   1HD   LYS 100          HD1       LYS 100  -6.498 -12.998  -6.415
  828   2HD   LYS 100          HD2       LYS 100  -7.767 -13.836  -7.253
  829   1HE   LYS 100          HE1       LYS 100  -6.080 -15.290  -7.590
  830   2HE   LYS 100          HE2       LYS 100  -5.755 -14.243  -8.981
  831   1HZ   LYS 100          HZ1       LYS 100  -4.133 -13.025  -7.709
  832   2HZ   LYS 100          HZ2       LYS 100  -3.760 -14.670  -7.598
  833   3HZ   LYS 100          HZ3       LYS 100  -4.513 -13.889  -6.297
  834    H    ALA 101           HN       ALA 101  -3.778  -8.905  -7.329
  835    HA   ALA 101           HA       ALA 101  -2.573  -9.176  -9.899
  836   1HB   ALA 101          HB1       ALA 101  -2.236  -6.983  -7.855
  837   2HB   ALA 101          HB2       ALA 101  -3.597  -7.091  -8.972
  838   3HB   ALA 101          HB3       ALA 101  -1.959  -6.885  -9.594
  839    H    THR 102           HN       THR 102  -1.399  -9.305  -6.559
  840    HA   THR 102           HA       THR 102   1.387  -9.565  -7.202
  841    HB   THR 102           HB       THR 102   0.094 -10.201  -4.553
  842    HG1  THR 102           HG1      THR 102  -0.435  -8.054  -5.295
  843   1HG2  THR 102          HG21      THR 102   2.481 -10.829  -4.819
  844   2HG2  THR 102          HG22      THR 102   2.238  -9.563  -3.615
  845   3HG2  THR 102          HG23      THR 102   2.850  -9.150  -5.216
  846    H    GLU 103           HN       GLU 103  -1.221 -11.819  -6.274
  847    HA   GLU 103           HA       GLU 103   0.538 -14.046  -7.088
  848   1HB   GLU 103          HB1       GLU 103  -1.133 -15.348  -5.434
  849   2HB   GLU 103          HB2       GLU 103   0.391 -14.657  -4.903
  850   1HG   GLU 103          HG1       GLU 103  -0.744 -13.560  -3.358
  851   2HG   GLU 103          HG2       GLU 103  -1.435 -12.583  -4.648
  852    HHA  HEC 104           HA       HEC 104   5.003   3.505   1.516
  853    HHB  HEC 104           HB       HEC 104  -0.588   0.480   0.182
  854    HHC  HEC 104           HC       HEC 104  -3.182   6.152  -1.584
  855    HHD  HEC 104           HD       HEC 104   2.705   8.806  -1.423
  856   1HMA  HEC 104          HMA1      HEC 104   1.178  -0.855   2.076
  857   2HMA  HEC 104          HMA2      HEC 104   2.725  -1.212   1.306
  858   3HMA  HEC 104          HMA3      HEC 104   1.260  -1.090   0.330
  859   1HAA  HEC 104          HAA1      HEC 104   4.216  -0.159   2.241
  860   2HAA  HEC 104          HAA2      HEC 104   4.857   1.432   2.607
  861   1HBA  HEC 104          HBA1      HEC 104   5.785   1.555   0.307
  862   2HBA  HEC 104          HBA2      HEC 104   5.202  -0.075   0.010
  863   1HMB  HEC 104          HMB1      HEC 104  -2.443   0.120  -0.490
  864   2HMB  HEC 104          HMB2      HEC 104  -3.335   0.674  -1.907
  865   3HMB  HEC 104          HMB3      HEC 104  -4.046   0.830  -0.302
  866    HAB  HEC 104           HAB      HEC 104  -4.560   4.797  -1.645
  867   1HBB  HEC 104          HBB1      HEC 104  -4.935   3.613   0.656
  868   2HBB  HEC 104          HBB2      HEC 104  -5.883   2.505  -0.334
  869   3HBB  HEC 104          HBB3      HEC 104  -6.270   4.226  -0.319
  870   1HMC  HEC 104          HMC1      HEC 104  -3.279   8.714  -1.798
  871   2HMC  HEC 104          HMC2      HEC 104  -2.882   7.964  -3.344
  872   3HMC  HEC 104          HMC3      HEC 104  -2.314   9.594  -2.983
  873    HAC  HEC 104           HAC      HEC 104   1.526   9.809  -2.754
  874   1HBC  HEC 104          HBC1      HEC 104   0.660  11.215  -1.133
  875   2HBC  HEC 104          HBC2      HEC 104  -0.981  11.103  -1.768
  876   3HBC  HEC 104          HBC3      HEC 104   0.260  11.968  -2.676
  877   1HMD  HEC 104          HMD1      HEC 104   4.804   9.263  -0.460
  878   2HMD  HEC 104          HMD2      HEC 104   5.313   8.259  -1.817
  879   3HMD  HEC 104          HMD3      HEC 104   6.292   8.322  -0.351
  880   1HAD  HEC 104          HAD1      HEC 104   7.108   6.480   0.487
  881   2HAD  HEC 104          HAD2      HEC 104   6.663   4.943   1.221
  882   1HBD  HEC 104          HBD1      HEC 104   6.070   5.921   3.236
  883   2HBD  HEC 104          HBD2      HEC 104   5.741   7.477   2.505
  884    H2   4NL 105           H2       4NL 105  -0.499 -13.442  -1.299
  885    H6   4NL 105           H6       4NL 105   2.066 -14.154   2.712
  886    H3   4NL 105           H3       4NL 105  -1.780 -10.414   1.540
  887    H5   4NL 105           H5       4NL 105  -2.587 -10.577  -0.554
  888    H4   4NL 105           H4       4NL 105  -0.331 -11.456   3.304
  889    H1   4NL 105           H1       4NL 105   0.950 -14.483   0.465
  890    H7   4NL 105           H7       4NL 105   1.005 -13.499   3.983
  Start of MODEL   17
    1   1H    THR  -5          HT1       THR  -5 -13.055  -6.147  13.549
    2   2H    THR  -5          HT2       THR  -5 -12.109  -5.607  12.253
    3   3H    THR  -5          HT3       THR  -5 -11.418  -5.776  13.789
    4    HA   THR  -5           HA       THR  -5 -10.938  -7.582  12.090
    5    HB   THR  -5           HB       THR  -5 -12.161  -8.795  14.540
    6    HG1  THR  -5           HG1      THR  -5 -10.327  -7.968  15.730
    7   1HG2  THR  -5          HG21      THR  -5 -10.710 -10.095  13.018
    8   2HG2  THR  -5          HG22      THR  -5 -10.001  -9.934  14.624
    9   3HG2  THR  -5          HG23      THR  -5  -9.407  -8.938  13.295
   10    H    GLU  -4           HN       GLU  -4 -12.881  -7.101  10.580
   11    HA   GLU  -4           HA       GLU  -4 -14.680  -9.387  10.620
   12   1HB   GLU  -4          HB1       GLU  -4 -15.822  -7.325  11.733
   13   2HB   GLU  -4          HB2       GLU  -4 -15.834  -6.632  10.115
   14   1HG   GLU  -4          HG1       GLU  -4 -16.963  -9.367  10.552
   15   2HG   GLU  -4          HG2       GLU  -4 -17.909  -7.957  11.011
   16    H    PHE  -3           HN       PHE  -3 -12.938  -9.799   9.038
   17    HA   PHE  -3           HA       PHE  -3 -12.876  -8.244   6.623
   18   1HB   PHE  -3          HB1       PHE  -3 -10.766  -9.083   7.312
   19   2HB   PHE  -3          HB2       PHE  -3 -11.376 -10.729   7.427
   20    HD1  PHE  -3           HD1      PHE  -3 -10.590  -7.996   4.996
   21    HD2  PHE  -3           HD2      PHE  -3 -11.253 -12.205   5.582
   22    HE1  PHE  -3           HE1      PHE  -3  -9.956  -8.424   2.629
   23    HE2  PHE  -3           HE2      PHE  -3 -10.667 -12.629   3.202
   24    HZ   PHE  -3           HZ       PHE  -3 -10.047 -10.733   1.715
   25    H    LYS  -2           HN       LYS  -2 -14.173  -8.372   5.063
   26    HA   LYS  -2           HA       LYS  -2 -15.617 -10.835   4.386
   27   1HB   LYS  -2          HB1       LYS  -2 -16.443  -8.022   4.659
   28   2HB   LYS  -2          HB2       LYS  -2 -16.981  -8.772   3.162
   29   1HG   LYS  -2          HG1       LYS  -2 -17.921 -10.656   4.497
   30   2HG   LYS  -2          HG2       LYS  -2 -17.492  -9.780   5.963
   31   1HD   LYS  -2          HD1       LYS  -2 -18.943  -7.884   5.120
   32   2HD   LYS  -2          HD2       LYS  -2 -19.498  -8.974   3.852
   33   1HE   LYS  -2          HE1       LYS  -2 -21.142  -9.089   5.544
   34   2HE   LYS  -2          HE2       LYS  -2 -20.195 -10.563   5.713
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.945  -9.424   7.515
   36   2HZ   LYS  -2          HZ2       LYS  -2 -20.578  -9.672   7.866
   37   3HZ   LYS  -2          HZ3       LYS  -2 -20.047  -8.138   7.407
   38    H    ALA  -1           HN       ALA  -1 -14.914 -11.749   2.631
   39    HA   ALA  -1           HA       ALA  -1 -12.878 -10.936   0.977
   40   1HB   ALA  -1          HB1       ALA  -1 -13.524 -12.800  -0.448
   41   2HB   ALA  -1          HB2       ALA  -1 -15.112 -12.858   0.319
   42   3HB   ALA  -1          HB3       ALA  -1 -13.667 -13.246   1.253
   43    H    GLY   1           HN       GLY   1 -12.707 -10.006  -1.028
   44   1HA   GLY   1          HA1       GLY   1 -15.004  -8.462  -2.035
   45   2HA   GLY   1          HA2       GLY   1 -13.325  -7.956  -2.147
   46    H    SER   2           HN       SER   2 -13.216  -7.744  -4.302
   47    HA   SER   2           HA       SER   2 -12.824 -10.077  -5.929
   48   1HB   SER   2          HB1       SER   2 -14.807  -8.220  -7.144
   49   2HB   SER   2          HB2       SER   2 -14.606  -9.962  -7.368
   50    HG   SER   2           HG       SER   2 -15.362 -10.101  -5.095
   51    H    ALA   3           HN       ALA   3 -11.550  -9.623  -7.732
   52    HA   ALA   3           HA       ALA   3  -9.868  -7.454  -7.711
   53   1HB   ALA   3          HB1       ALA   3  -9.233  -8.162 -10.004
   54   2HB   ALA   3          HB2       ALA   3 -10.609  -9.266  -9.999
   55   3HB   ALA   3          HB3       ALA   3  -9.301  -9.484  -8.838
   56    H    LYS   4           HN       LYS   4 -12.931  -7.649  -9.591
   57    HA   LYS   4           HA       LYS   4 -12.465  -5.105 -10.815
   58   1HB   LYS   4          HB1       LYS   4 -13.674  -7.064 -11.869
   59   2HB   LYS   4          HB2       LYS   4 -15.076  -6.557 -10.927
   60   1HG   LYS   4          HG1       LYS   4 -14.049  -4.223 -12.133
   61   2HG   LYS   4          HG2       LYS   4 -14.055  -5.461 -13.382
   62   1HD   LYS   4          HD1       LYS   4 -16.328  -5.540 -13.473
   63   2HD   LYS   4          HD2       LYS   4 -16.512  -5.248 -11.739
   64   1HE   LYS   4          HE1       LYS   4 -15.621  -3.108 -13.680
   65   2HE   LYS   4          HE2       LYS   4 -17.315  -3.377 -13.267
   66   1HZ   LYS   4          HZ1       LYS   4 -15.345  -3.007 -11.121
   67   2HZ   LYS   4          HZ2       LYS   4 -16.999  -2.659 -11.131
   68   3HZ   LYS   4          HZ3       LYS   4 -15.925  -1.653 -11.961
   69    H    LYS   5           HN       LYS   5 -13.197  -5.560  -7.730
   70    HA   LYS   5           HA       LYS   5 -14.926  -3.172  -7.579
   71   1HB   LYS   5          HB1       LYS   5 -14.706  -5.519  -5.697
   72   2HB   LYS   5          HB2       LYS   5 -15.378  -3.978  -5.179
   73   1HG   LYS   5          HG1       LYS   5 -16.963  -4.221  -7.208
   74   2HG   LYS   5          HG2       LYS   5 -16.467  -5.915  -7.201
   75   1HD   LYS   5          HD1       LYS   5 -17.305  -4.765  -4.593
   76   2HD   LYS   5          HD2       LYS   5 -18.575  -4.996  -5.794
   77   1HE   LYS   5          HE1       LYS   5 -18.567  -7.006  -4.582
   78   2HE   LYS   5          HE2       LYS   5 -17.644  -7.385  -6.036
   79   1HZ   LYS   5          HZ1       LYS   5 -15.929  -7.934  -4.768
   80   2HZ   LYS   5          HZ2       LYS   5 -16.848  -7.615  -3.378
   81   3HZ   LYS   5          HZ3       LYS   5 -15.907  -6.388  -4.066
   82    H    GLY   6           HN       GLY   6 -12.373  -4.859  -5.704
   83   1HA   GLY   6          HA1       GLY   6 -11.540  -2.668  -4.180
   84   2HA   GLY   6          HA2       GLY   6 -10.529  -4.041  -4.599
   85    H    ALA   7           HN       ALA   7 -10.717  -3.501  -7.512
   86    HA   ALA   7           HA       ALA   7  -8.511  -1.856  -7.904
   87   1HB   ALA   7          HB1       ALA   7  -9.012  -2.001 -10.284
   88   2HB   ALA   7          HB2       ALA   7 -10.632  -2.597  -9.920
   89   3HB   ALA   7          HB3       ALA   7  -9.223  -3.569  -9.503
   90    H    THR   8           HN       THR   8 -11.984  -0.977  -8.573
   91    HA   THR   8           HA       THR   8 -11.555   1.605  -9.427
   92    HB   THR   8           HB       THR   8 -13.825   1.955  -7.926
   93    HG1  THR   8           HG1      THR   8 -13.666  -0.318  -7.367
   94   1HG2  THR   8          HG21      THR   8 -15.033   1.467 -10.018
   95   2HG2  THR   8          HG22      THR   8 -13.561   0.762 -10.689
   96   3HG2  THR   8          HG23      THR   8 -13.614   2.480 -10.292
   97    H    LEU   9           HN       LEU   9 -11.528   0.532  -6.063
   98    HA   LEU   9           HA       LEU   9 -11.420   3.103  -4.867
   99   1HB   LEU   9          HB1       LEU   9 -10.540   0.418  -3.759
  100   2HB   LEU   9          HB2       LEU   9 -10.793   1.886  -2.817
  101    HG   LEU   9           HG       LEU   9 -12.947   0.471  -4.410
  102   1HD1  LEU   9          HD11      LEU   9 -12.422   0.576  -1.434
  103   2HD1  LEU   9          HD12      LEU   9 -12.271  -0.843  -2.469
  104   3HD1  LEU   9          HD13      LEU   9 -13.855  -0.118  -2.194
  105   1HD2  LEU   9          HD21      LEU   9 -13.168   2.736  -2.412
  106   2HD2  LEU   9          HD22      LEU   9 -14.499   1.956  -3.266
  107   3HD2  LEU   9          HD23      LEU   9 -13.319   2.914  -4.162
  108    H    PHE  10           HN       PHE  10  -8.874   0.609  -5.138
  109    HA   PHE  10           HA       PHE  10  -6.683   2.162  -4.425
  110   1HB   PHE  10          HB1       PHE  10  -6.727  -0.301  -4.522
  111   2HB   PHE  10          HB2       PHE  10  -6.778  -0.227  -6.276
  112    HD1  PHE  10           HD1      PHE  10  -4.763   0.820  -7.505
  113    HD2  PHE  10           HD2      PHE  10  -4.699  -0.362  -3.371
  114    HE1  PHE  10           HE1      PHE  10  -2.273   0.730  -7.565
  115    HE2  PHE  10           HE2      PHE  10  -2.215  -0.327  -3.398
  116    HZ   PHE  10           HZ       PHE  10  -0.997   0.193  -5.498
  117    H    LYS  11           HN       LYS  11  -8.145   1.701  -7.617
  118    HA   LYS  11           HA       LYS  11  -6.083   3.143  -9.009
  119   1HB   LYS  11          HB1       LYS  11  -7.940   1.225  -9.727
  120   2HB   LYS  11          HB2       LYS  11  -8.504   2.679 -10.547
  121   1HG   LYS  11          HG1       LYS  11  -6.561   2.901 -11.798
  122   2HG   LYS  11          HG2       LYS  11  -5.601   1.958 -10.662
  123   1HD   LYS  11          HD1       LYS  11  -6.982  -0.056 -11.389
  124   2HD   LYS  11          HD2       LYS  11  -7.591   0.958 -12.699
  125   1HE   LYS  11          HE1       LYS  11  -5.738  -0.381 -13.512
  126   2HE   LYS  11          HE2       LYS  11  -5.262   1.313 -13.470
  127   1HZ   LYS  11          HZ1       LYS  11  -4.550  -0.718 -11.418
  128   2HZ   LYS  11          HZ2       LYS  11  -4.061   0.900 -11.423
  129   3HZ   LYS  11          HZ3       LYS  11  -3.516  -0.145 -12.635
  130    H    THR  12           HN       THR  12  -8.312   4.409  -7.074
  131    HA   THR  12           HA       THR  12  -8.506   6.919  -8.554
  132    HB   THR  12           HB       THR  12 -10.662   5.233  -8.031
  133    HG1  THR  12           HG1      THR  12 -10.389   6.617  -9.794
  134   1HG2  THR  12          HG21      THR  12 -10.923   7.777  -6.435
  135   2HG2  THR  12          HG22      THR  12 -11.043   6.124  -5.832
  136   3HG2  THR  12          HG23      THR  12 -12.271   6.754  -6.931
  137    H    ARG  13           HN       ARG  13  -8.078   5.316  -5.564
  138    HA   ARG  13           HA       ARG  13  -7.752   7.784  -4.004
  139   1HB   ARG  13          HB1       ARG  13  -8.175   4.912  -3.192
  140   2HB   ARG  13          HB2       ARG  13  -7.709   6.153  -2.048
  141   1HG   ARG  13          HG1       ARG  13 -10.263   6.047  -3.639
  142   2HG   ARG  13          HG2       ARG  13 -10.079   5.701  -1.926
  143   1HD   ARG  13          HD1       ARG  13 -11.005   7.883  -2.088
  144   2HD   ARG  13          HD2       ARG  13  -9.305   8.101  -1.653
  145    HE   ARG  13           HE       ARG  13  -9.883   7.841  -4.308
  146   1HH1  ARG  13          HH11      ARG  13  -9.815  10.200  -1.731
  147   2HH1  ARG  13          HH12      ARG  13  -9.186  11.551  -2.600
  148   1HH2  ARG  13          HH21      ARG  13  -8.877   9.921  -5.592
  149   2HH2  ARG  13          HH22      ARG  13  -8.691  11.403  -4.722
  150    H    CYS  14           HN       CYS  14  -6.018   5.020  -5.196
  151    HA   CYS  14           HA       CYS  14  -3.585   5.802  -3.728
  152   1HB   CYS  14          HB1       CYS  14  -3.987   3.139  -5.035
  153   2HB   CYS  14          HB2       CYS  14  -2.896   3.568  -3.735
  154    H    LEU  15           HN       LEU  15  -4.915   5.094  -6.924
  155    HA   LEU  15           HA       LEU  15  -2.646   4.842  -8.455
  156   1HB   LEU  15          HB1       LEU  15  -5.101   4.579  -9.101
  157   2HB   LEU  15          HB2       LEU  15  -5.108   6.317  -9.369
  158    HG   LEU  15           HG       LEU  15  -3.236   6.030 -11.008
  159   1HD1  LEU  15          HD11      LEU  15  -2.901   3.735 -11.935
  160   2HD1  LEU  15          HD12      LEU  15  -3.785   3.103 -10.545
  161   3HD1  LEU  15          HD13      LEU  15  -2.260   3.957 -10.307
  162   1HD2  LEU  15          HD21      LEU  15  -5.820   4.570 -11.525
  163   2HD2  LEU  15          HD22      LEU  15  -4.632   4.914 -12.784
  164   3HD2  LEU  15          HD23      LEU  15  -5.424   6.240 -11.931
  165    H    GLN  16           HN       GLN  16  -4.139   7.865  -7.371
  166    HA   GLN  16           HA       GLN  16  -3.001   9.812  -8.817
  167   1HB   GLN  16          HB1       GLN  16  -2.936  11.100  -6.538
  168   2HB   GLN  16          HB2       GLN  16  -4.461  10.589  -7.243
  169   1HG   GLN  16          HG1       GLN  16  -4.360   8.550  -5.762
  170   2HG   GLN  16          HG2       GLN  16  -2.973   9.291  -4.960
  171   1HE2  GLN  16          HE21      GLN  16  -3.340  11.153  -3.644
  172   2HE2  GLN  16          HE22      GLN  16  -4.930  11.609  -3.158
  173    H    CYS  17           HN       CYS  17  -1.199   7.954  -6.398
  174    HA   CYS  17           HA       CYS  17   1.259   9.352  -7.206
  175   1HB   CYS  17          HB1       CYS  17   1.243   8.087  -4.542
  176   2HB   CYS  17          HB2       CYS  17   1.946   9.596  -5.096
  177    H    HIS  18           HN       HIS  18  -0.117   6.217  -6.309
  178    HA   HIS  18           HA       HIS  18   2.404   4.806  -6.648
  179   1HB   HIS  18          HB1       HIS  18  -0.321   4.091  -5.633
  180   2HB   HIS  18          HB2       HIS  18   0.839   2.834  -6.023
  181    HD1  HIS  18           HD1      HIS  18   3.283   3.199  -4.592
  182    HD2  HIS  18           HD2      HIS  18  -0.275   4.888  -3.172
  183    HE1  HIS  18           HE1      HIS  18   3.623   3.568  -2.106
  184    H    THR  19           HN       THR  19   1.724   2.439  -7.473
  185    HA   THR  19           HA       THR  19   0.175   2.306  -9.883
  186    HB   THR  19           HB       THR  19   2.441   1.334 -10.965
  187    HG1  THR  19           HG1      THR  19   4.114   2.782 -10.510
  188   1HG2  THR  19          HG21      THR  19   1.526   4.210 -11.026
  189   2HG2  THR  19          HG22      THR  19   1.016   2.914 -12.108
  190   3HG2  THR  19          HG23      THR  19   2.679   3.498 -12.155
  191    H    VAL  20           HN       VAL  20  -0.821   0.359  -9.774
  192    HA   VAL  20           HA       VAL  20  -0.028  -1.685  -7.944
  193    HB   VAL  20           HB       VAL  20  -2.358  -0.869  -8.914
  194   1HG1  VAL  20          HG11      VAL  20  -2.072  -1.833 -11.127
  195   2HG1  VAL  20          HG12      VAL  20  -3.436  -2.553 -10.271
  196   3HG1  VAL  20          HG13      VAL  20  -1.918  -3.440 -10.414
  197   1HG2  VAL  20          HG21      VAL  20  -3.437  -2.720  -7.815
  198   2HG2  VAL  20          HG22      VAL  20  -2.041  -2.190  -6.877
  199   3HG2  VAL  20          HG23      VAL  20  -1.942  -3.655  -7.852
  200    H    GLU  21           HN       GLU  21   0.411  -1.302 -11.349
  201    HA   GLU  21           HA       GLU  21   1.370  -4.031 -11.762
  202   1HB   GLU  21          HB1       GLU  21   1.394  -1.983 -13.942
  203   2HB   GLU  21          HB2       GLU  21   1.039  -3.696 -14.037
  204   1HG   GLU  21          HG1       GLU  21  -0.992  -2.635 -14.545
  205   2HG   GLU  21          HG2       GLU  21  -1.172  -3.148 -12.870
  206    H    LYS  22           HN       LYS  22   3.618  -4.288 -12.790
  207    HA   LYS  22           HA       LYS  22   5.431  -2.375 -11.640
  208   1HB   LYS  22          HB1       LYS  22   5.554  -5.100 -12.158
  209   2HB   LYS  22          HB2       LYS  22   6.781  -4.375 -13.212
  210   1HG   LYS  22          HG1       LYS  22   7.940  -3.414 -11.449
  211   2HG   LYS  22          HG2       LYS  22   6.532  -3.420 -10.387
  212   1HD   LYS  22          HD1       LYS  22   6.709  -5.795 -10.077
  213   2HD   LYS  22          HD2       LYS  22   7.996  -5.897 -11.279
  214   1HE   LYS  22          HE1       LYS  22   9.020  -6.008  -9.116
  215   2HE   LYS  22          HE2       LYS  22   9.406  -4.444  -9.811
  216   1HZ   LYS  22          HZ1       LYS  22   7.533  -3.541  -8.386
  217   2HZ   LYS  22          HZ2       LYS  22   8.898  -4.074  -7.548
  218   3HZ   LYS  22          HZ3       LYS  22   7.512  -5.038  -7.596
  219    H    GLY  23           HN       GLY  23   3.891  -2.106 -14.522
  220   1HA   GLY  23          HA1       GLY  23   6.207  -1.149 -16.044
  221   2HA   GLY  23          HA2       GLY  23   4.568  -1.317 -16.650
  222    H    GLY  24           HN       GLY  24   4.152   0.196 -13.797
  223   1HA   GLY  24          HA1       GLY  24   3.821   2.826 -14.955
  224   2HA   GLY  24          HA2       GLY  24   3.287   2.292 -13.369
  225    HA   PRO  25           HA       PRO  25   7.782   4.258 -13.357
  226   1HB   PRO  25          HB1       PRO  25   7.254   6.945 -13.661
  227   2HB   PRO  25          HB2       PRO  25   7.862   5.896 -14.946
  228   1HG   PRO  25          HG1       PRO  25   5.067   6.810 -14.407
  229   2HG   PRO  25          HG2       PRO  25   5.911   6.635 -15.957
  230   1HD   PRO  25          HD1       PRO  25   4.128   4.812 -15.097
  231   2HD   PRO  25          HD2       PRO  25   5.567   4.346 -16.028
  232    H    HIS  26           HN       HIS  26   8.488   5.004 -11.379
  233    HA   HIS  26           HA       HIS  26   6.715   5.067  -9.195
  234   1HB   HIS  26          HB1       HIS  26   9.591   5.952  -9.505
  235   2HB   HIS  26          HB2       HIS  26   8.761   5.882  -7.960
  236    HD2  HIS  26           HD2      HIS  26  10.676   3.747 -10.425
  237    HE1  HIS  26           HE1      HIS  26   9.388   1.098  -7.367
  238    HE2  HIS  26           HE2      HIS  26  10.908   1.364  -9.383
  239    H    LYS  27           HN       LYS  27   5.209   6.693  -9.030
  240    HA   LYS  27           HA       LYS  27   5.853   9.424  -9.756
  241   1HB   LYS  27          HB1       LYS  27   3.334   7.906  -9.183
  242   2HB   LYS  27          HB2       LYS  27   3.319   9.660  -9.137
  243   1HG   LYS  27          HG1       LYS  27   3.421   9.843 -11.381
  244   2HG   LYS  27          HG2       LYS  27   4.628   8.560 -11.521
  245   1HD   LYS  27          HD1       LYS  27   2.411   8.028 -12.605
  246   2HD   LYS  27          HD2       LYS  27   2.930   6.854 -11.389
  247   1HE   LYS  27          HE1       LYS  27   1.544   8.359  -9.752
  248   2HE   LYS  27          HE2       LYS  27   0.757   8.918 -11.228
  249   1HZ   LYS  27          HZ1       LYS  27   0.961   6.076 -10.387
  250   2HZ   LYS  27          HZ2       LYS  27   0.130   6.666 -11.734
  251   3HZ   LYS  27          HZ3       LYS  27  -0.409   7.054 -10.180
  252    H    VAL  28           HN       VAL  28   3.735  10.099  -7.487
  253    HA   VAL  28           HA       VAL  28   5.564  11.095  -5.576
  254    HB   VAL  28           HB       VAL  28   2.616  10.667  -5.113
  255   1HG1  VAL  28          HG11      VAL  28   2.859  12.735  -3.749
  256   2HG1  VAL  28          HG12      VAL  28   4.598  12.681  -4.037
  257   3HG1  VAL  28          HG13      VAL  28   3.812  11.382  -3.138
  258   1HG2  VAL  28          HG21      VAL  28   3.923  13.010  -6.518
  259   2HG2  VAL  28          HG22      VAL  28   2.239  12.938  -6.000
  260   3HG2  VAL  28          HG23      VAL  28   2.824  11.840  -7.250
  261    H    GLY  29           HN       GLY  29   4.051   8.051  -5.983
  262   1HA   GLY  29          HA1       GLY  29   5.109   7.033  -3.426
  263   2HA   GLY  29          HA2       GLY  29   3.553   6.521  -4.058
  264    HA   PRO  30           HA       PRO  30   7.355   4.109  -5.888
  265   1HB   PRO  30          HB1       PRO  30   7.724   2.146  -4.065
  266   2HB   PRO  30          HB2       PRO  30   8.569   3.697  -3.988
  267   1HG   PRO  30          HG1       PRO  30   6.122   2.801  -2.504
  268   2HG   PRO  30          HG2       PRO  30   7.554   3.647  -1.887
  269   1HD   PRO  30          HD1       PRO  30   5.260   4.940  -2.459
  270   2HD   PRO  30          HD2       PRO  30   6.852   5.690  -2.698
  271    H    ASN  31           HN       ASN  31   7.308   1.912  -6.761
  272    HA   ASN  31           HA       ASN  31   4.709   1.044  -7.461
  273   1HB   ASN  31          HB1       ASN  31   6.453   0.754  -9.046
  274   2HB   ASN  31          HB2       ASN  31   7.498  -0.046  -7.880
  275   1HD2  ASN  31          HD21      ASN  31   4.760  -0.487 -10.033
  276   2HD2  ASN  31          HD22      ASN  31   4.814  -2.218  -9.992
  277    H    LEU  32           HN       LEU  32   3.424  -0.532  -6.584
  278    HA   LEU  32           HA       LEU  32   4.139  -1.744  -4.025
  279   1HB   LEU  32          HB1       LEU  32   1.457  -1.211  -5.309
  280   2HB   LEU  32          HB2       LEU  32   1.686  -1.933  -3.728
  281    HG   LEU  32           HG       LEU  32   2.381   0.901  -4.538
  282   1HD1  LEU  32          HD11      LEU  32  -0.004   0.479  -4.104
  283   2HD1  LEU  32          HD12      LEU  32   0.708   1.515  -2.867
  284   3HD1  LEU  32          HD13      LEU  32   0.408  -0.188  -2.522
  285   1HD2  LEU  32          HD21      LEU  32   4.082   0.109  -2.976
  286   2HD2  LEU  32          HD22      LEU  32   2.827  -0.476  -1.883
  287   3HD2  LEU  32          HD23      LEU  32   3.002   1.253  -2.179
  288    H    HIS  33           HN       HIS  33   3.933  -2.706  -7.216
  289    HA   HIS  33           HA       HIS  33   2.704  -5.235  -7.160
  290   1HB   HIS  33          HB1       HIS  33   3.257  -3.678  -9.139
  291   2HB   HIS  33          HB2       HIS  33   4.871  -4.381  -9.071
  292    HD2  HIS  33           HD2      HIS  33   1.774  -6.582  -8.453
  293    HE1  HIS  33           HE1      HIS  33   3.263  -7.607 -12.299
  294    HE2  HIS  33           HE2      HIS  33   1.634  -8.256 -10.459
  295    H    GLY  34           HN       GLY  34   3.498  -6.478  -5.479
  296   1HA   GLY  34          HA1       GLY  34   4.869  -8.469  -5.218
  297   2HA   GLY  34          HA2       GLY  34   6.241  -7.525  -5.760
  298    H    ILE  35           HN       ILE  35   4.203  -5.841  -3.476
  299    HA   ILE  35           HA       ILE  35   6.326  -5.829  -1.590
  300    HB   ILE  35           HB       ILE  35   4.827  -4.648  -0.043
  301   1HG1  ILE  35          HG11      ILE  35   2.753  -5.180  -2.139
  302   2HG1  ILE  35          HG12      ILE  35   2.591  -5.121  -0.385
  303   1HG2  ILE  35          HG21      ILE  35   5.109  -3.529  -2.824
  304   2HG2  ILE  35          HG22      ILE  35   6.332  -3.531  -1.553
  305   3HG2  ILE  35          HG23      ILE  35   4.856  -2.586  -1.354
  306   1HD1  ILE  35          HD11      ILE  35   2.761  -2.672  -0.447
  307   2HD1  ILE  35          HD12      ILE  35   1.424  -3.250  -1.442
  308   3HD1  ILE  35          HD13      ILE  35   2.927  -2.729  -2.203
  309    H    PHE  36           HN       PHE  36   3.342  -7.749  -1.686
  310    HA   PHE  36           HA       PHE  36   3.369  -8.744   0.902
  311   1HB   PHE  36          HB1       PHE  36   2.348  -9.977  -1.655
  312   2HB   PHE  36          HB2       PHE  36   2.090 -10.695  -0.066
  313    HD1  PHE  36           HD1      PHE  36   1.417  -8.606   1.708
  314    HD2  PHE  36           HD2      PHE  36   0.400  -8.986  -2.455
  315    HE1  PHE  36           HE1      PHE  36  -0.539  -7.111   2.058
  316    HE2  PHE  36           HE2      PHE  36  -1.558  -7.490  -2.109
  317    HZ   PHE  36           HZ       PHE  36  -2.023  -6.543   0.144
  318    H    GLY  37           HN       GLY  37   4.858  -9.732   1.939
  319   1HA   GLY  37          HA1       GLY  37   6.105 -11.702   2.451
  320   2HA   GLY  37          HA2       GLY  37   6.494 -11.864   0.749
  321    H    ARG  38           HN       ARG  38   6.901  -8.649   1.344
  322    HA   ARG  38           HA       ARG  38   9.756  -8.905   2.048
  323   1HB   ARG  38          HB1       ARG  38   8.350  -7.050   0.107
  324   2HB   ARG  38          HB2       ARG  38   9.995  -6.772   0.660
  325   1HG   ARG  38          HG1       ARG  38  10.844  -8.561  -0.527
  326   2HG   ARG  38          HG2       ARG  38   9.296  -9.408  -0.562
  327   1HD   ARG  38          HD1       ARG  38   9.420  -8.670  -2.747
  328   2HD   ARG  38          HD2       ARG  38   8.553  -7.325  -2.002
  329    HE   ARG  38           HE       ARG  38  10.687  -6.970  -1.494
  330   1HH1  ARG  38          HH21      ARG  38   9.408  -7.585  -4.634
  331   2HH1  ARG  38          HH22      ARG  38  10.180  -6.275  -5.369
  332   1HH2  ARG  38          HH11      ARG  38  12.388  -5.369  -3.120
  333   2HH2  ARG  38          HH12      ARG  38  12.156  -5.808  -4.757
  334    H    HIS  39           HN       HIS  39  10.663  -6.986   3.091
  335    HA   HIS  39           HA       HIS  39   8.937  -6.007   5.185
  336   1HB   HIS  39          HB1       HIS  39  11.815  -5.207   4.705
  337   2HB   HIS  39          HB2       HIS  39  10.931  -5.235   6.233
  338    HD2  HIS  39           HD2      HIS  39  10.886  -7.474   7.600
  339    HE1  HIS  39           HE1      HIS  39  12.819 -10.005   4.778
  340    HE2  HIS  39           HE2      HIS  39  11.847  -9.860   7.120
  341    H    SER  40           HN       SER  40   8.860  -3.644   5.722
  342    HA   SER  40           HA       SER  40   7.951  -2.084   3.614
  343   1HB   SER  40          HB1       SER  40   9.083  -0.698   6.010
  344   2HB   SER  40          HB2       SER  40   7.633  -0.328   5.089
  345    HG   SER  40           HG       SER  40   6.929  -2.491   6.025
  346    H    GLY  41           HN       GLY  41   8.783  -0.427   2.406
  347   1HA   GLY  41          HA1       GLY  41  10.364   0.963   1.463
  348   2HA   GLY  41          HA2       GLY  41  11.476   0.522   2.737
  349    H    GLN  42           HN       GLN  42  10.034  -1.641   0.192
  350    HA   GLN  42           HA       GLN  42  12.790  -2.121  -0.696
  351   1HB   GLN  42          HB1       GLN  42  10.554  -4.098  -0.431
  352   2HB   GLN  42          HB2       GLN  42  12.022  -4.442  -1.339
  353   1HG   GLN  42          HG1       GLN  42  13.309  -3.834   0.771
  354   2HG   GLN  42          HG2       GLN  42  11.760  -3.871   1.609
  355   1HE2  GLN  42          HE21      GLN  42  12.706  -5.628   2.902
  356   2HE2  GLN  42          HE22      GLN  42  12.754  -7.226   2.253
  357    H    ALA  43           HN       ALA  43  10.737  -0.231  -2.038
  358    HA   ALA  43           HA       ALA  43  10.068  -1.301  -4.550
  359   1HB   ALA  43          HB1       ALA  43   9.039   0.690  -3.567
  360   2HB   ALA  43          HB2       ALA  43   9.613   0.980  -5.209
  361   3HB   ALA  43          HB3       ALA  43  10.534   1.586  -3.834
  362    H    GLU  44           HN       GLU  44  11.217  -1.823  -6.271
  363    HA   GLU  44           HA       GLU  44  13.997  -1.396  -6.511
  364   1HB   GLU  44          HB1       GLU  44  12.243  -2.492  -8.717
  365   2HB   GLU  44          HB2       GLU  44  13.934  -2.852  -8.381
  366   1HG   GLU  44          HG1       GLU  44  13.032  -4.730  -7.473
  367   2HG   GLU  44          HG2       GLU  44  12.915  -3.691  -6.065
  368    H    GLY  45           HN       GLY  45  14.315   0.839  -6.507
  369   1HA   GLY  45          HA1       GLY  45  15.336   2.368  -8.132
  370   2HA   GLY  45          HA2       GLY  45  13.883   2.206  -9.091
  371    H    TYR  46           HN       TYR  46  13.366   2.548  -5.692
  372    HA   TYR  46           HA       TYR  46  13.088   5.436  -5.780
  373   1HB   TYR  46          HB1       TYR  46  10.967   4.295  -6.574
  374   2HB   TYR  46          HB2       TYR  46  10.753   3.762  -4.912
  375    HD1  TYR  46           HD1      TYR  46  11.040   6.788  -7.075
  376    HD2  TYR  46           HD2      TYR  46   9.903   5.198  -3.250
  377    HE1  TYR  46           HE1      TYR  46   9.845   8.913  -6.563
  378    HE2  TYR  46           HE2      TYR  46   8.608   7.271  -2.764
  379    HH   TYR  46           HH       TYR  46   7.848   9.562  -5.164
  380    H    SER  47           HN       SER  47  13.128   6.502  -3.813
  381    HA   SER  47           HA       SER  47  14.275   5.026  -1.582
  382   1HB   SER  47          HB1       SER  47  14.075   7.941  -1.313
  383   2HB   SER  47          HB2       SER  47  15.469   6.878  -1.117
  384    HG   SER  47           HG       SER  47  15.568   6.775  -3.430
  385    H    TYR  48           HN       TYR  48  13.663   5.323   0.544
  386    HA   TYR  48           HA       TYR  48  10.922   6.143   1.185
  387   1HB   TYR  48          HB1       TYR  48  12.598   3.796   2.062
  388   2HB   TYR  48          HB2       TYR  48  11.144   4.284   2.930
  389    HD1  TYR  48           HD1      TYR  48   8.941   4.076   1.927
  390    HD2  TYR  48           HD2      TYR  48  12.460   2.776  -0.174
  391    HE1  TYR  48           HE1      TYR  48   7.524   2.681   0.435
  392    HE2  TYR  48           HE2      TYR  48  11.054   1.377  -1.672
  393    HH   TYR  48           HH       TYR  48   8.177   0.297  -0.904
  394    H    THR  49           HN       THR  49  10.638   6.681   3.631
  395    HA   THR  49           HA       THR  49  12.518   8.674   4.480
  396    HB   THR  49           HB       THR  49  11.013   8.650   6.593
  397    HG1  THR  49           HG1      THR  49   9.053   7.611   4.928
  398   1HG2  THR  49          HG21      THR  49   9.838   9.458   3.945
  399   2HG2  THR  49          HG22      THR  49  11.011  10.395   4.871
  400   3HG2  THR  49          HG23      THR  49   9.403  10.095   5.532
  401    H    ASP  50           HN       ASP  50  13.365   8.836   6.693
  402    HA   ASP  50           HA       ASP  50  15.037   6.786   7.494
  403   1HB   ASP  50          HB1       ASP  50  15.338   9.153   8.045
  404   2HB   ASP  50          HB2       ASP  50  13.929   9.101   9.102
  405    H    ALA  51           HN       ALA  51  11.729   7.431   8.510
  406    HA   ALA  51           HA       ALA  51  11.751   5.558  10.691
  407   1HB   ALA  51          HB1       ALA  51   9.487   7.175   9.525
  408   2HB   ALA  51          HB2       ALA  51  10.562   7.699  10.821
  409   3HB   ALA  51          HB3       ALA  51   9.480   6.329  11.073
  410    H    ASN  52           HN       ASN  52  10.490   5.491   7.333
  411    HA   ASN  52           HA       ASN  52   8.893   3.160   7.741
  412   1HB   ASN  52          HB1       ASN  52   8.105   4.384   5.971
  413   2HB   ASN  52          HB2       ASN  52   9.713   4.831   5.416
  414   1HD2  ASN  52          HD21      ASN  52   7.141   2.501   5.099
  415   2HD2  ASN  52          HD22      ASN  52   7.856   1.721   3.735
  416    H    ILE  53           HN       ILE  53  12.207   3.657   6.615
  417    HA   ILE  53           HA       ILE  53  12.738   0.970   5.916
  418    HB   ILE  53           HB       ILE  53  14.571   3.237   6.634
  419   1HG1  ILE  53          HG11      ILE  53  14.018   2.060   3.896
  420   2HG1  ILE  53          HG12      ILE  53  13.071   3.390   4.557
  421   1HG2  ILE  53          HG21      ILE  53  15.795   1.165   6.999
  422   2HG2  ILE  53          HG22      ILE  53  16.373   1.929   5.518
  423   3HG2  ILE  53          HG23      ILE  53  15.280   0.550   5.427
  424   1HD1  ILE  53          HD11      ILE  53  15.013   4.816   4.626
  425   2HD1  ILE  53          HD12      ILE  53  14.884   4.116   3.013
  426   3HD1  ILE  53          HD13      ILE  53  16.064   3.479   4.158
  427    H    LYS  54           HN       LYS  54  14.207   2.662   8.743
  428    HA   LYS  54           HA       LYS  54  14.904   0.661  10.366
  429   1HB   LYS  54          HB1       LYS  54  13.483   3.217  11.081
  430   2HB   LYS  54          HB2       LYS  54  14.200   2.146  12.289
  431   1HG   LYS  54          HG1       LYS  54  16.390   2.405  11.331
  432   2HG   LYS  54          HG2       LYS  54  15.735   3.296   9.954
  433   1HD   LYS  54          HD1       LYS  54  14.970   5.073  11.527
  434   2HD   LYS  54          HD2       LYS  54  15.776   4.201  12.841
  435   1HE   LYS  54          HE1       LYS  54  17.921   4.514  11.868
  436   2HE   LYS  54          HE2       LYS  54  17.226   5.039  10.331
  437   1HZ   LYS  54          HZ1       LYS  54  17.367   6.513  12.879
  438   2HZ   LYS  54          HZ2       LYS  54  16.229   6.923  11.691
  439   3HZ   LYS  54          HZ3       LYS  54  17.882   6.994  11.336
  440    H    LYS  55           HN       LYS  55  11.665   1.096   9.375
  441    HA   LYS  55           HA       LYS  55  10.414  -0.221  11.636
  442   1HB   LYS  55          HB1       LYS  55   9.392   1.689  10.476
  443   2HB   LYS  55          HB2       LYS  55   9.261   0.735   9.017
  444   1HG   LYS  55          HG1       LYS  55   7.119   0.873   9.996
  445   2HG   LYS  55          HG2       LYS  55   7.692  -0.772  10.207
  446   1HD   LYS  55          HD1       LYS  55   8.441   0.526  12.556
  447   2HD   LYS  55          HD2       LYS  55   6.847   1.180  12.183
  448   1HE   LYS  55          HE1       LYS  55   6.493  -0.729  13.562
  449   2HE   LYS  55          HE2       LYS  55   6.056  -1.211  11.922
  450   1HZ   LYS  55          HZ1       LYS  55   7.365  -2.941  12.867
  451   2HZ   LYS  55          HZ2       LYS  55   8.558  -1.861  13.377
  452   3HZ   LYS  55          HZ3       LYS  55   8.343  -2.152  11.727
  453    H    ASN  56           HN       ASN  56  11.251  -1.108   8.351
  454    HA   ASN  56           HA       ASN  56  10.896  -2.902   7.026
  455   1HB   ASN  56          HB1       ASN  56  12.746  -3.461   9.213
  456   2HB   ASN  56          HB2       ASN  56  12.152  -4.909   8.433
  457   1HD2  ASN  56          HD21      ASN  56  13.255  -1.692   7.151
  458   2HD2  ASN  56          HD22      ASN  56  14.059  -2.577   5.929
  459    H    VAL  57           HN       VAL  57   8.425  -2.656   8.102
  460    HA   VAL  57           HA       VAL  57   7.518  -4.989   9.458
  461    HB   VAL  57           HB       VAL  57   6.371  -2.518   8.558
  462   1HG1  VAL  57          HG11      VAL  57   4.568  -4.904   8.158
  463   2HG1  VAL  57          HG12      VAL  57   5.043  -3.736   6.925
  464   3HG1  VAL  57          HG13      VAL  57   4.036  -3.227   8.280
  465   1HG2  VAL  57          HG21      VAL  57   6.565  -3.138  10.839
  466   2HG2  VAL  57          HG22      VAL  57   5.648  -4.621  10.578
  467   3HG2  VAL  57          HG23      VAL  57   4.845  -3.057  10.457
  468    H    LEU  58           HN       LEU  58   7.026  -6.958   8.677
  469    HA   LEU  58           HA       LEU  58   7.518  -7.512   5.917
  470   1HB   LEU  58          HB1       LEU  58   8.140  -9.073   7.749
  471   2HB   LEU  58          HB2       LEU  58   6.431  -9.361   8.051
  472    HG   LEU  58           HG       LEU  58   6.257 -10.133   5.617
  473   1HD1  LEU  58          HD11      LEU  58   9.267 -10.260   5.879
  474   2HD1  LEU  58          HD12      LEU  58   8.393  -9.081   4.901
  475   3HD1  LEU  58          HD13      LEU  58   8.301 -10.796   4.503
  476   1HD2  LEU  58          HD21      LEU  58   7.252 -12.363   6.031
  477   2HD2  LEU  58          HD22      LEU  58   6.274 -11.805   7.387
  478   3HD2  LEU  58          HD23      LEU  58   8.032 -11.725   7.480
  479    H    TRP  59           HN       TRP  59   6.116  -6.678   4.524
  480    HA   TRP  59           HA       TRP  59   3.385  -6.216   4.931
  481   1HB   TRP  59          HB1       TRP  59   5.015  -6.499   2.412
  482   2HB   TRP  59          HB2       TRP  59   3.337  -5.992   2.422
  483    HD1  TRP  59           HD1      TRP  59   6.364  -4.467   1.802
  484    HE1  TRP  59           HE1      TRP  59   6.483  -2.017   2.601
  485    HE3  TRP  59           HE3      TRP  59   2.358  -4.386   4.977
  486    HZ2  TRP  59           HZ2      TRP  59   5.168  -0.298   4.471
  487    HZ3  TRP  59           HZ3      TRP  59   1.801  -2.332   6.221
  488    HH2  TRP  59           HH2      TRP  59   3.174  -0.294   5.985
  489    H    ASP  60           HN       ASP  60   2.245  -7.903   5.586
  490    HA   ASP  60           HA       ASP  60   1.779 -10.210   3.845
  491   1HB   ASP  60          HB1       ASP  60   1.939 -11.602   5.627
  492   2HB   ASP  60          HB2       ASP  60   2.879 -10.291   6.313
  493    H    GLU  61           HN       GLU  61  -0.526 -11.129   5.098
  494    HA   GLU  61           HA       GLU  61  -2.544  -9.561   3.897
  495   1HB   GLU  61          HB1       GLU  61  -2.382 -12.165   4.799
  496   2HB   GLU  61          HB2       GLU  61  -3.484 -11.433   5.961
  497   1HG   GLU  61          HG1       GLU  61  -4.934 -12.198   4.318
  498   2HG   GLU  61          HG2       GLU  61  -4.706 -10.508   3.858
  499    H    ASN  62           HN       ASN  62  -1.627 -10.004   7.315
  500    HA   ASN  62           HA       ASN  62  -3.562  -8.077   8.237
  501   1HB   ASN  62          HB1       ASN  62  -3.139 -10.014   9.583
  502   2HB   ASN  62          HB2       ASN  62  -1.412  -9.691   9.614
  503   1HD2  ASN  62          HD21      ASN  62  -0.640  -8.029  10.959
  504   2HD2  ASN  62          HD22      ASN  62  -1.605  -7.387  12.240
  505    H    ASN  63           HN       ASN  63   0.052  -8.110   8.095
  506    HA   ASN  63           HA       ASN  63   0.544  -5.605   9.124
  507   1HB   ASN  63          HB1       ASN  63   1.961  -7.427   7.251
  508   2HB   ASN  63          HB2       ASN  63   2.587  -5.799   7.429
  509   1HD2  ASN  63          HD21      ASN  63   2.089  -8.878   9.083
  510   2HD2  ASN  63          HD22      ASN  63   2.918  -8.298  10.486
  511    H    MET  64           HN       MET  64  -0.316  -6.223   5.659
  512    HA   MET  64           HA       MET  64   0.060  -3.539   4.851
  513   1HB   MET  64          HB1       MET  64  -0.009  -5.001   3.081
  514   2HB   MET  64          HB2       MET  64  -1.377  -5.897   3.728
  515   1HG   MET  64          HG1       MET  64  -1.829  -3.083   2.914
  516   2HG   MET  64          HG2       MET  64  -1.570  -4.262   1.642
  517   1HE   MET  64          HE1       MET  64  -3.036  -6.824   3.238
  518   2HE   MET  64          HE2       MET  64  -3.049  -6.528   1.498
  519   3HE   MET  64          HE3       MET  64  -4.568  -6.757   2.364
  520    H    SER  65           HN       SER  65  -2.868  -5.148   6.123
  521    HA   SER  65           HA       SER  65  -4.619  -2.961   5.821
  522   1HB   SER  65          HB1       SER  65  -4.886  -5.081   7.942
  523   2HB   SER  65          HB2       SER  65  -6.163  -4.155   7.166
  524    HG   SER  65           HG       SER  65  -4.808  -5.440   5.284
  525    H    GLU  66           HN       GLU  66  -2.515  -3.851   8.534
  526    HA   GLU  66           HA       GLU  66  -3.387  -2.106  10.490
  527   1HB   GLU  66          HB1       GLU  66  -0.644  -3.175   9.806
  528   2HB   GLU  66          HB2       GLU  66  -0.941  -2.210  11.248
  529   1HG   GLU  66          HG1       GLU  66  -2.706  -3.897  11.887
  530   2HG   GLU  66          HG2       GLU  66  -2.109  -4.903  10.567
  531    H    TYR  67           HN       TYR  67  -0.767  -1.504   8.166
  532    HA   TYR  67           HA       TYR  67  -0.272   1.185   8.708
  533   1HB   TYR  67          HB1       TYR  67   1.235  -0.403   7.566
  534   2HB   TYR  67          HB2       TYR  67   0.188  -0.360   6.160
  535    HD1  TYR  67           HD1      TYR  67   1.050   0.835   4.378
  536    HD2  TYR  67           HD2      TYR  67   1.821   2.178   8.384
  537    HE1  TYR  67           HE1      TYR  67   2.513   2.642   3.484
  538    HE2  TYR  67           HE2      TYR  67   3.327   3.955   7.517
  539    HH   TYR  67           HH       TYR  67   4.584   4.522   5.642
  540    H    LEU  68           HN       LEU  68  -2.491  -0.224   6.230
  541    HA   LEU  68           HA       LEU  68  -3.043   2.189   4.922
  542   1HB   LEU  68          HB1       LEU  68  -4.703  -0.293   5.264
  543   2HB   LEU  68          HB2       LEU  68  -5.202   1.056   4.259
  544    HG   LEU  68           HG       LEU  68  -2.829  -0.768   3.846
  545   1HD1  LEU  68          HD11      LEU  68  -4.068  -0.994   1.630
  546   2HD1  LEU  68          HD12      LEU  68  -5.394  -0.115   2.392
  547   3HD1  LEU  68          HD13      LEU  68  -4.877  -1.670   3.044
  548   1HD2  LEU  68          HD21      LEU  68  -3.525   1.754   2.304
  549   2HD2  LEU  68          HD22      LEU  68  -2.319   0.561   1.825
  550   3HD2  LEU  68          HD23      LEU  68  -2.080   1.516   3.288
  551    H    THR  69           HN       THR  69  -4.637   0.889   7.851
  552    HA   THR  69           HA       THR  69  -6.734   2.779   7.931
  553    HB   THR  69           HB       THR  69  -6.070   2.034  10.590
  554    HG1  THR  69           HG1      THR  69  -4.818   0.385   9.727
  555   1HG2  THR  69          HG21      THR  69  -8.141   0.771  10.486
  556   2HG2  THR  69          HG22      THR  69  -8.133   0.841   8.724
  557   3HG2  THR  69          HG23      THR  69  -8.368   2.314   9.663
  558    H    ASN  70           HN       ASN  70  -3.384   3.045   8.910
  559    HA   ASN  70           HA       ASN  70  -3.615   5.861   9.262
  560   1HB   ASN  70          HB1       ASN  70  -3.967   4.250  11.600
  561   2HB   ASN  70          HB2       ASN  70  -2.449   5.129  11.751
  562   1HD2  ASN  70          HD21      ASN  70  -4.745   5.575  13.371
  563   2HD2  ASN  70          HD22      ASN  70  -5.048   7.252  13.088
  564    HA   PRO  71           HA       PRO  71   0.501   4.456   7.660
  565   1HB   PRO  71          HB1       PRO  71   0.844   6.756   6.175
  566   2HB   PRO  71          HB2       PRO  71   0.093   5.274   5.577
  567   1HG   PRO  71          HG1       PRO  71  -1.190   7.773   6.595
  568   2HG   PRO  71          HG2       PRO  71  -1.662   6.746   5.230
  569   1HD   PRO  71          HD1       PRO  71  -2.947   6.646   7.589
  570   2HD   PRO  71          HD2       PRO  71  -2.704   5.194   6.596
  571    H    LYS  72           HN       LYS  72  -0.242   7.855   8.491
  572    HA   LYS  72           HA       LYS  72   2.339   8.565   9.355
  573   1HB   LYS  72          HB1       LYS  72  -0.349   9.800   9.950
  574   2HB   LYS  72          HB2       LYS  72   1.175  10.512  10.451
  575   1HG   LYS  72          HG1       LYS  72   1.170   9.911   7.617
  576   2HG   LYS  72          HG2       LYS  72  -0.181  10.950   8.064
  577   1HD   LYS  72          HD1       LYS  72   1.413  12.517   9.126
  578   2HD   LYS  72          HD2       LYS  72   2.745  11.483   8.608
  579   1HE   LYS  72          HE1       LYS  72   0.768  12.817   6.756
  580   2HE   LYS  72          HE2       LYS  72   2.368  13.443   7.124
  581   1HZ   LYS  72          HZ1       LYS  72   3.308  11.419   6.143
  582   2HZ   LYS  72          HZ2       LYS  72   2.378  12.291   5.035
  583   3HZ   LYS  72          HZ3       LYS  72   1.744  10.895   5.741
  584    H    LYS  73           HN       LYS  73  -0.394   7.196  11.116
  585    HA   LYS  73           HA       LYS  73   0.826   7.554  13.684
  586   1HB   LYS  73          HB1       LYS  73  -1.582   7.470  13.537
  587   2HB   LYS  73          HB2       LYS  73  -1.525   5.855  12.846
  588   1HG   LYS  73          HG1       LYS  73  -2.168   5.708  15.166
  589   2HG   LYS  73          HG2       LYS  73  -0.570   5.002  14.962
  590   1HD   LYS  73          HD1       LYS  73   0.073   7.573  15.614
  591   2HD   LYS  73          HD2       LYS  73  -1.420   7.358  16.524
  592   1HE   LYS  73          HE1       LYS  73   0.158   6.653  18.057
  593   2HE   LYS  73          HE2       LYS  73  -0.298   5.128  17.304
  594   1HZ   LYS  73          HZ1       LYS  73   1.664   5.497  15.791
  595   2HZ   LYS  73          HZ2       LYS  73   2.024   5.131  17.401
  596   3HZ   LYS  73          HZ3       LYS  73   2.146   6.725  16.855
  597    H    TYR  74           HN       TYR  74   0.702   4.852  11.399
  598    HA   TYR  74           HA       TYR  74   2.016   2.986  13.111
  599   1HB   TYR  74          HB1       TYR  74   0.478   2.593  11.060
  600   2HB   TYR  74          HB2       TYR  74   1.964   2.767  10.123
  601    HD1  TYR  74           HD1      TYR  74   3.501   0.925   9.925
  602    HD2  TYR  74           HD2      TYR  74   0.409   0.919  12.912
  603    HE1  TYR  74           HE1      TYR  74   3.999  -1.469  10.434
  604    HE2  TYR  74           HE2      TYR  74   0.886  -1.460  13.425
  605    HH   TYR  74           HH       TYR  74   1.849  -3.422  12.244
  606    H    ILE  75           HN       ILE  75   3.137   5.099  10.538
  607    HA   ILE  75           HA       ILE  75   5.930   4.655  11.323
  608    HB   ILE  75           HB       ILE  75   4.853   4.892   8.504
  609   1HG1  ILE  75          HG11      ILE  75   6.469   2.715   9.884
  610   2HG1  ILE  75          HG12      ILE  75   4.776   2.598   9.425
  611   1HG2  ILE  75          HG21      ILE  75   7.688   5.036   9.556
  612   2HG2  ILE  75          HG22      ILE  75   6.817   6.268   8.644
  613   3HG2  ILE  75          HG23      ILE  75   7.291   4.763   7.859
  614   1HD1  ILE  75          HD11      ILE  75   5.486   2.811   7.031
  615   2HD1  ILE  75          HD12      ILE  75   6.084   1.363   7.839
  616   3HD1  ILE  75          HD13      ILE  75   7.161   2.734   7.577
  617    HA   PRO  76           HA       PRO  76   4.910   9.048  12.078
  618   1HB   PRO  76          HB1       PRO  76   7.006   9.425  13.793
  619   2HB   PRO  76          HB2       PRO  76   5.438   8.775  14.282
  620   1HG   PRO  76          HG1       PRO  76   7.980   7.326  13.661
  621   2HG   PRO  76          HG2       PRO  76   6.814   7.035  14.964
  622   1HD   PRO  76          HD1       PRO  76   6.880   5.523  12.732
  623   2HD   PRO  76          HD2       PRO  76   5.364   5.886  13.582
  624    H    GLY  77           HN       GLY  77   5.450  10.297  10.374
  625   1HA   GLY  77          HA1       GLY  77   6.977  11.933   9.523
  626   2HA   GLY  77          HA2       GLY  77   8.297  10.828   9.854
  627    H    THR  78           HN       THR  78   5.806   9.075   8.443
  628    HA   THR  78           HA       THR  78   7.180   8.503   6.056
  629    HB   THR  78           HB       THR  78   5.217   7.309   7.469
  630    HG1  THR  78           HG1      THR  78   6.622   6.783   5.294
  631   1HG2  THR  78          HG21      THR  78   3.860   8.122   4.898
  632   2HG2  THR  78          HG22      THR  78   3.376   8.623   6.518
  633   3HG2  THR  78          HG23      THR  78   3.279   6.923   6.055
  634    H    LYS  79           HN       LYS  79   6.855   9.019   3.940
  635    HA   LYS  79           HA       LYS  79   5.942  11.623   3.299
  636   1HB   LYS  79          HB1       LYS  79   6.509   9.314   1.437
  637   2HB   LYS  79          HB2       LYS  79   6.436  11.010   0.991
  638   1HG   LYS  79          HG1       LYS  79   8.399  11.390   2.538
  639   2HG   LYS  79          HG2       LYS  79   8.532   9.628   2.656
  640   1HD   LYS  79          HD1       LYS  79   8.253  10.196  -0.092
  641   2HD   LYS  79          HD2       LYS  79   9.418  11.373   0.528
  642   1HE   LYS  79          HE1       LYS  79  10.811   9.593   0.031
  643   2HE   LYS  79          HE2       LYS  79  10.448   9.281   1.728
  644   1HZ   LYS  79          HZ1       LYS  79   8.663   8.110  -0.261
  645   2HZ   LYS  79          HZ2       LYS  79   9.176   7.494   1.226
  646   3HZ   LYS  79          HZ3       LYS  79  10.209   7.433  -0.108
  647    H    MET  80           HN       MET  80   4.180   8.553   3.286
  648    HA   MET  80           HA       MET  80   2.200   9.355   1.427
  649   1HB   MET  80          HB1       MET  80   2.303   7.074   1.534
  650   2HB   MET  80          HB2       MET  80   2.531   7.052   3.286
  651   1HG   MET  80          HG1       MET  80   0.324   7.142   3.728
  652   2HG   MET  80          HG2       MET  80  -0.023   8.171   2.351
  653   1HE   MET  80          HE1       MET  80   0.186   3.572   2.394
  654   2HE   MET  80          HE2       MET  80   0.140   4.612   3.817
  655   3HE   MET  80          HE3       MET  80   1.568   4.594   2.785
  656    H    ALA  81           HN       ALA  81   1.077  11.076   1.714
  657    HA   ALA  81           HA       ALA  81  -0.029  11.819   4.294
  658   1HB   ALA  81          HB1       ALA  81   1.409  13.380   3.010
  659   2HB   ALA  81          HB2       ALA  81  -0.160  14.034   3.476
  660   3HB   ALA  81          HB3       ALA  81   0.116  13.505   1.817
  661    H    PHE  82           HN       PHE  82  -1.190   9.867   2.343
  662    HA   PHE  82           HA       PHE  82  -3.619  10.574   1.266
  663   1HB   PHE  82          HB1       PHE  82  -2.532   8.627   0.521
  664   2HB   PHE  82          HB2       PHE  82  -2.459   7.946   2.141
  665    HD1  PHE  82           HD1      PHE  82  -4.827   8.872  -0.601
  666    HD2  PHE  82           HD2      PHE  82  -4.148   6.516   2.934
  667    HE1  PHE  82           HE1      PHE  82  -7.011   7.728  -0.942
  668    HE2  PHE  82           HE2      PHE  82  -6.334   5.383   2.601
  669    HZ   PHE  82           HZ       PHE  82  -7.775   6.004   0.675
  670    H    GLY  83           HN       GLY  83  -3.001  10.259   4.647
  671   1HA   GLY  83          HA1       GLY  83  -4.555  10.824   6.321
  672   2HA   GLY  83          HA2       GLY  83  -5.854  10.581   5.175
  673    H    GLY  84           HN       GLY  84  -5.189   7.883   4.433
  674   1HA   GLY  84          HA1       GLY  84  -5.058   5.681   5.195
  675   2HA   GLY  84          HA2       GLY  84  -5.142   6.258   6.849
  676    H    LEU  85           HN       LEU  85  -6.768   4.560   4.568
  677    HA   LEU  85           HA       LEU  85  -9.482   5.369   5.018
  678   1HB   LEU  85          HB1       LEU  85  -8.181   3.101   3.540
  679   2HB   LEU  85          HB2       LEU  85  -9.912   3.125   3.801
  680    HG   LEU  85           HG       LEU  85  -8.343   5.235   2.294
  681   1HD1  LEU  85          HD11      LEU  85 -10.246   3.093   1.320
  682   2HD1  LEU  85          HD12      LEU  85  -8.491   3.052   1.145
  683   3HD1  LEU  85          HD13      LEU  85  -9.431   4.297   0.321
  684   1HD2  LEU  85          HD21      LEU  85 -10.512   6.092   1.577
  685   2HD2  LEU  85          HD22      LEU  85 -10.400   6.157   3.335
  686   3HD2  LEU  85          HD23      LEU  85 -11.341   4.884   2.559
  687    H    LYS  86           HN       LYS  86  -9.679   5.290   7.182
  688    HA   LYS  86           HA       LYS  86  -9.214   3.192   8.967
  689   1HB   LYS  86          HB1       LYS  86 -10.886   5.689   9.075
  690   2HB   LYS  86          HB2       LYS  86 -10.832   4.565  10.426
  691   1HG   LYS  86          HG1       LYS  86  -8.881   5.395  11.128
  692   2HG   LYS  86          HG2       LYS  86  -8.154   5.182   9.534
  693   1HD   LYS  86          HD1       LYS  86  -9.182   7.322   8.810
  694   2HD   LYS  86          HD2       LYS  86  -9.830   7.540  10.435
  695   1HE   LYS  86          HE1       LYS  86  -7.817   8.860  10.202
  696   2HE   LYS  86          HE2       LYS  86  -7.509   7.535  11.320
  697   1HZ   LYS  86          HZ1       LYS  86  -6.571   7.848   8.537
  698   2HZ   LYS  86          HZ2       LYS  86  -6.593   6.335   9.290
  699   3HZ   LYS  86          HZ3       LYS  86  -5.659   7.583   9.942
  700    H    LYS  87           HN       LYS  87 -11.699   3.441   6.674
  701    HA   LYS  87           HA       LYS  87 -13.770   1.990   8.055
  702   1HB   LYS  87          HB1       LYS  87 -13.404   2.484   5.110
  703   2HB   LYS  87          HB2       LYS  87 -14.866   1.942   5.889
  704   1HG   LYS  87          HG1       LYS  87 -14.997   4.242   6.993
  705   2HG   LYS  87          HG2       LYS  87 -13.690   4.728   5.869
  706   1HD   LYS  87          HD1       LYS  87 -15.375   3.104   4.393
  707   2HD   LYS  87          HD2       LYS  87 -16.474   4.059   5.329
  708   1HE   LYS  87          HE1       LYS  87 -16.099   5.930   4.043
  709   2HE   LYS  87          HE2       LYS  87 -14.491   5.378   3.523
  710   1HZ   LYS  87          HZ1       LYS  87 -16.438   5.079   1.892
  711   2HZ   LYS  87          HZ2       LYS  87 -16.924   3.810   2.892
  712   3HZ   LYS  87          HZ3       LYS  87 -15.408   3.751   2.136
  713    H    GLU  88           HN       GLU  88 -13.235  -0.084   8.580
  714    HA   GLU  88           HA       GLU  88 -11.544  -1.868   7.387
  715   1HB   GLU  88          HB1       GLU  88 -12.697  -2.036   9.611
  716   2HB   GLU  88          HB2       GLU  88 -14.112  -2.643   8.753
  717   1HG   GLU  88          HG1       GLU  88 -12.677  -4.487   7.832
  718   2HG   GLU  88          HG2       GLU  88 -11.380  -3.928   8.897
  719    H    LYS  89           HN       LYS  89 -15.057  -1.684   6.655
  720    HA   LYS  89           HA       LYS  89 -15.261  -3.858   4.972
  721   1HB   LYS  89          HB1       LYS  89 -16.791  -1.325   4.450
  722   2HB   LYS  89          HB2       LYS  89 -17.332  -2.996   4.320
  723   1HG   LYS  89          HG1       LYS  89 -16.517  -1.813   6.957
  724   2HG   LYS  89          HG2       LYS  89 -18.148  -1.629   6.332
  725   1HD   LYS  89          HD1       LYS  89 -18.713  -3.705   6.984
  726   2HD   LYS  89          HD2       LYS  89 -17.256  -4.402   6.255
  727   1HE   LYS  89          HE1       LYS  89 -16.212  -3.041   8.389
  728   2HE   LYS  89          HE2       LYS  89 -17.760  -3.579   9.040
  729   1HZ   LYS  89          HZ1       LYS  89 -15.900  -5.430   7.676
  730   2HZ   LYS  89          HZ2       LYS  89 -17.201  -5.810   8.684
  731   3HZ   LYS  89          HZ3       LYS  89 -15.804  -5.118   9.339
  732    H    ASP  90           HN       ASP  90 -14.466  -0.579   4.143
  733    HA   ASP  90           HA       ASP  90 -14.106  -0.683   1.428
  734   1HB   ASP  90          HB1       ASP  90 -13.159   1.001   3.700
  735   2HB   ASP  90          HB2       ASP  90 -12.449   1.271   2.120
  736    H    ARG  91           HN       ARG  91 -11.562  -1.202   3.972
  737    HA   ARG  91           HA       ARG  91  -9.533  -1.850   2.084
  738   1HB   ARG  91          HB1       ARG  91  -9.281  -3.041   4.799
  739   2HB   ARG  91          HB2       ARG  91  -8.079  -2.217   3.811
  740   1HG   ARG  91          HG1       ARG  91  -8.881  -0.087   4.424
  741   2HG   ARG  91          HG2       ARG  91 -10.366  -0.745   5.088
  742   1HD   ARG  91          HD1       ARG  91  -7.589  -0.883   6.255
  743   2HD   ARG  91          HD2       ARG  91  -8.987  -0.043   6.906
  744    HE   ARG  91           HE       ARG  91  -9.624  -2.118   6.422
  745   1HH1  ARG  91          HH21      ARG  91  -6.961  -1.194   8.456
  746   2HH1  ARG  91          HH22      ARG  91  -7.069  -2.323   9.761
  747   1HH2  ARG  91          HH11      ARG  91  -9.798  -3.990   8.511
  748   2HH2  ARG  91          HH12      ARG  91  -8.678  -3.858   9.819
  749    H    ASN  92           HN       ASN  92 -11.887  -3.878   3.778
  750    HA   ASN  92           HA       ASN  92 -10.961  -6.390   3.417
  751   1HB   ASN  92          HB1       ASN  92 -13.750  -5.296   3.163
  752   2HB   ASN  92          HB2       ASN  92 -13.431  -7.016   3.009
  753   1HD2  ASN  92          HD21      ASN  92 -15.111  -6.144   4.933
  754   2HD2  ASN  92          HD22      ASN  92 -14.318  -6.595   6.403
  755    H    ASP  93           HN       ASP  93 -12.986  -4.836   0.877
  756    HA   ASP  93           HA       ASP  93 -12.420  -6.675  -1.157
  757   1HB   ASP  93          HB1       ASP  93 -14.116  -4.576  -0.929
  758   2HB   ASP  93          HB2       ASP  93 -12.908  -3.881  -1.998
  759    H    LEU  94           HN       LEU  94 -10.631  -3.675  -0.281
  760    HA   LEU  94           HA       LEU  94  -8.914  -3.504  -2.422
  761   1HB   LEU  94          HB1       LEU  94  -9.096  -2.453   0.311
  762   2HB   LEU  94          HB2       LEU  94  -7.490  -2.562  -0.305
  763    HG   LEU  94           HG       LEU  94  -9.653  -1.211  -1.887
  764   1HD1  LEU  94          HD11      LEU  94  -9.465  -0.231   0.400
  765   2HD1  LEU  94          HD12      LEU  94  -9.044   0.892  -0.896
  766   3HD1  LEU  94          HD13      LEU  94  -7.772   0.130   0.056
  767   1HD2  LEU  94          HD21      LEU  94  -7.932  -0.025  -3.011
  768   2HD2  LEU  94          HD22      LEU  94  -7.415  -1.710  -2.995
  769   3HD2  LEU  94          HD23      LEU  94  -6.706  -0.560  -1.861
  770    H    ILE  95           HN       ILE  95  -8.574  -5.484   0.505
  771    HA   ILE  95           HA       ILE  95  -5.965  -6.427   0.113
  772    HB   ILE  95           HB       ILE  95  -8.292  -7.770   1.507
  773   1HG1  ILE  95          HG11      ILE  95  -6.049  -6.126   2.719
  774   2HG1  ILE  95          HG12      ILE  95  -7.616  -5.444   2.294
  775   1HG2  ILE  95          HG21      ILE  95  -6.471  -9.371   1.050
  776   2HG2  ILE  95          HG22      ILE  95  -6.612  -9.027   2.773
  777   3HG2  ILE  95          HG23      ILE  95  -5.323  -8.280   1.829
  778   1HD1  ILE  95          HD11      ILE  95  -8.657  -7.158   3.830
  779   2HD1  ILE  95          HD12      ILE  95  -7.677  -5.923   4.622
  780   3HD1  ILE  95          HD13      ILE  95  -7.024  -7.542   4.377
  781    H    THR  96           HN       THR  96  -9.081  -7.916  -0.863
  782    HA   THR  96           HA       THR  96  -8.095 -10.155  -2.181
  783    HB   THR  96           HB       THR  96 -10.549  -8.642  -3.080
  784    HG1  THR  96           HG1      THR  96 -10.061  -9.681  -0.684
  785   1HG2  THR  96          HG21      THR  96  -9.975 -11.609  -3.020
  786   2HG2  THR  96          HG22      THR  96  -9.774 -10.599  -4.453
  787   3HG2  THR  96          HG23      THR  96 -11.373 -10.806  -3.737
  788    H    TYR  97           HN       TYR  97  -8.590  -6.871  -3.536
  789    HA   TYR  97           HA       TYR  97  -7.797  -7.570  -6.167
  790   1HB   TYR  97          HB1       TYR  97  -9.105  -5.589  -5.825
  791   2HB   TYR  97          HB2       TYR  97  -7.870  -4.894  -4.782
  792    HD1  TYR  97           HD1      TYR  97  -6.897  -3.050  -5.751
  793    HD2  TYR  97           HD2      TYR  97  -7.769  -6.476  -8.198
  794    HE1  TYR  97           HE1      TYR  97  -5.827  -1.928  -7.695
  795    HE2  TYR  97           HE2      TYR  97  -6.811  -5.316 -10.180
  796    HH   TYR  97           HH       TYR  97  -6.083  -3.296 -10.961
  797    H    LEU  98           HN       LEU  98  -5.924  -5.899  -3.592
  798    HA   LEU  98           HA       LEU  98  -3.501  -5.713  -4.985
  799   1HB   LEU  98          HB1       LEU  98  -4.431  -4.834  -2.589
  800   2HB   LEU  98          HB2       LEU  98  -3.353  -6.123  -2.060
  801    HG   LEU  98           HG       LEU  98  -1.474  -5.110  -3.254
  802   1HD1  LEU  98          HD11      LEU  98  -3.486  -3.009  -4.089
  803   2HD1  LEU  98          HD12      LEU  98  -2.675  -4.157  -5.155
  804   3HD1  LEU  98          HD13      LEU  98  -1.743  -2.901  -4.337
  805   1HD2  LEU  98          HD21      LEU  98  -2.989  -3.068  -1.616
  806   2HD2  LEU  98          HD22      LEU  98  -1.267  -3.012  -1.991
  807   3HD2  LEU  98          HD23      LEU  98  -1.907  -4.307  -0.979
  808    H    LYS  99           HN       LYS  99  -4.604  -8.123  -2.667
  809    HA   LYS  99           HA       LYS  99  -2.417  -9.829  -2.644
  810   1HB   LYS  99          HB1       LYS  99  -3.727 -10.586  -0.998
  811   2HB   LYS  99          HB2       LYS  99  -5.165  -9.877  -1.711
  812   1HG   LYS  99          HG1       LYS  99  -5.449 -11.843  -3.133
  813   2HG   LYS  99          HG2       LYS  99  -3.981 -12.547  -2.485
  814   1HD   LYS  99          HD1       LYS  99  -5.991 -11.897  -0.441
  815   2HD   LYS  99          HD2       LYS  99  -6.525 -13.094  -1.625
  816   1HE   LYS  99          HE1       LYS  99  -5.283 -13.882   0.511
  817   2HE   LYS  99          HE2       LYS  99  -4.886 -14.607  -1.039
  818   1HZ   LYS  99          HZ1       LYS  99  -3.100 -13.640   0.680
  819   2HZ   LYS  99          HZ2       LYS  99  -3.303 -12.299  -0.334
  820   3HZ   LYS  99          HZ3       LYS  99  -2.845 -13.789  -0.996
  821    H    LYS 100           HN       LYS 100  -5.124  -9.702  -4.951
  822    HA   LYS 100           HA       LYS 100  -4.421 -12.097  -6.313
  823   1HB   LYS 100          HB1       LYS 100  -6.690 -10.730  -6.115
  824   2HB   LYS 100          HB2       LYS 100  -6.166 -10.163  -7.684
  825   1HG   LYS 100          HG1       LYS 100  -7.785 -12.156  -7.601
  826   2HG   LYS 100          HG2       LYS 100  -6.380 -12.299  -8.660
  827   1HD   LYS 100          HD1       LYS 100  -5.965 -13.203  -5.915
  828   2HD   LYS 100          HD2       LYS 100  -7.182 -14.105  -6.762
  829   1HE   LYS 100          HE1       LYS 100  -5.391 -15.457  -7.052
  830   2HE   LYS 100          HE2       LYS 100  -5.175 -14.436  -8.483
  831   1HZ   LYS 100          HZ1       LYS 100  -3.124 -14.695  -7.078
  832   2HZ   LYS 100          HZ2       LYS 100  -3.924 -13.867  -5.839
  833   3HZ   LYS 100          HZ3       LYS 100  -3.606 -13.085  -7.309
  834    H    ALA 101           HN       ALA 101  -3.541  -8.890  -6.788
  835    HA   ALA 101           HA       ALA 101  -2.382  -9.034  -9.388
  836   1HB   ALA 101          HB1       ALA 101  -3.480  -7.023  -8.581
  837   2HB   ALA 101          HB2       ALA 101  -1.781  -6.695  -8.922
  838   3HB   ALA 101          HB3       ALA 101  -2.324  -6.896  -7.256
  839    H    THR 102           HN       THR 102  -1.120  -9.150  -6.081
  840    HA   THR 102           HA       THR 102   1.660  -9.208  -6.788
  841    HB   THR 102           HB       THR 102   0.459  -9.991  -4.134
  842    HG1  THR 102           HG1      THR 102  -0.190  -7.855  -4.809
  843   1HG2  THR 102          HG21      THR 102   2.855 -10.502  -4.414
  844   2HG2  THR 102          HG22      THR 102   2.592  -9.226  -3.224
  845   3HG2  THR 102          HG23      THR 102   3.154  -8.817  -4.846
  846    H    GLU 103           HN       GLU 103  -0.781 -11.659  -5.916
  847    HA   GLU 103           HA       GLU 103   1.126 -13.736  -6.791
  848   1HB   GLU 103          HB1       GLU 103  -0.513 -15.170  -5.179
  849   2HB   GLU 103          HB2       GLU 103   1.011 -14.475  -4.655
  850   1HG   GLU 103          HG1       GLU 103  -0.083 -13.401  -3.070
  851   2HG   GLU 103          HG2       GLU 103  -0.888 -12.455  -4.316
  852    HHA  HEC 104           HA       HEC 104   4.995   3.373   1.402
  853    HHB  HEC 104           HB       HEC 104  -0.661   0.465   0.078
  854    HHC  HEC 104           HC       HEC 104  -3.201   6.220  -1.484
  855    HHD  HEC 104           HD       HEC 104   2.725   8.787  -1.348
  856   1HMA  HEC 104          HMA1      HEC 104   1.117  -0.947   1.903
  857   2HMA  HEC 104          HMA2      HEC 104   2.646  -1.304   1.097
  858   3HMA  HEC 104          HMA3      HEC 104   1.168  -1.134   0.150
  859   1HAA  HEC 104          HAA1      HEC 104   4.167  -0.299   2.037
  860   2HAA  HEC 104          HAA2      HEC 104   4.837   1.272   2.436
  861   1HBA  HEC 104          HBA1      HEC 104   5.728   1.447   0.125
  862   2HBA  HEC 104          HBA2      HEC 104   5.117  -0.166  -0.208
  863   1HMB  HEC 104          HMB1      HEC 104  -2.531   0.150  -0.573
  864   2HMB  HEC 104          HMB2      HEC 104  -3.438   0.756  -1.958
  865   3HMB  HEC 104          HMB3      HEC 104  -4.121   0.877  -0.337
  866    HAB  HEC 104           HAB      HEC 104  -4.599   4.886  -1.559
  867   1HBB  HEC 104          HBB1      HEC 104  -4.953   3.644   0.714
  868   2HBB  HEC 104          HBB2      HEC 104  -5.934   2.577  -0.292
  869   3HBB  HEC 104          HBB3      HEC 104  -6.296   4.303  -0.221
  870   1HMC  HEC 104          HMC1      HEC 104  -3.265   8.788  -1.624
  871   2HMC  HEC 104          HMC2      HEC 104  -2.904   8.077  -3.197
  872   3HMC  HEC 104          HMC3      HEC 104  -2.307   9.688  -2.800
  873    HAC  HEC 104           HAC      HEC 104   1.538   9.843  -2.632
  874   1HBC  HEC 104          HBC1      HEC 104   0.720  11.215  -0.956
  875   2HBC  HEC 104          HBC2      HEC 104  -0.933  11.143  -1.566
  876   3HBC  HEC 104          HBC3      HEC 104   0.305  12.017  -2.470
  877   1HMD  HEC 104          HMD1      HEC 104   4.846   9.187  -0.408
  878   2HMD  HEC 104          HMD2      HEC 104   5.318   8.215  -1.802
  879   3HMD  HEC 104          HMD3      HEC 104   6.322   8.222  -0.351
  880   1HAD  HEC 104          HAD1      HEC 104   7.125   6.346   0.421
  881   2HAD  HEC 104          HAD2      HEC 104   6.670   4.795   1.119
  882   1HBD  HEC 104          HBD1      HEC 104   6.125   5.724   3.170
  883   2HBD  HEC 104          HBD2      HEC 104   5.806   7.305   2.489
  884    H2   4NL 105           H2       4NL 105  -0.122 -12.947  -1.320
  885    H6   4NL 105           H6       4NL 105   2.266 -14.482   2.811
  886    H3   4NL 105           H3       4NL 105  -1.208 -10.518   2.113
  887    H5   4NL 105           H5       4NL 105  -2.257 -10.401   0.133
  888    H4   4NL 105           H4       4NL 105   0.613 -11.602   3.457
  889    H1   4NL 105           H1       4NL 105   1.699 -14.031   0.022
  890    H7   4NL 105           H7       4NL 105   3.113 -12.919   2.898
  Start of MODEL   18
    1   1H    THR  -5          HT1       THR  -5 -13.505  -7.003  13.658
    2   2H    THR  -5          HT2       THR  -5 -12.807  -6.254  12.309
    3   3H    THR  -5          HT3       THR  -5 -11.907  -6.442  13.730
    4    HA   THR  -5           HA       THR  -5 -11.368  -8.044  11.905
    5    HB   THR  -5           HB       THR  -5 -12.379  -9.583  14.278
    6    HG1  THR  -5           HG1      THR  -5 -10.209  -8.702  15.162
    7   1HG2  THR  -5          HG21      THR  -5  -9.694  -9.456  12.890
    8   2HG2  THR  -5          HG22      THR  -5 -10.956 -10.636  12.535
    9   3HG2  THR  -5          HG23      THR  -5 -10.184 -10.620  14.122
   10    H    GLU  -4           HN       GLU  -4 -13.334  -7.672  10.456
   11    HA   GLU  -4           HA       GLU  -4 -14.934 -10.106  10.369
   12   1HB   GLU  -4          HB1       GLU  -4 -16.210  -8.094  11.513
   13   2HB   GLU  -4          HB2       GLU  -4 -16.331  -7.478   9.869
   14   1HG   GLU  -4          HG1       GLU  -4 -17.177 -10.287  10.458
   15   2HG   GLU  -4          HG2       GLU  -4 -18.245  -8.952  10.874
   16    H    PHE  -3           HN       PHE  -3 -13.111 -10.296   8.815
   17    HA   PHE  -3           HA       PHE  -3 -13.086  -8.651   6.477
   18   1HB   PHE  -3          HB1       PHE  -3 -10.965  -9.451   7.141
   19   2HB   PHE  -3          HB2       PHE  -3 -11.524 -11.118   7.206
   20    HD1  PHE  -3           HD1      PHE  -3 -10.541  -8.342   4.948
   21    HD2  PHE  -3           HD2      PHE  -3 -11.587 -12.503   5.235
   22    HE1  PHE  -3           HE1      PHE  -3  -9.862  -8.674   2.578
   23    HE2  PHE  -3           HE2      PHE  -3 -10.957 -12.827   2.851
   24    HZ   PHE  -3           HZ       PHE  -3 -10.123 -10.904   1.510
   25    H    LYS  -2           HN       LYS  -2 -14.421  -8.707   4.953
   26    HA   LYS  -2           HA       LYS  -2 -15.828 -11.148   4.139
   27   1HB   LYS  -2          HB1       LYS  -2 -16.623  -8.333   4.482
   28   2HB   LYS  -2          HB2       LYS  -2 -17.152  -9.033   2.954
   29   1HG   LYS  -2          HG1       LYS  -2 -18.125 -10.947   4.228
   30   2HG   LYS  -2          HG2       LYS  -2 -17.717 -10.107   5.721
   31   1HD   LYS  -2          HD1       LYS  -2 -19.162  -8.213   5.000
   32   2HD   LYS  -2          HD2       LYS  -2 -19.619  -9.142   3.574
   33   1HE   LYS  -2          HE1       LYS  -2 -21.369  -9.370   5.198
   34   2HE   LYS  -2          HE2       LYS  -2 -20.523 -10.910   5.094
   35   1HZ   LYS  -2          HZ1       LYS  -2 -19.293 -10.284   7.118
   36   2HZ   LYS  -2          HZ2       LYS  -2 -20.959 -10.385   7.375
   37   3HZ   LYS  -2          HZ3       LYS  -2 -20.228  -8.872   7.227
   38    H    ALA  -1           HN       ALA  -1 -15.147 -12.019   2.351
   39    HA   ALA  -1           HA       ALA  -1 -13.056 -11.176   0.764
   40   1HB   ALA  -1          HB1       ALA  -1 -13.693 -13.008  -0.719
   41   2HB   ALA  -1          HB2       ALA  -1 -15.275 -13.098   0.057
   42   3HB   ALA  -1          HB3       ALA  -1 -13.820 -13.491   0.974
   43    H    GLY   1           HN       GLY   1 -12.847 -10.198  -1.208
   44   1HA   GLY   1          HA1       GLY   1 -15.145  -8.682  -2.264
   45   2HA   GLY   1          HA2       GLY   1 -13.479  -8.127  -2.300
   46    H    SER   2           HN       SER   2 -13.293  -7.867  -4.444
   47    HA   SER   2           HA       SER   2 -12.815 -10.148  -6.121
   48   1HB   SER   2          HB1       SER   2 -14.798  -8.300  -7.347
   49   2HB   SER   2          HB2       SER   2 -14.570 -10.037  -7.590
   50    HG   SER   2           HG       SER   2 -15.377 -10.212  -5.334
   51    H    ALA   3           HN       ALA   3 -11.423  -9.637  -7.787
   52    HA   ALA   3           HA       ALA   3  -9.779  -7.476  -7.659
   53   1HB   ALA   3          HB1       ALA   3  -8.893  -8.150  -9.759
   54   2HB   ALA   3          HB2       ALA   3 -10.408  -8.929 -10.218
   55   3HB   ALA   3          HB3       ALA   3  -9.430  -9.604  -8.916
   56    H    LYS   4           HN       LYS   4 -12.723  -7.580  -9.748
   57    HA   LYS   4           HA       LYS   4 -12.205  -4.972 -10.784
   58   1HB   LYS   4          HB1       LYS   4 -13.314  -6.851 -12.038
   59   2HB   LYS   4          HB2       LYS   4 -14.779  -6.457 -11.139
   60   1HG   LYS   4          HG1       LYS   4 -13.738  -4.017 -12.136
   61   2HG   LYS   4          HG2       LYS   4 -13.703  -5.172 -13.462
   62   1HD   LYS   4          HD1       LYS   4 -15.968  -5.237 -13.630
   63   2HD   LYS   4          HD2       LYS   4 -16.204  -5.105 -11.884
   64   1HE   LYS   4          HE1       LYS   4 -15.228  -2.771 -13.525
   65   2HE   LYS   4          HE2       LYS   4 -16.950  -3.112 -13.343
   66   1HZ   LYS   4          HZ1       LYS   4 -16.879  -2.683 -11.090
   67   2HZ   LYS   4          HZ2       LYS   4 -15.836  -1.509 -11.712
   68   3HZ   LYS   4          HZ3       LYS   4 -15.200  -2.896 -10.984
   69    H    LYS   5           HN       LYS   5 -13.179  -5.614  -7.789
   70    HA   LYS   5           HA       LYS   5 -14.985  -3.289  -7.625
   71   1HB   LYS   5          HB1       LYS   5 -14.614  -5.605  -5.718
   72   2HB   LYS   5          HB2       LYS   5 -15.486  -4.140  -5.283
   73   1HG   LYS   5          HG1       LYS   5 -16.788  -4.722  -7.550
   74   2HG   LYS   5          HG2       LYS   5 -16.279  -6.351  -7.099
   75   1HD   LYS   5          HD1       LYS   5 -17.401  -4.766  -4.884
   76   2HD   LYS   5          HD2       LYS   5 -18.544  -5.112  -6.182
   77   1HE   LYS   5          HE1       LYS   5 -18.693  -6.860  -4.520
   78   2HE   LYS   5          HE2       LYS   5 -17.966  -7.526  -5.982
   79   1HZ   LYS   5          HZ1       LYS   5 -16.942  -7.849  -3.547
   80   2HZ   LYS   5          HZ2       LYS   5 -16.115  -6.447  -4.024
   81   3HZ   LYS   5          HZ3       LYS   5 -16.007  -7.853  -4.962
   82    H    GLY   6           HN       GLY   6 -12.373  -4.838  -5.713
   83   1HA   GLY   6          HA1       GLY   6 -11.712  -2.613  -4.153
   84   2HA   GLY   6          HA2       GLY   6 -10.612  -3.923  -4.551
   85    H    ALA   7           HN       ALA   7 -10.633  -3.445  -7.430
   86    HA   ALA   7           HA       ALA   7  -8.546  -1.652  -7.738
   87   1HB   ALA   7          HB1       ALA   7  -9.069  -1.778 -10.187
   88   2HB   ALA   7          HB2       ALA   7 -10.503  -2.717  -9.768
   89   3HB   ALA   7          HB3       ALA   7  -8.900  -3.340  -9.383
   90    H    THR   8           HN       THR   8 -12.039  -1.002  -8.536
   91    HA   THR   8           HA       THR   8 -11.717   1.569  -9.486
   92    HB   THR   8           HB       THR   8 -14.072   1.847  -8.122
   93    HG1  THR   8           HG1      THR   8 -13.842  -0.363  -7.412
   94   1HG2  THR   8          HG21      THR   8 -15.146   1.169 -10.237
   95   2HG2  THR   8          HG22      THR   8 -13.601   0.527 -10.797
   96   3HG2  THR   8          HG23      THR   8 -13.781   2.256 -10.500
   97    H    LEU   9           HN       LEU   9 -11.820   0.625  -6.083
   98    HA   LEU   9           HA       LEU   9 -11.902   3.245  -4.993
   99   1HB   LEU   9          HB1       LEU   9 -10.935   0.680  -3.690
  100   2HB   LEU   9          HB2       LEU   9 -11.404   2.162  -2.859
  101    HG   LEU   9           HG       LEU   9 -13.282   0.522  -4.579
  102   1HD1  LEU   9          HD11      LEU   9 -12.999   0.665  -1.572
  103   2HD1  LEU   9          HD12      LEU   9 -12.642  -0.733  -2.587
  104   3HD1  LEU   9          HD13      LEU   9 -14.300  -0.153  -2.438
  105   1HD2  LEU   9          HD21      LEU   9 -13.977   2.854  -4.431
  106   2HD2  LEU   9          HD22      LEU   9 -13.770   2.829  -2.680
  107   3HD2  LEU   9          HD23      LEU   9 -15.034   1.854  -3.430
  108    H    PHE  10           HN       PHE  10  -9.245   0.863  -5.170
  109    HA   PHE  10           HA       PHE  10  -7.147   2.516  -4.358
  110   1HB   PHE  10          HB1       PHE  10  -6.685   0.249  -4.286
  111   2HB   PHE  10          HB2       PHE  10  -7.373  -0.052  -5.874
  112    HD1  PHE  10           HD1      PHE  10  -6.052   0.549  -7.943
  113    HD2  PHE  10           HD2      PHE  10  -4.381   0.680  -3.982
  114    HE1  PHE  10           HE1      PHE  10  -3.753   0.502  -8.906
  115    HE2  PHE  10           HE2      PHE  10  -2.094   0.764  -4.949
  116    HZ   PHE  10           HZ       PHE  10  -1.772   0.649  -7.408
  117    H    LYS  11           HN       LYS  11  -8.467   1.954  -7.601
  118    HA   LYS  11           HA       LYS  11  -6.403   3.292  -9.016
  119   1HB   LYS  11          HB1       LYS  11  -8.479   1.594  -9.679
  120   2HB   LYS  11          HB2       LYS  11  -8.922   3.111 -10.458
  121   1HG   LYS  11          HG1       LYS  11  -7.573   2.385 -12.115
  122   2HG   LYS  11          HG2       LYS  11  -6.289   3.004 -11.080
  123   1HD   LYS  11          HD1       LYS  11  -6.066   0.717 -10.095
  124   2HD   LYS  11          HD2       LYS  11  -7.248   0.141 -11.272
  125   1HE   LYS  11          HE1       LYS  11  -5.708   0.979 -13.086
  126   2HE   LYS  11          HE2       LYS  11  -4.509   1.297 -11.836
  127   1HZ   LYS  11          HZ1       LYS  11  -5.045  -1.236 -11.305
  128   2HZ   LYS  11          HZ2       LYS  11  -3.859  -0.774 -12.419
  129   3HZ   LYS  11          HZ3       LYS  11  -5.390  -1.239 -12.965
  130    H    THR  12           HN       THR  12  -8.634   4.711  -7.067
  131    HA   THR  12           HA       THR  12  -8.372   7.306  -8.359
  132    HB   THR  12           HB       THR  12 -10.645   5.988  -8.696
  133    HG1  THR  12           HG1      THR  12 -10.134   7.908  -9.683
  134   1HG2  THR  12          HG21      THR  12 -12.420   7.059  -7.330
  135   2HG2  THR  12          HG22      THR  12 -11.170   7.632  -6.225
  136   3HG2  THR  12          HG23      THR  12 -11.435   5.901  -6.437
  137    H    ARG  13           HN       ARG  13  -7.519   5.662  -5.873
  138    HA   ARG  13           HA       ARG  13  -7.595   7.858  -3.910
  139   1HB   ARG  13          HB1       ARG  13  -8.047   4.920  -3.486
  140   2HB   ARG  13          HB2       ARG  13  -7.436   5.923  -2.187
  141   1HG   ARG  13          HG1       ARG  13 -10.063   6.310  -3.609
  142   2HG   ARG  13          HG2       ARG  13  -9.850   5.531  -2.048
  143   1HD   ARG  13          HD1       ARG  13 -10.596   7.734  -1.594
  144   2HD   ARG  13          HD2       ARG  13  -8.863   7.733  -1.241
  145    HE   ARG  13           HE       ARG  13 -10.130   8.442  -3.651
  146   1HH1  ARG  13          HH11      ARG  13  -7.908   9.277  -1.086
  147   2HH1  ARG  13          HH12      ARG  13  -6.981  10.487  -1.896
  148   1HH2  ARG  13          HH21      ARG  13  -8.656  10.265  -4.871
  149   2HH2  ARG  13          HH22      ARG  13  -7.385  11.021  -3.975
  150    H    CYS  14           HN       CYS  14  -5.854   4.995  -5.035
  151    HA   CYS  14           HA       CYS  14  -3.406   5.898  -3.673
  152   1HB   CYS  14          HB1       CYS  14  -3.773   3.175  -4.854
  153   2HB   CYS  14          HB2       CYS  14  -2.711   3.676  -3.556
  154    H    LEU  15           HN       LEU  15  -4.782   5.096  -6.796
  155    HA   LEU  15           HA       LEU  15  -2.579   4.787  -8.402
  156   1HB   LEU  15          HB1       LEU  15  -5.055   4.585  -8.969
  157   2HB   LEU  15          HB2       LEU  15  -5.031   6.322  -9.242
  158    HG   LEU  15           HG       LEU  15  -3.192   5.964 -10.929
  159   1HD1  LEU  15          HD11      LEU  15  -3.963   3.059 -10.665
  160   2HD1  LEU  15          HD12      LEU  15  -2.434   3.758 -10.130
  161   3HD1  LEU  15          HD13      LEU  15  -2.847   3.745 -11.846
  162   1HD2  LEU  15          HD21      LEU  15  -5.965   4.925 -11.262
  163   2HD2  LEU  15          HD22      LEU  15  -4.812   4.689 -12.575
  164   3HD2  LEU  15          HD23      LEU  15  -5.188   6.318 -12.013
  165    H    GLN  16           HN       GLN  16  -3.952   7.860  -7.300
  166    HA   GLN  16           HA       GLN  16  -2.761   9.736  -8.833
  167   1HB   GLN  16          HB1       GLN  16  -2.868  11.225  -6.824
  168   2HB   GLN  16          HB2       GLN  16  -4.353  10.365  -7.199
  169   1HG   GLN  16          HG1       GLN  16  -3.907   8.762  -5.409
  170   2HG   GLN  16          HG2       GLN  16  -2.377   9.567  -5.054
  171   1HE2  GLN  16          HE21      GLN  16  -2.454  11.659  -4.043
  172   2HE2  GLN  16          HE22      GLN  16  -3.885  12.196  -3.246
  173    H    CYS  17           HN       CYS  17  -1.059   7.914  -6.315
  174    HA   CYS  17           HA       CYS  17   1.440   9.273  -7.065
  175   1HB   CYS  17          HB1       CYS  17   1.209   7.979  -4.397
  176   2HB   CYS  17          HB2       CYS  17   2.135   9.376  -4.918
  177    H    HIS  18           HN       HIS  18  -0.039   6.153  -6.398
  178    HA   HIS  18           HA       HIS  18   2.510   4.730  -6.618
  179   1HB   HIS  18          HB1       HIS  18  -0.187   4.042  -5.508
  180   2HB   HIS  18          HB2       HIS  18   0.984   2.789  -5.856
  181    HD1  HIS  18           HD1      HIS  18   3.479   3.350  -4.520
  182    HD2  HIS  18           HD2      HIS  18  -0.141   4.863  -3.060
  183    HE1  HIS  18           HE1      HIS  18   3.853   3.812  -2.055
  184    H    THR  19           HN       THR  19   1.934   2.366  -7.377
  185    HA   THR  19           HA       THR  19   0.226   2.074  -9.664
  186    HB   THR  19           HB       THR  19   2.485   1.149 -10.833
  187    HG1  THR  19           HG1      THR  19   4.062   2.769 -10.581
  188   1HG2  THR  19          HG21      THR  19   1.272   3.900 -11.002
  189   2HG2  THR  19          HG22      THR  19   0.970   2.516 -12.053
  190   3HG2  THR  19          HG23      THR  19   2.531   3.332 -12.097
  191    H    VAL  20           HN       VAL  20  -0.672   0.083  -9.441
  192    HA   VAL  20           HA       VAL  20   0.362  -1.865  -7.613
  193    HB   VAL  20           HB       VAL  20  -2.083  -1.154  -8.386
  194   1HG1  VAL  20          HG11      VAL  20  -2.105  -2.147 -10.542
  195   2HG1  VAL  20          HG12      VAL  20  -3.185  -3.071  -9.495
  196   3HG1  VAL  20          HG13      VAL  20  -1.589  -3.706  -9.894
  197   1HG2  VAL  20          HG21      VAL  20  -1.221  -3.715  -7.086
  198   2HG2  VAL  20          HG22      VAL  20  -2.918  -3.268  -7.262
  199   3HG2  VAL  20          HG23      VAL  20  -1.827  -2.238  -6.337
  200    H    GLU  21           HN       GLU  21   0.536  -1.520 -11.029
  201    HA   GLU  21           HA       GLU  21   1.576  -4.228 -11.456
  202   1HB   GLU  21          HB1       GLU  21   1.207  -2.290 -13.706
  203   2HB   GLU  21          HB2       GLU  21   0.971  -4.026 -13.690
  204   1HG   GLU  21          HG1       GLU  21  -1.177  -3.147 -14.003
  205   2HG   GLU  21          HG2       GLU  21  -1.129  -3.565 -12.292
  206    H    LYS  22           HN       LYS  22   3.709  -4.377 -12.721
  207    HA   LYS  22           HA       LYS  22   5.506  -2.333 -11.816
  208   1HB   LYS  22          HB1       LYS  22   5.733  -5.068 -12.514
  209   2HB   LYS  22          HB2       LYS  22   6.905  -4.152 -13.478
  210   1HG   LYS  22          HG1       LYS  22   8.016  -3.339 -11.636
  211   2HG   LYS  22          HG2       LYS  22   6.588  -3.428 -10.604
  212   1HD   LYS  22          HD1       LYS  22   6.797  -5.862 -10.529
  213   2HD   LYS  22          HD2       LYS  22   8.224  -5.772 -11.563
  214   1HE   LYS  22          HE1       LYS  22   8.763  -6.047  -9.144
  215   2HE   LYS  22          HE2       LYS  22   9.474  -4.616  -9.868
  216   1HZ   LYS  22          HZ1       LYS  22   7.444  -3.415  -8.845
  217   2HZ   LYS  22          HZ2       LYS  22   8.702  -3.876  -7.820
  218   3HZ   LYS  22          HZ3       LYS  22   7.288  -4.797  -7.880
  219    H    GLY  23           HN       GLY  23   3.662  -2.295 -14.574
  220   1HA   GLY  23          HA1       GLY  23   5.634  -1.276 -16.422
  221   2HA   GLY  23          HA2       GLY  23   3.894  -1.289 -16.657
  222    H    GLY  24           HN       GLY  24   3.835   0.137 -13.872
  223   1HA   GLY  24          HA1       GLY  24   3.889   2.857 -14.890
  224   2HA   GLY  24          HA2       GLY  24   3.179   2.310 -13.381
  225    HA   PRO  25           HA       PRO  25   7.933   3.488 -12.971
  226   1HB   PRO  25          HB1       PRO  25   7.963   6.215 -13.356
  227   2HB   PRO  25          HB2       PRO  25   8.476   5.031 -14.562
  228   1HG   PRO  25          HG1       PRO  25   5.869   6.474 -14.310
  229   2HG   PRO  25          HG2       PRO  25   6.808   6.100 -15.767
  230   1HD   PRO  25          HD1       PRO  25   4.638   4.671 -15.075
  231   2HD   PRO  25          HD2       PRO  25   6.047   3.914 -15.849
  232    H    HIS  26           HN       HIS  26   8.728   4.572 -11.079
  233    HA   HIS  26           HA       HIS  26   6.878   4.766  -8.949
  234   1HB   HIS  26          HB1       HIS  26   9.749   5.715  -9.125
  235   2HB   HIS  26          HB2       HIS  26   8.843   5.471  -7.642
  236    HD2  HIS  26           HD2      HIS  26  10.881   3.604 -10.272
  237    HE1  HIS  26           HE1      HIS  26   9.827   0.734  -7.326
  238    HE2  HIS  26           HE2      HIS  26  11.270   1.187  -9.365
  239    H    LYS  27           HN       LYS  27   5.422   6.433  -8.870
  240    HA   LYS  27           HA       LYS  27   6.125   9.095  -9.784
  241   1HB   LYS  27          HB1       LYS  27   3.581   7.653  -9.158
  242   2HB   LYS  27          HB2       LYS  27   3.583   9.410  -9.176
  243   1HG   LYS  27          HG1       LYS  27   4.167   9.504 -11.461
  244   2HG   LYS  27          HG2       LYS  27   4.664   7.808 -11.486
  245   1HD   LYS  27          HD1       LYS  27   1.839   8.870 -11.203
  246   2HD   LYS  27          HD2       LYS  27   2.510   7.993 -12.584
  247   1HE   LYS  27          HE1       LYS  27   2.483   5.964 -11.485
  248   2HE   LYS  27          HE2       LYS  27   2.633   6.706  -9.892
  249   1HZ   LYS  27          HZ1       LYS  27   0.194   6.727 -11.586
  250   2HZ   LYS  27          HZ2       LYS  27   0.336   7.437 -10.060
  251   3HZ   LYS  27          HZ3       LYS  27   0.441   5.758 -10.216
  252    H    VAL  28           HN       VAL  28   3.975   9.885  -7.540
  253    HA   VAL  28           HA       VAL  28   5.786  11.022  -5.696
  254    HB   VAL  28           HB       VAL  28   2.866  10.519  -5.146
  255   1HG1  VAL  28          HG11      VAL  28   3.091  12.740  -3.985
  256   2HG1  VAL  28          HG12      VAL  28   4.831  12.629  -4.249
  257   3HG1  VAL  28          HG13      VAL  28   4.012  11.426  -3.253
  258   1HG2  VAL  28          HG21      VAL  28   3.997  12.866  -6.688
  259   2HG2  VAL  28          HG22      VAL  28   2.313  12.627  -6.221
  260   3HG2  VAL  28          HG23      VAL  28   3.063  11.548  -7.397
  261    H    GLY  29           HN       GLY  29   4.299   7.928  -5.909
  262   1HA   GLY  29          HA1       GLY  29   5.445   7.057  -3.336
  263   2HA   GLY  29          HA2       GLY  29   3.875   6.502  -3.893
  264    HA   PRO  30           HA       PRO  30   7.585   3.883  -5.556
  265   1HB   PRO  30          HB1       PRO  30   7.585   1.851  -3.771
  266   2HB   PRO  30          HB2       PRO  30   8.552   3.315  -3.561
  267   1HG   PRO  30          HG1       PRO  30   5.892   2.620  -2.363
  268   2HG   PRO  30          HG2       PRO  30   7.324   3.309  -1.574
  269   1HD   PRO  30          HD1       PRO  30   5.240   4.836  -2.326
  270   2HD   PRO  30          HD2       PRO  30   6.913   5.429  -2.398
  271    H    ASN  31           HN       ASN  31   7.476   1.618  -6.360
  272    HA   ASN  31           HA       ASN  31   4.858   1.003  -7.347
  273   1HB   ASN  31          HB1       ASN  31   6.926   0.797  -8.697
  274   2HB   ASN  31          HB2       ASN  31   7.495  -0.480  -7.631
  275   1HD2  ASN  31          HD21      ASN  31   5.113   0.314 -10.106
  276   2HD2  ASN  31          HD22      ASN  31   4.781  -1.336 -10.517
  277    H    LEU  32           HN       LEU  32   3.428  -0.471  -6.557
  278    HA   LEU  32           HA       LEU  32   3.867  -1.730  -3.989
  279   1HB   LEU  32          HB1       LEU  32   1.363  -1.401  -5.648
  280   2HB   LEU  32          HB2       LEU  32   1.423  -1.992  -4.000
  281    HG   LEU  32           HG       LEU  32   2.260   0.797  -4.840
  282   1HD1  LEU  32          HD11      LEU  32   0.171   1.551  -3.841
  283   2HD1  LEU  32          HD12      LEU  32  -0.277  -0.114  -3.472
  284   3HD1  LEU  32          HD13      LEU  32  -0.159   0.414  -5.149
  285   1HD2  LEU  32          HD21      LEU  32   3.316  -0.068  -2.743
  286   2HD2  LEU  32          HD22      LEU  32   1.698  -0.280  -2.073
  287   3HD2  LEU  32          HD23      LEU  32   2.274   1.333  -2.495
  288    H    HIS  33           HN       HIS  33   3.789  -2.749  -7.262
  289    HA   HIS  33           HA       HIS  33   2.770  -5.336  -7.197
  290   1HB   HIS  33          HB1       HIS  33   3.346  -3.795  -9.176
  291   2HB   HIS  33          HB2       HIS  33   4.990  -4.404  -9.009
  292    HD2  HIS  33           HD2      HIS  33   1.829  -6.622  -8.643
  293    HE1  HIS  33           HE1      HIS  33   3.849  -7.859 -12.172
  294    HE2  HIS  33           HE2      HIS  33   1.960  -8.399 -10.559
  295    H    GLY  34           HN       GLY  34   3.520  -6.560  -5.500
  296   1HA   GLY  34          HA1       GLY  34   4.962  -8.461  -5.106
  297   2HA   GLY  34          HA2       GLY  34   6.319  -7.476  -5.613
  298    H    ILE  35           HN       ILE  35   4.217  -5.714  -3.504
  299    HA   ILE  35           HA       ILE  35   6.216  -5.638  -1.506
  300    HB   ILE  35           HB       ILE  35   4.666  -4.420  -0.076
  301   1HG1  ILE  35          HG11      ILE  35   2.620  -5.155  -2.132
  302   2HG1  ILE  35          HG12      ILE  35   2.451  -4.978  -0.387
  303   1HG2  ILE  35          HG21      ILE  35   4.700  -2.426  -1.415
  304   2HG2  ILE  35          HG22      ILE  35   4.817  -3.376  -2.896
  305   3HG2  ILE  35          HG23      ILE  35   6.144  -3.386  -1.734
  306   1HD1  ILE  35          HD11      ILE  35   2.405  -2.580  -0.566
  307   2HD1  ILE  35          HD12      ILE  35   1.242  -3.241  -1.716
  308   3HD1  ILE  35          HD13      ILE  35   2.804  -2.654  -2.284
  309    H    PHE  36           HN       PHE  36   3.183  -7.522  -1.590
  310    HA   PHE  36           HA       PHE  36   3.213  -8.468   1.013
  311   1HB   PHE  36          HB1       PHE  36   2.123  -9.725  -1.504
  312   2HB   PHE  36          HB2       PHE  36   1.856 -10.391   0.106
  313    HD1  PHE  36           HD1      PHE  36   0.965  -8.639   1.890
  314    HD2  PHE  36           HD2      PHE  36   0.510  -8.284  -2.374
  315    HE1  PHE  36           HE1      PHE  36  -0.937  -7.072   2.231
  316    HE2  PHE  36           HE2      PHE  36  -1.393  -6.717  -2.037
  317    HZ   PHE  36           HZ       PHE  36  -2.110  -6.102   0.264
  318    H    GLY  37           HN       GLY  37   4.682  -9.483   2.054
  319   1HA   GLY  37          HA1       GLY  37   5.881 -11.460   2.610
  320   2HA   GLY  37          HA2       GLY  37   6.206 -11.716   0.906
  321    H    ARG  38           HN       ARG  38   6.784  -8.514   1.262
  322    HA   ARG  38           HA       ARG  38   9.636  -8.846   1.940
  323   1HB   ARG  38          HB1       ARG  38   8.184  -7.153  -0.078
  324   2HB   ARG  38          HB2       ARG  38   9.712  -6.579   0.575
  325   1HG   ARG  38          HG1       ARG  38  10.937  -8.138  -0.541
  326   2HG   ARG  38          HG2       ARG  38   9.666  -9.360  -0.451
  327   1HD   ARG  38          HD1       ARG  38   9.771  -8.786  -2.737
  328   2HD   ARG  38          HD2       ARG  38   8.381  -7.891  -2.121
  329    HE   ARG  38           HE       ARG  38  10.375  -6.777  -1.621
  330   1HH1  ARG  38          HH21      ARG  38   8.817  -7.579  -4.589
  331   2HH1  ARG  38          HH22      ARG  38   8.944  -6.028  -5.241
  332   1HH2  ARG  38          HH11      ARG  38  11.127  -4.578  -3.267
  333   2HH2  ARG  38          HH12      ARG  38  10.770  -4.967  -4.894
  334    H    HIS  39           HN       HIS  39  10.618  -6.811   2.816
  335    HA   HIS  39           HA       HIS  39   9.000  -5.855   5.029
  336   1HB   HIS  39          HB1       HIS  39  11.884  -5.134   4.479
  337   2HB   HIS  39          HB2       HIS  39  11.045  -5.187   6.032
  338    HD2  HIS  39           HD2      HIS  39  10.855  -7.513   7.281
  339    HE1  HIS  39           HE1      HIS  39  12.852  -9.926   4.402
  340    HE2  HIS  39           HE2      HIS  39  11.800  -9.885   6.713
  341    H    SER  40           HN       SER  40   9.089  -3.478   5.595
  342    HA   SER  40           HA       SER  40   8.221  -1.862   3.481
  343   1HB   SER  40          HB1       SER  40   9.339  -0.554   5.924
  344   2HB   SER  40          HB2       SER  40   7.914  -0.133   4.984
  345    HG   SER  40           HG       SER  40   7.109  -2.262   5.869
  346    H    GLY  41           HN       GLY  41   9.146  -0.262   2.288
  347   1HA   GLY  41          HA1       GLY  41  10.797   1.125   1.450
  348   2HA   GLY  41          HA2       GLY  41  11.864   0.597   2.729
  349    H    GLN  42           HN       GLN  42  10.395  -1.466   0.125
  350    HA   GLN  42           HA       GLN  42  13.142  -1.954  -0.787
  351   1HB   GLN  42          HB1       GLN  42  10.951  -4.007  -0.616
  352   2HB   GLN  42          HB2       GLN  42  12.560  -4.288  -1.272
  353   1HG   GLN  42          HG1       GLN  42  13.496  -3.602   0.961
  354   2HG   GLN  42          HG2       GLN  42  11.846  -3.584   1.576
  355   1HE2  GLN  42          HE21      GLN  42  13.970  -5.277   2.544
  356   2HE2  GLN  42          HE22      GLN  42  13.503  -6.908   2.227
  357    H    ALA  43           HN       ALA  43  11.176  -0.063  -2.131
  358    HA   ALA  43           HA       ALA  43  10.348  -1.173  -4.580
  359   1HB   ALA  43          HB1       ALA  43   9.464   0.899  -3.624
  360   2HB   ALA  43          HB2       ALA  43   9.986   1.107  -5.294
  361   3HB   ALA  43          HB3       ALA  43  10.992   1.705  -3.976
  362    H    GLU  44           HN       GLU  44  11.256  -1.482  -6.525
  363    HA   GLU  44           HA       GLU  44  14.081  -1.432  -6.829
  364   1HB   GLU  44          HB1       GLU  44  12.128  -2.166  -9.016
  365   2HB   GLU  44          HB2       GLU  44  13.772  -2.746  -8.776
  366   1HG   GLU  44          HG1       GLU  44  12.616  -4.559  -7.991
  367   2HG   GLU  44          HG2       GLU  44  12.806  -3.654  -6.501
  368    H    GLY  45           HN       GLY  45  14.297   0.918  -6.533
  369   1HA   GLY  45          HA1       GLY  45  15.538   2.467  -8.024
  370   2HA   GLY  45          HA2       GLY  45  14.142   2.416  -9.077
  371    H    TYR  46           HN       TYR  46  13.350   2.565  -5.734
  372    HA   TYR  46           HA       TYR  46  13.051   5.474  -5.768
  373   1HB   TYR  46          HB1       TYR  46  10.942   4.536  -6.437
  374   2HB   TYR  46          HB2       TYR  46  10.921   3.479  -5.032
  375    HD1  TYR  46           HD1      TYR  46  10.324   6.874  -6.280
  376    HD2  TYR  46           HD2      TYR  46  10.546   4.397  -2.778
  377    HE1  TYR  46           HE1      TYR  46   9.006   8.568  -5.015
  378    HE2  TYR  46           HE2      TYR  46   9.133   6.024  -1.526
  379    HH   TYR  46           HH       TYR  46   7.523   8.672  -3.129
  380    H    SER  47           HN       SER  47  13.223   6.569  -3.845
  381    HA   SER  47           HA       SER  47  14.490   5.157  -1.630
  382   1HB   SER  47          HB1       SER  47  14.489   7.967  -1.192
  383   2HB   SER  47          HB2       SER  47  15.854   6.919  -1.585
  384    HG   SER  47           HG       SER  47  15.794   7.592  -3.581
  385    H    TYR  48           HN       TYR  48  13.840   5.215   0.420
  386    HA   TYR  48           HA       TYR  48  11.183   6.176   1.183
  387   1HB   TYR  48          HB1       TYR  48  12.878   3.834   2.050
  388   2HB   TYR  48          HB2       TYR  48  11.407   4.312   2.894
  389    HD1  TYR  48           HD1      TYR  48   9.233   3.958   1.950
  390    HD2  TYR  48           HD2      TYR  48  12.767   2.925  -0.271
  391    HE1  TYR  48           HE1      TYR  48   7.860   2.537   0.442
  392    HE2  TYR  48           HE2      TYR  48  11.405   1.501  -1.785
  393    HH   TYR  48           HH       TYR  48   8.379   0.387  -0.949
  394    H    THR  49           HN       THR  49  10.931   6.860   3.539
  395    HA   THR  49           HA       THR  49  12.862   8.797   4.345
  396    HB   THR  49           HB       THR  49  11.388   8.838   6.482
  397    HG1  THR  49           HG1      THR  49   9.405   7.783   4.844
  398   1HG2  THR  49          HG21      THR  49   9.697  10.212   5.333
  399   2HG2  THR  49          HG22      THR  49  10.331   9.648   3.786
  400   3HG2  THR  49          HG23      THR  49  11.352  10.604   4.862
  401    H    ASP  50           HN       ASP  50  13.700   9.000   6.576
  402    HA   ASP  50           HA       ASP  50  15.390   6.972   7.390
  403   1HB   ASP  50          HB1       ASP  50  15.705   9.319   7.943
  404   2HB   ASP  50          HB2       ASP  50  14.256   9.309   8.946
  405    H    ALA  51           HN       ALA  51  12.067   7.565   8.372
  406    HA   ALA  51           HA       ALA  51  12.107   5.694  10.561
  407   1HB   ALA  51          HB1       ALA  51   9.810   7.273   9.407
  408   2HB   ALA  51          HB2       ALA  51  10.901   7.841  10.671
  409   3HB   ALA  51          HB3       ALA  51   9.852   6.457  10.972
  410    H    ASN  52           HN       ASN  52  10.835   5.638   7.205
  411    HA   ASN  52           HA       ASN  52   9.270   3.285   7.596
  412   1HB   ASN  52          HB1       ASN  52   8.512   4.605   5.847
  413   2HB   ASN  52          HB2       ASN  52  10.131   4.907   5.230
  414   1HD2  ASN  52          HD21      ASN  52   7.329   2.957   4.882
  415   2HD2  ASN  52          HD22      ASN  52   7.986   1.996   3.607
  416    H    ILE  53           HN       ILE  53  12.586   3.828   6.507
  417    HA   ILE  53           HA       ILE  53  13.160   1.163   5.763
  418    HB   ILE  53           HB       ILE  53  14.955   3.431   6.577
  419   1HG1  ILE  53          HG11      ILE  53  14.386   2.302   3.816
  420   2HG1  ILE  53          HG12      ILE  53  13.540   3.691   4.492
  421   1HG2  ILE  53          HG21      ILE  53  15.759   0.834   5.236
  422   2HG2  ILE  53          HG22      ILE  53  16.116   1.270   6.908
  423   3HG2  ILE  53          HG23      ILE  53  16.822   2.199   5.587
  424   1HD1  ILE  53          HD11      ILE  53  15.544   4.997   4.519
  425   2HD1  ILE  53          HD12      ILE  53  15.422   4.251   2.926
  426   3HD1  ILE  53          HD13      ILE  53  16.535   3.592   4.124
  427    H    LYS  54           HN       LYS  54  14.556   2.798   8.665
  428    HA   LYS  54           HA       LYS  54  15.194   0.772  10.278
  429   1HB   LYS  54          HB1       LYS  54  13.669   3.249  11.080
  430   2HB   LYS  54          HB2       LYS  54  14.553   2.204  12.195
  431   1HG   LYS  54          HG1       LYS  54  16.636   2.636  10.976
  432   2HG   LYS  54          HG2       LYS  54  15.764   3.672   9.843
  433   1HD   LYS  54          HD1       LYS  54  15.131   5.150  11.742
  434   2HD   LYS  54          HD2       LYS  54  16.124   4.146  12.810
  435   1HE   LYS  54          HE1       LYS  54  18.121   4.773  11.748
  436   2HE   LYS  54          HE2       LYS  54  17.278   5.342  10.304
  437   1HZ   LYS  54          HZ1       LYS  54  17.168   6.631  12.972
  438   2HZ   LYS  54          HZ2       LYS  54  16.378   7.167  11.571
  439   3HZ   LYS  54          HZ3       LYS  54  18.069   7.176  11.643
  440    H    LYS  55           HN       LYS  55  11.989   1.214   9.179
  441    HA   LYS  55           HA       LYS  55  10.652  -0.085  11.390
  442   1HB   LYS  55          HB1       LYS  55   9.554   1.750  10.364
  443   2HB   LYS  55          HB2       LYS  55   9.732   1.061   8.767
  444   1HG   LYS  55          HG1       LYS  55   7.538   0.670   9.098
  445   2HG   LYS  55          HG2       LYS  55   8.184  -0.817   9.768
  446   1HD   LYS  55          HD1       LYS  55   7.402   1.597  11.410
  447   2HD   LYS  55          HD2       LYS  55   6.348   0.218  11.106
  448   1HE   LYS  55          HE1       LYS  55   9.015   0.134  12.536
  449   2HE   LYS  55          HE2       LYS  55   7.428   0.048  13.302
  450   1HZ   LYS  55          HZ1       LYS  55   7.061  -1.980  11.836
  451   2HZ   LYS  55          HZ2       LYS  55   8.136  -2.155  13.126
  452   3HZ   LYS  55          HZ3       LYS  55   8.734  -1.954  11.558
  453    H    ASN  56           HN       ASN  56  11.606  -0.999   8.146
  454    HA   ASN  56           HA       ASN  56  11.239  -2.788   6.810
  455   1HB   ASN  56          HB1       ASN  56  13.080  -3.314   8.994
  456   2HB   ASN  56          HB2       ASN  56  12.459  -4.791   8.292
  457   1HD2  ASN  56          HD21      ASN  56  14.151  -1.735   7.369
  458   2HD2  ASN  56          HD22      ASN  56  14.657  -2.519   5.935
  459    H    VAL  57           HN       VAL  57   8.759  -2.508   7.960
  460    HA   VAL  57           HA       VAL  57   7.883  -4.874   9.291
  461    HB   VAL  57           HB       VAL  57   6.823  -2.352   8.880
  462   1HG1  VAL  57          HG11      VAL  57   4.986  -4.352   7.569
  463   2HG1  VAL  57          HG12      VAL  57   5.620  -2.867   6.859
  464   3HG1  VAL  57          HG13      VAL  57   4.476  -2.785   8.199
  465   1HG2  VAL  57          HG21      VAL  57   6.739  -3.744  10.863
  466   2HG2  VAL  57          HG22      VAL  57   5.578  -4.814  10.078
  467   3HG2  VAL  57          HG23      VAL  57   5.133  -3.148  10.442
  468    H    LEU  58           HN       LEU  58   7.319  -6.797   8.455
  469    HA   LEU  58           HA       LEU  58   7.544  -7.168   5.611
  470   1HB   LEU  58          HB1       LEU  58   8.471  -8.778   7.302
  471   2HB   LEU  58          HB2       LEU  58   6.819  -9.231   7.700
  472    HG   LEU  58           HG       LEU  58   7.641  -9.379   4.826
  473   1HD1  LEU  58          HD11      LEU  58   8.498 -11.323   6.972
  474   2HD1  LEU  58          HD12      LEU  58   9.527 -10.450   5.837
  475   3HD1  LEU  58          HD13      LEU  58   8.455 -11.723   5.254
  476   1HD2  LEU  58          HD21      LEU  58   5.974 -11.238   6.534
  477   2HD2  LEU  58          HD22      LEU  58   6.159 -11.296   4.782
  478   3HD2  LEU  58          HD23      LEU  58   5.321  -9.939   5.534
  479    H    TRP  59           HN       TRP  59   5.924  -6.354   4.474
  480    HA   TRP  59           HA       TRP  59   3.259  -6.059   5.255
  481   1HB   TRP  59          HB1       TRP  59   4.367  -6.279   2.457
  482   2HB   TRP  59          HB2       TRP  59   2.821  -5.583   2.901
  483    HD1  TRP  59           HD1      TRP  59   6.199  -4.615   2.038
  484    HE1  TRP  59           HE1      TRP  59   6.666  -2.169   2.706
  485    HE3  TRP  59           HE3      TRP  59   2.148  -3.732   5.033
  486    HZ2  TRP  59           HZ2      TRP  59   5.570  -0.157   4.418
  487    HZ3  TRP  59           HZ3      TRP  59   1.873  -1.544   6.134
  488    HH2  TRP  59           HH2      TRP  59   3.550   0.243   5.843
  489    H    ASP  60           HN       ASP  60   1.851  -7.531   5.638
  490    HA   ASP  60           HA       ASP  60   1.551  -9.983   4.073
  491   1HB   ASP  60          HB1       ASP  60   2.035 -11.162   5.908
  492   2HB   ASP  60          HB2       ASP  60   2.280  -9.678   6.809
  493    H    GLU  61           HN       GLU  61  -0.794 -10.892   5.107
  494    HA   GLU  61           HA       GLU  61  -2.745  -9.316   3.798
  495   1HB   GLU  61          HB1       GLU  61  -2.614 -11.943   4.553
  496   2HB   GLU  61          HB2       GLU  61  -3.751 -11.307   5.737
  497   1HG   GLU  61          HG1       GLU  61  -5.209 -11.899   4.068
  498   2HG   GLU  61          HG2       GLU  61  -4.869 -10.233   3.594
  499    H    ASN  62           HN       ASN  62  -2.353 -10.048   7.286
  500    HA   ASN  62           HA       ASN  62  -4.265  -8.109   8.118
  501   1HB   ASN  62          HB1       ASN  62  -3.903 -10.083   9.422
  502   2HB   ASN  62          HB2       ASN  62  -2.191  -9.740   9.588
  503   1HD2  ASN  62          HD21      ASN  62  -1.545  -8.097  11.029
  504   2HD2  ASN  62          HD22      ASN  62  -2.610  -7.508  12.253
  505    H    ASN  63           HN       ASN  63  -0.657  -8.071   8.170
  506    HA   ASN  63           HA       ASN  63  -0.285  -5.585   9.320
  507   1HB   ASN  63          HB1       ASN  63   1.514  -7.123   9.049
  508   2HB   ASN  63          HB2       ASN  63   1.361  -7.102   7.303
  509   1HD2  ASN  63          HD21      ASN  63   2.139  -4.895  10.034
  510   2HD2  ASN  63          HD22      ASN  63   3.061  -3.913   8.950
  511    H    MET  64           HN       MET  64  -0.742  -6.128   5.755
  512    HA   MET  64           HA       MET  64  -0.379  -3.480   4.973
  513   1HB   MET  64          HB1       MET  64  -0.678  -5.565   3.539
  514   2HB   MET  64          HB2       MET  64  -2.408  -5.304   3.707
  515   1HG   MET  64          HG1       MET  64  -0.787  -3.003   2.807
  516   2HG   MET  64          HG2       MET  64  -0.948  -4.340   1.684
  517   1HE   MET  64          HE1       MET  64  -3.305  -5.430   1.255
  518   2HE   MET  64          HE2       MET  64  -4.794  -4.496   1.110
  519   3HE   MET  64          HE3       MET  64  -4.265  -5.069   2.692
  520    H    SER  65           HN       SER  65  -3.304  -4.930   6.381
  521    HA   SER  65           HA       SER  65  -4.993  -2.685   6.059
  522   1HB   SER  65          HB1       SER  65  -5.286  -4.674   8.292
  523   2HB   SER  65          HB2       SER  65  -6.541  -3.788   7.437
  524    HG   SER  65           HG       SER  65  -5.233  -6.125   6.766
  525    H    GLU  66           HN       GLU  66  -2.803  -3.584   8.700
  526    HA   GLU  66           HA       GLU  66  -3.480  -1.763  10.650
  527   1HB   GLU  66          HB1       GLU  66  -0.648  -2.531   9.898
  528   2HB   GLU  66          HB2       GLU  66  -1.243  -2.078  11.492
  529   1HG   GLU  66          HG1       GLU  66  -2.611  -4.101  11.579
  530   2HG   GLU  66          HG2       GLU  66  -2.055  -4.554   9.967
  531    H    TYR  67           HN       TYR  67  -1.098  -1.268   8.063
  532    HA   TYR  67           HA       TYR  67  -0.497   1.427   8.496
  533   1HB   TYR  67          HB1       TYR  67   0.909  -0.152   7.275
  534   2HB   TYR  67          HB2       TYR  67  -0.291  -0.253   6.001
  535    HD1  TYR  67           HD1      TYR  67  -0.263   1.261   4.176
  536    HD2  TYR  67           HD2      TYR  67   2.082   2.055   7.687
  537    HE1  TYR  67           HE1      TYR  67   1.004   3.005   2.928
  538    HE2  TYR  67           HE2      TYR  67   3.396   3.761   6.444
  539    HH   TYR  67           HH       TYR  67   2.586   4.648   3.101
  540    H    LEU  68           HN       LEU  68  -2.950  -0.005   6.261
  541    HA   LEU  68           HA       LEU  68  -3.644   2.350   4.956
  542   1HB   LEU  68          HB1       LEU  68  -5.317  -0.043   5.670
  543   2HB   LEU  68          HB2       LEU  68  -5.902   1.265   4.657
  544    HG   LEU  68           HG       LEU  68  -3.679  -0.686   4.048
  545   1HD1  LEU  68          HD11      LEU  68  -6.144  -1.204   3.717
  546   2HD1  LEU  68          HD12      LEU  68  -5.135  -1.340   2.277
  547   3HD1  LEU  68          HD13      LEU  68  -6.160   0.077   2.504
  548   1HD2  LEU  68          HD21      LEU  68  -2.968   1.590   3.294
  549   2HD2  LEU  68          HD22      LEU  68  -4.479   1.730   2.395
  550   3HD2  LEU  68          HD23      LEU  68  -3.299   0.498   1.949
  551    H    THR  69           HN       THR  69  -4.825   1.273   8.153
  552    HA   THR  69           HA       THR  69  -6.879   3.184   8.414
  553    HB   THR  69           HB       THR  69  -5.726   2.573  10.974
  554    HG1  THR  69           HG1      THR  69  -4.839   0.764  10.086
  555   1HG2  THR  69          HG21      THR  69  -7.866   1.541  11.396
  556   2HG2  THR  69          HG22      THR  69  -8.225   1.477   9.670
  557   3HG2  THR  69          HG23      THR  69  -8.145   3.033  10.496
  558    H    ASN  70           HN       ASN  70  -3.427   3.404   9.231
  559    HA   ASN  70           HA       ASN  70  -3.486   6.241   9.049
  560   1HB   ASN  70          HB1       ASN  70  -4.402   5.816  11.376
  561   2HB   ASN  70          HB2       ASN  70  -2.810   5.196  11.803
  562   1HD2  ASN  70          HD21      ASN  70  -4.202   7.520  12.894
  563   2HD2  ASN  70          HD22      ASN  70  -2.985   8.729  12.687
  564    HA   PRO  71           HA       PRO  71   0.545   4.445   7.744
  565   1HB   PRO  71          HB1       PRO  71   1.110   6.588   6.109
  566   2HB   PRO  71          HB2       PRO  71   0.220   5.150   5.602
  567   1HG   PRO  71          HG1       PRO  71  -0.821   7.821   6.457
  568   2HG   PRO  71          HG2       PRO  71  -1.369   6.776   5.133
  569   1HD   PRO  71          HD1       PRO  71  -2.703   6.912   7.456
  570   2HD   PRO  71          HD2       PRO  71  -2.560   5.386   6.557
  571    H    LYS  72           HN       LYS  72  -0.052   7.862   8.535
  572    HA   LYS  72           HA       LYS  72   2.576   8.567   9.238
  573   1HB   LYS  72          HB1       LYS  72  -0.065   9.797  10.026
  574   2HB   LYS  72          HB2       LYS  72   1.493  10.510  10.411
  575   1HG   LYS  72          HG1       LYS  72   1.438   9.971   7.618
  576   2HG   LYS  72          HG2       LYS  72  -0.059  10.794   8.052
  577   1HD   LYS  72          HD1       LYS  72   1.224  12.618   9.058
  578   2HD   LYS  72          HD2       LYS  72   2.730  11.780   8.684
  579   1HE   LYS  72          HE1       LYS  72   0.714  12.768   6.663
  580   2HE   LYS  72          HE2       LYS  72   2.223  13.572   7.068
  581   1HZ   LYS  72          HZ1       LYS  72   2.428  12.322   5.031
  582   2HZ   LYS  72          HZ2       LYS  72   1.956  10.899   5.809
  583   3HZ   LYS  72          HZ3       LYS  72   3.416  11.634   6.228
  584    H    LYS  73           HN       LYS  73  -0.042   7.204  11.175
  585    HA   LYS  73           HA       LYS  73   1.372   7.505  13.649
  586   1HB   LYS  73          HB1       LYS  73  -1.076   7.432  13.593
  587   2HB   LYS  73          HB2       LYS  73  -1.020   5.772  13.019
  588   1HG   LYS  73          HG1       LYS  73  -1.526   5.835  15.395
  589   2HG   LYS  73          HG2       LYS  73   0.033   5.068  15.119
  590   1HD   LYS  73          HD1       LYS  73   0.811   7.640  15.534
  591   2HD   LYS  73          HD2       LYS  73  -0.630   7.573  16.546
  592   1HE   LYS  73          HE1       LYS  73   1.075   6.948  18.007
  593   2HE   LYS  73          HE2       LYS  73   0.401   5.403  17.499
  594   1HZ   LYS  73          HZ1       LYS  73   2.653   5.073  17.308
  595   2HZ   LYS  73          HZ2       LYS  73   2.962   6.638  16.753
  596   3HZ   LYS  73          HZ3       LYS  73   2.242   5.510  15.723
  597    H    TYR  74           HN       TYR  74   1.041   4.844  11.338
  598    HA   TYR  74           HA       TYR  74   2.428   2.907  12.882
  599   1HB   TYR  74          HB1       TYR  74   0.839   2.670  10.824
  600   2HB   TYR  74          HB2       TYR  74   2.330   2.829   9.894
  601    HD1  TYR  74           HD1      TYR  74   3.938   0.995   9.782
  602    HD2  TYR  74           HD2      TYR  74   0.569   0.875  12.450
  603    HE1  TYR  74           HE1      TYR  74   4.346  -1.436  10.186
  604    HE2  TYR  74           HE2      TYR  74   0.956  -1.540  12.857
  605    HH   TYR  74           HH       TYR  74   1.993  -3.443  11.687
  606    H    ILE  75           HN       ILE  75   3.495   5.150  10.395
  607    HA   ILE  75           HA       ILE  75   6.305   4.650  11.084
  608    HB   ILE  75           HB       ILE  75   5.228   5.183   8.302
  609   1HG1  ILE  75          HG11      ILE  75   6.642   2.714   9.376
  610   2HG1  ILE  75          HG12      ILE  75   4.905   2.821   9.134
  611   1HG2  ILE  75          HG21      ILE  75   8.073   4.694   9.233
  612   2HG2  ILE  75          HG22      ILE  75   7.405   6.272   8.818
  613   3HG2  ILE  75          HG23      ILE  75   7.551   5.025   7.580
  614   1HD1  ILE  75          HD11      ILE  75   6.969   3.063   6.939
  615   2HD1  ILE  75          HD12      ILE  75   5.218   3.034   6.734
  616   3HD1  ILE  75          HD13      ILE  75   6.060   1.601   7.324
  617    HA   PRO  76           HA       PRO  76   5.382   8.985  12.157
  618   1HB   PRO  76          HB1       PRO  76   7.560   9.251  13.782
  619   2HB   PRO  76          HB2       PRO  76   6.022   8.558  14.306
  620   1HG   PRO  76          HG1       PRO  76   8.533   7.174  13.452
  621   2HG   PRO  76          HG2       PRO  76   7.440   6.785  14.793
  622   1HD   PRO  76          HD1       PRO  76   7.393   5.434  12.455
  623   2HD   PRO  76          HD2       PRO  76   5.927   5.717  13.416
  624    H    GLY  77           HN       GLY  77   5.816  10.127  10.308
  625   1HA   GLY  77          HA1       GLY  77   7.272  11.891   9.516
  626   2HA   GLY  77          HA2       GLY  77   8.632  10.815   9.769
  627    H    THR  78           HN       THR  78   6.074   9.101   8.370
  628    HA   THR  78           HA       THR  78   7.406   8.661   5.905
  629    HB   THR  78           HB       THR  78   5.569   7.310   7.374
  630    HG1  THR  78           HG1      THR  78   6.997   6.887   5.226
  631   1HG2  THR  78          HG21      THR  78   3.705   8.682   6.285
  632   2HG2  THR  78          HG22      THR  78   3.562   6.924   6.236
  633   3HG2  THR  78          HG23      THR  78   4.097   7.806   4.804
  634    H    LYS  79           HN       LYS  79   6.978   9.282   3.848
  635    HA   LYS  79           HA       LYS  79   5.844  11.830   3.375
  636   1HB   LYS  79          HB1       LYS  79   6.281   9.802   1.210
  637   2HB   LYS  79          HB2       LYS  79   6.499  11.543   1.149
  638   1HG   LYS  79          HG1       LYS  79   8.484  11.291   2.640
  639   2HG   LYS  79          HG2       LYS  79   8.294   9.535   2.511
  640   1HD   LYS  79          HD1       LYS  79   8.192  10.223  -0.112
  641   2HD   LYS  79          HD2       LYS  79   9.268  11.485   0.501
  642   1HE   LYS  79          HE1       LYS  79  10.843   9.877   0.110
  643   2HE   LYS  79          HE2       LYS  79  10.366   9.380   1.733
  644   1HZ   LYS  79          HZ1       LYS  79   8.811   8.272  -0.458
  645   2HZ   LYS  79          HZ2       LYS  79   9.348   7.541   0.968
  646   3HZ   LYS  79          HZ3       LYS  79  10.412   7.730  -0.330
  647    H    MET  80           HN       MET  80   4.300   8.654   3.308
  648    HA   MET  80           HA       MET  80   2.217   9.375   1.523
  649   1HB   MET  80          HB1       MET  80   2.486   7.109   1.518
  650   2HB   MET  80          HB2       MET  80   2.785   7.026   3.258
  651   1HG   MET  80          HG1       MET  80   0.541   7.158   3.795
  652   2HG   MET  80          HG2       MET  80   0.106   7.875   2.254
  653   1HE   MET  80          HE1       MET  80  -1.973   4.543   2.561
  654   2HE   MET  80          HE2       MET  80  -2.081   6.270   2.220
  655   3HE   MET  80          HE3       MET  80  -1.526   5.717   3.799
  656    H    ALA  81           HN       ALA  81   0.994  11.007   1.924
  657    HA   ALA  81           HA       ALA  81  -0.193  11.436   4.555
  658   1HB   ALA  81          HB1       ALA  81   0.212  13.447   2.361
  659   2HB   ALA  81          HB2       ALA  81   1.318  13.169   3.705
  660   3HB   ALA  81          HB3       ALA  81  -0.312  13.764   4.016
  661    H    PHE  82           HN       PHE  82  -1.254   9.745   2.406
  662    HA   PHE  82           HA       PHE  82  -3.497  10.537   1.095
  663   1HB   PHE  82          HB1       PHE  82  -2.619   8.513   0.455
  664   2HB   PHE  82          HB2       PHE  82  -2.484   7.920   2.105
  665    HD1  PHE  82           HD1      PHE  82  -4.854   8.551  -0.689
  666    HD2  PHE  82           HD2      PHE  82  -4.243   6.691   3.142
  667    HE1  PHE  82           HE1      PHE  82  -7.053   7.403  -0.894
  668    HE2  PHE  82           HE2      PHE  82  -6.444   5.555   2.944
  669    HZ   PHE  82           HZ       PHE  82  -7.858   5.927   0.936
  670    H    GLY  83           HN       GLY  83  -3.350   9.985   4.564
  671   1HA   GLY  83          HA1       GLY  83  -5.138  11.004   5.877
  672   2HA   GLY  83          HA2       GLY  83  -6.267  10.463   4.655
  673    H    GLY  84           HN       GLY  84  -5.556   7.761   4.447
  674   1HA   GLY  84          HA1       GLY  84  -5.325   5.727   5.620
  675   2HA   GLY  84          HA2       GLY  84  -5.668   6.571   7.119
  676    H    LEU  85           HN       LEU  85  -6.893   4.484   4.846
  677    HA   LEU  85           HA       LEU  85  -9.702   5.105   5.054
  678   1HB   LEU  85          HB1       LEU  85  -8.122   2.937   3.701
  679   2HB   LEU  85          HB2       LEU  85  -9.862   2.817   3.854
  680    HG   LEU  85           HG       LEU  85  -8.313   4.917   2.323
  681   1HD1  LEU  85          HD11      LEU  85  -9.505   3.965   0.412
  682   2HD1  LEU  85          HD12      LEU  85 -10.327   2.823   1.476
  683   3HD1  LEU  85          HD13      LEU  85  -8.582   2.714   1.247
  684   1HD2  LEU  85          HD21      LEU  85 -10.282   5.989   3.359
  685   2HD2  LEU  85          HD22      LEU  85 -11.312   4.716   2.705
  686   3HD2  LEU  85          HD23      LEU  85 -10.479   5.822   1.614
  687    H    LYS  86           HN       LYS  86  -9.935   5.053   7.241
  688    HA   LYS  86           HA       LYS  86  -9.506   2.876   8.988
  689   1HB   LYS  86          HB1       LYS  86 -11.273   5.305   9.332
  690   2HB   LYS  86          HB2       LYS  86 -10.711   4.244  10.617
  691   1HG   LYS  86          HG1       LYS  86  -8.626   5.156  10.655
  692   2HG   LYS  86          HG2       LYS  86  -8.609   5.464   8.917
  693   1HD   LYS  86          HD1       LYS  86 -10.200   7.350   9.285
  694   2HD   LYS  86          HD2       LYS  86 -10.074   7.076  11.022
  695   1HE   LYS  86          HE1       LYS  86  -8.623   8.932  10.082
  696   2HE   LYS  86          HE2       LYS  86  -7.791   7.724  11.057
  697   1HZ   LYS  86          HZ1       LYS  86  -6.798   6.794   9.202
  698   2HZ   LYS  86          HZ2       LYS  86  -6.749   8.448   8.852
  699   3HZ   LYS  86          HZ3       LYS  86  -7.918   7.470   8.123
  700    H    LYS  87           HN       LYS  87 -11.440   2.574   6.557
  701    HA   LYS  87           HA       LYS  87 -13.840   1.556   7.919
  702   1HB   LYS  87          HB1       LYS  87 -13.564   1.572   4.970
  703   2HB   LYS  87          HB2       LYS  87 -14.982   1.815   5.953
  704   1HG   LYS  87          HG1       LYS  87 -14.625   4.133   6.104
  705   2HG   LYS  87          HG2       LYS  87 -12.888   3.982   5.695
  706   1HD   LYS  87          HD1       LYS  87 -13.678   2.773   3.612
  707   2HD   LYS  87          HD2       LYS  87 -15.267   3.361   3.964
  708   1HE   LYS  87          HE1       LYS  87 -14.749   5.492   3.175
  709   2HE   LYS  87          HE2       LYS  87 -12.999   5.208   3.300
  710   1HZ   LYS  87          HZ1       LYS  87 -14.813   3.617   1.561
  711   2HZ   LYS  87          HZ2       LYS  87 -13.130   3.516   1.617
  712   3HZ   LYS  87          HZ3       LYS  87 -13.871   4.911   0.999
  713    H    GLU  88           HN       GLU  88 -13.406  -0.519   8.544
  714    HA   GLU  88           HA       GLU  88 -11.785  -2.427   7.407
  715   1HB   GLU  88          HB1       GLU  88 -12.846  -2.476   9.657
  716   2HB   GLU  88          HB2       GLU  88 -14.353  -2.964   8.887
  717   1HG   GLU  88          HG1       GLU  88 -12.990  -4.914   7.887
  718   2HG   GLU  88          HG2       GLU  88 -11.781  -4.508   9.114
  719    H    LYS  89           HN       LYS  89 -15.335  -2.239   6.839
  720    HA   LYS  89           HA       LYS  89 -15.590  -4.402   5.146
  721   1HB   LYS  89          HB1       LYS  89 -17.198  -1.905   4.715
  722   2HB   LYS  89          HB2       LYS  89 -17.712  -3.588   4.635
  723   1HG   LYS  89          HG1       LYS  89 -16.692  -2.566   7.236
  724   2HG   LYS  89          HG2       LYS  89 -18.290  -2.048   6.718
  725   1HD   LYS  89          HD1       LYS  89 -18.639  -3.957   8.084
  726   2HD   LYS  89          HD2       LYS  89 -18.821  -4.536   6.419
  727   1HE   LYS  89          HE1       LYS  89 -16.971  -5.831   6.536
  728   2HE   LYS  89          HE2       LYS  89 -16.055  -4.602   7.409
  729   1HZ   LYS  89          HZ1       LYS  89 -17.840  -5.435   9.251
  730   2HZ   LYS  89          HZ2       LYS  89 -16.249  -5.991   9.124
  731   3HZ   LYS  89          HZ3       LYS  89 -17.507  -6.871   8.414
  732    H    ASP  90           HN       ASP  90 -14.834  -1.115   4.335
  733    HA   ASP  90           HA       ASP  90 -14.554  -1.235   1.588
  734   1HB   ASP  90          HB1       ASP  90 -14.754   0.719   3.241
  735   2HB   ASP  90          HB2       ASP  90 -13.022   0.560   3.457
  736    H    ARG  91           HN       ARG  91 -11.958  -1.547   4.115
  737    HA   ARG  91           HA       ARG  91  -9.885  -2.048   2.255
  738   1HB   ARG  91          HB1       ARG  91  -9.858  -3.047   5.109
  739   2HB   ARG  91          HB2       ARG  91  -8.473  -2.763   4.061
  740   1HG   ARG  91          HG1       ARG  91  -8.820  -0.396   4.124
  741   2HG   ARG  91          HG2       ARG  91 -10.353  -0.588   4.958
  742   1HD   ARG  91          HD1       ARG  91  -7.576  -1.037   6.043
  743   2HD   ARG  91          HD2       ARG  91  -8.745   0.173   6.545
  744    HE   ARG  91           HE       ARG  91  -9.713  -1.890   6.479
  745   1HH1  ARG  91          HH21      ARG  91  -7.046  -0.743   8.389
  746   2HH1  ARG  91          HH22      ARG  91  -7.308  -1.517   9.913
  747   1HH2  ARG  91          HH11      ARG  91 -10.165  -3.158   8.947
  748   2HH2  ARG  91          HH12      ARG  91  -9.062  -2.843  10.238
  749    H    ASN  92           HN       ASN  92 -12.111  -4.287   3.857
  750    HA   ASN  92           HA       ASN  92 -10.994  -6.716   3.387
  751   1HB   ASN  92          HB1       ASN  92 -13.880  -5.870   3.156
  752   2HB   ASN  92          HB2       ASN  92 -13.376  -7.550   3.076
  753   1HD2  ASN  92          HD21      ASN  92 -15.138  -6.422   4.982
  754   2HD2  ASN  92          HD22      ASN  92 -14.354  -6.825   6.471
  755    H    ASP  93           HN       ASP  93 -13.073  -5.081   0.947
  756    HA   ASP  93           HA       ASP  93 -12.491  -6.859  -1.162
  757   1HB   ASP  93          HB1       ASP  93 -14.344  -4.966  -0.855
  758   2HB   ASP  93          HB2       ASP  93 -13.190  -4.035  -1.796
  759    H    LEU  94           HN       LEU  94 -10.881  -3.764  -0.247
  760    HA   LEU  94           HA       LEU  94  -9.218  -3.443  -2.410
  761   1HB   LEU  94          HB1       LEU  94  -9.435  -2.446   0.335
  762   2HB   LEU  94          HB2       LEU  94  -7.826  -2.454  -0.284
  763    HG   LEU  94           HG       LEU  94 -10.058  -1.213  -1.859
  764   1HD1  LEU  94          HD11      LEU  94  -9.926  -0.280   0.472
  765   2HD1  LEU  94          HD12      LEU  94  -9.645   0.895  -0.816
  766   3HD1  LEU  94          HD13      LEU  94  -8.283   0.246   0.096
  767   1HD2  LEU  94          HD21      LEU  94  -8.446   0.007  -3.023
  768   2HD2  LEU  94          HD22      LEU  94  -7.688  -1.575  -2.854
  769   3HD2  LEU  94          HD23      LEU  94  -7.213  -0.252  -1.789
  770    H    ILE  95           HN       ILE  95  -8.690  -5.440   0.480
  771    HA   ILE  95           HA       ILE  95  -6.034  -6.213  -0.011
  772    HB   ILE  95           HB       ILE  95  -8.191  -7.744   1.461
  773   1HG1  ILE  95          HG11      ILE  95  -6.145  -5.805   2.588
  774   2HG1  ILE  95          HG12      ILE  95  -7.810  -5.360   2.226
  775   1HG2  ILE  95          HG21      ILE  95  -6.369  -8.793   2.703
  776   2HG2  ILE  95          HG22      ILE  95  -5.181  -7.893   1.762
  777   3HG2  ILE  95          HG23      ILE  95  -6.184  -9.112   0.977
  778   1HD1  ILE  95          HD11      ILE  95  -8.519  -7.203   3.813
  779   2HD1  ILE  95          HD12      ILE  95  -7.727  -5.811   4.551
  780   3HD1  ILE  95          HD13      ILE  95  -6.827  -7.306   4.305
  781    H    THR  96           HN       THR  96  -9.110  -7.808  -0.922
  782    HA   THR  96           HA       THR  96  -8.134 -10.025  -2.254
  783    HB   THR  96           HB       THR  96 -10.496  -8.589  -3.408
  784    HG1  THR  96           HG1      THR  96 -11.083  -8.425  -1.324
  785   1HG2  THR  96          HG21      THR  96  -9.979 -10.744  -4.364
  786   2HG2  THR  96          HG22      THR  96 -11.411 -10.922  -3.348
  787   3HG2  THR  96          HG23      THR  96  -9.840 -11.469  -2.761
  788    H    TYR  97           HN       TYR  97  -8.569  -6.735  -3.616
  789    HA   TYR  97           HA       TYR  97  -7.720  -7.433  -6.227
  790   1HB   TYR  97          HB1       TYR  97  -8.996  -5.444  -5.962
  791   2HB   TYR  97          HB2       TYR  97  -7.842  -4.776  -4.816
  792    HD1  TYR  97           HD1      TYR  97  -6.467  -3.099  -5.577
  793    HD2  TYR  97           HD2      TYR  97  -7.822  -6.098  -8.344
  794    HE1  TYR  97           HE1      TYR  97  -5.253  -1.945  -7.415
  795    HE2  TYR  97           HE2      TYR  97  -6.714  -4.887 -10.214
  796    HH   TYR  97           HH       TYR  97  -4.397  -2.922 -10.023
  797    H    LEU  98           HN       LEU  98  -5.883  -5.769  -3.620
  798    HA   LEU  98           HA       LEU  98  -3.427  -5.620  -4.950
  799   1HB   LEU  98          HB1       LEU  98  -4.473  -5.000  -2.394
  800   2HB   LEU  98          HB2       LEU  98  -3.049  -5.998  -2.126
  801    HG   LEU  98           HG       LEU  98  -2.363  -3.659  -2.182
  802   1HD1  LEU  98          HD11      LEU  98  -0.771  -5.210  -3.157
  803   2HD1  LEU  98          HD12      LEU  98  -0.776  -3.720  -4.100
  804   3HD1  LEU  98          HD13      LEU  98  -1.613  -5.149  -4.706
  805   1HD2  LEU  98          HD21      LEU  98  -3.611  -3.597  -4.937
  806   2HD2  LEU  98          HD22      LEU  98  -2.684  -2.294  -4.194
  807   3HD2  LEU  98          HD23      LEU  98  -4.234  -2.776  -3.505
  808    H    LYS  99           HN       LYS  99  -4.657  -8.045  -2.719
  809    HA   LYS  99           HA       LYS  99  -2.479  -9.783  -2.656
  810   1HB   LYS  99          HB1       LYS  99  -3.829 -10.508  -1.025
  811   2HB   LYS  99          HB2       LYS  99  -5.249  -9.797  -1.771
  812   1HG   LYS  99          HG1       LYS  99  -5.503 -11.769  -3.196
  813   2HG   LYS  99          HG2       LYS  99  -4.059 -12.477  -2.498
  814   1HD   LYS  99          HD1       LYS  99  -6.098 -11.804  -0.502
  815   2HD   LYS  99          HD2       LYS  99  -6.651 -12.971  -1.708
  816   1HE   LYS  99          HE1       LYS  99  -5.462 -13.816   0.440
  817   2HE   LYS  99          HE2       LYS  99  -5.074 -14.542  -1.112
  818   1HZ   LYS  99          HZ1       LYS  99  -2.984 -13.862  -0.960
  819   2HZ   LYS  99          HZ2       LYS  99  -3.301 -13.563   0.679
  820   3HZ   LYS  99          HZ3       LYS  99  -3.426 -12.303  -0.444
  821    H    LYS 100           HN       LYS 100  -5.140  -9.566  -5.001
  822    HA   LYS 100           HA       LYS 100  -4.493 -11.949  -6.397
  823   1HB   LYS 100          HB1       LYS 100  -6.688 -10.421  -6.265
  824   2HB   LYS 100          HB2       LYS 100  -6.078  -9.939  -7.830
  825   1HG   LYS 100          HG1       LYS 100  -7.830 -11.870  -7.640
  826   2HG   LYS 100          HG2       LYS 100  -6.493 -12.020  -8.783
  827   1HD   LYS 100          HD1       LYS 100  -6.001 -12.990  -6.057
  828   2HD   LYS 100          HD2       LYS 100  -7.207 -13.876  -6.938
  829   1HE   LYS 100          HE1       LYS 100  -5.474 -15.207  -7.411
  830   2HE   LYS 100          HE2       LYS 100  -5.093 -14.000  -8.650
  831   1HZ   LYS 100          HZ1       LYS 100  -4.073 -13.813  -5.855
  832   2HZ   LYS 100          HZ2       LYS 100  -3.585 -12.911  -7.200
  833   3HZ   LYS 100          HZ3       LYS 100  -3.205 -14.558  -7.109
  834    H    ALA 101           HN       ALA 101  -3.445  -8.779  -6.775
  835    HA   ALA 101           HA       ALA 101  -2.194  -8.937  -9.333
  836   1HB   ALA 101          HB1       ALA 101  -1.484  -6.628  -8.768
  837   2HB   ALA 101          HB2       ALA 101  -2.192  -6.835  -7.166
  838   3HB   ALA 101          HB3       ALA 101  -3.221  -6.886  -8.598
  839    H    THR 102           HN       THR 102  -1.068  -9.112  -5.977
  840    HA   THR 102           HA       THR 102   1.737  -9.247  -6.580
  841    HB   THR 102           HB       THR 102   0.466 -10.027  -3.962
  842    HG1  THR 102           HG1      THR 102  -0.233  -7.905  -4.680
  843   1HG2  THR 102          HG21      THR 102   2.546  -9.223  -2.999
  844   2HG2  THR 102          HG22      THR 102   3.124  -8.729  -4.591
  845   3HG2  THR 102          HG23      THR 102   2.898 -10.440  -4.228
  846    H    GLU 103           HN       GLU 103  -0.803 -11.621  -5.809
  847    HA   GLU 103           HA       GLU 103   1.062 -13.758  -6.623
  848   1HB   GLU 103          HB1       GLU 103  -0.563 -15.167  -5.021
  849   2HB   GLU 103          HB2       GLU 103   0.911 -14.406  -4.445
  850   1HG   GLU 103          HG1       GLU 103  -0.299 -13.368  -2.920
  851   2HG   GLU 103          HG2       GLU 103  -1.054 -12.445  -4.214
  852    HHA  HEC 104           HA       HEC 104   5.222   3.515   1.450
  853    HHB  HEC 104           HB       HEC 104  -0.450   0.602   0.211
  854    HHC  HEC 104           HC       HEC 104  -3.005   6.347  -1.362
  855    HHD  HEC 104           HD       HEC 104   2.924   8.910  -1.312
  856   1HMA  HEC 104          HMA1      HEC 104   1.348  -0.799   2.026
  857   2HMA  HEC 104          HMA2      HEC 104   2.867  -1.163   1.205
  858   3HMA  HEC 104          HMA3      HEC 104   1.378  -0.999   0.274
  859   1HAA  HEC 104          HAA1      HEC 104   4.400  -0.152   2.120
  860   2HAA  HEC 104          HAA2      HEC 104   5.075   1.421   2.501
  861   1HBA  HEC 104          HBA1      HEC 104   5.940   1.579   0.178
  862   2HBA  HEC 104          HBA2      HEC 104   5.323  -0.035  -0.137
  863   1HMB  HEC 104          HMB1      HEC 104  -2.328   0.283  -0.416
  864   2HMB  HEC 104          HMB2      HEC 104  -3.250   0.880  -1.795
  865   3HMB  HEC 104          HMB3      HEC 104  -3.915   1.013  -0.167
  866    HAB  HEC 104           HAB      HEC 104  -4.405   5.014  -1.412
  867   1HBB  HEC 104          HBB1      HEC 104  -4.733   3.788   0.874
  868   2HBB  HEC 104          HBB2      HEC 104  -5.726   2.715  -0.113
  869   3HBB  HEC 104          HBB3      HEC 104  -6.086   4.441  -0.051
  870   1HMC  HEC 104          HMC1      HEC 104  -3.068   8.914  -1.520
  871   2HMC  HEC 104          HMC2      HEC 104  -2.727   8.192  -3.092
  872   3HMC  HEC 104          HMC3      HEC 104  -2.124   9.805  -2.713
  873    HAC  HEC 104           HAC      HEC 104   1.724   9.958  -2.587
  874   1HBC  HEC 104          HBC1      HEC 104   0.925  11.343  -0.914
  875   2HBC  HEC 104          HBC2      HEC 104  -0.735  11.268  -1.506
  876   3HBC  HEC 104          HBC3      HEC 104   0.493  12.134  -2.430
  877   1HMD  HEC 104          HMD1      HEC 104   5.056   9.316  -0.399
  878   2HMD  HEC 104          HMD2      HEC 104   5.512   8.333  -1.792
  879   3HMD  HEC 104          HMD3      HEC 104   6.532   8.351  -0.353
  880   1HAD  HEC 104          HAD1      HEC 104   7.343   6.480   0.424
  881   2HAD  HEC 104          HAD2      HEC 104   6.895   4.934   1.137
  882   1HBD  HEC 104          HBD1      HEC 104   6.374   5.878   3.188
  883   2HBD  HEC 104          HBD2      HEC 104   6.048   7.454   2.500
  884    H2   4NL 105           H2       4NL 105   0.099 -13.020  -1.256
  885    H6   4NL 105           H6       4NL 105   2.013 -13.459   3.786
  886    H3   4NL 105           H3       4NL 105  -1.429 -10.491   1.927
  887    H5   4NL 105           H5       4NL 105  -2.293 -10.532  -0.145
  888    H4   4NL 105           H4       4NL 105   0.354 -11.353   3.467
  889    H1   4NL 105           H1       4NL 105   1.882 -13.881   0.283
  890    H7   4NL 105           H7       4NL 105   3.231 -13.161   2.522
  Start of MODEL   19
    1   1H    THR  -5          HT1       THR  -5 -12.620  -5.686  13.501
    2   2H    THR  -5          HT2       THR  -5 -11.704  -4.927  12.295
    3   3H    THR  -5          HT3       THR  -5 -11.002  -5.273  13.795
    4    HA   THR  -5           HA       THR  -5 -10.594  -6.798  11.723
    5    HB   THR  -5           HB       THR  -5 -11.211  -8.209  14.316
    6    HG1  THR  -5           HG1      THR  -5  -8.787  -7.302  14.510
    7   1HG2  THR  -5          HG21      THR  -5 -10.205  -9.526  12.545
    8   2HG2  THR  -5          HG22      THR  -5  -9.004  -9.246  13.805
    9   3HG2  THR  -5          HG23      THR  -5  -8.949  -8.309  12.311
   10    H    GLU  -4           HN       GLU  -4 -12.320  -7.060  10.271
   11    HA   GLU  -4           HA       GLU  -4 -14.042  -9.303  10.696
   12   1HB   GLU  -4          HB1       GLU  -4 -15.324  -7.372  11.779
   13   2HB   GLU  -4          HB2       GLU  -4 -15.400  -6.632  10.185
   14   1HG   GLU  -4          HG1       GLU  -4 -16.407  -9.424  10.641
   15   2HG   GLU  -4          HG2       GLU  -4 -17.412  -8.027  11.006
   16    H    PHE  -3           HN       PHE  -3 -12.571  -9.862   8.990
   17    HA   PHE  -3           HA       PHE  -3 -12.716  -8.436   6.486
   18   1HB   PHE  -3          HB1       PHE  -3 -10.529  -9.192   7.122
   19   2HB   PHE  -3          HB2       PHE  -3 -11.089 -10.854   7.264
   20    HD1  PHE  -3           HD1      PHE  -3 -10.402  -8.108   4.836
   21    HD2  PHE  -3           HD2      PHE  -3 -11.144 -12.309   5.379
   22    HE1  PHE  -3           HE1      PHE  -3  -9.891  -8.507   2.434
   23    HE2  PHE  -3           HE2      PHE  -3 -10.682 -12.703   2.967
   24    HZ   PHE  -3           HZ       PHE  -3 -10.084 -10.795   1.485
   25    H    LYS  -2           HN       LYS  -2 -13.395  -9.202   4.564
   26    HA   LYS  -2           HA       LYS  -2 -14.869 -11.673   4.271
   27   1HB   LYS  -2          HB1       LYS  -2 -16.341  -9.594   5.124
   28   2HB   LYS  -2          HB2       LYS  -2 -16.333  -9.219   3.401
   29   1HG   LYS  -2          HG1       LYS  -2 -17.823 -10.821   2.963
   30   2HG   LYS  -2          HG2       LYS  -2 -16.866 -12.026   3.820
   31   1HD   LYS  -2          HD1       LYS  -2 -18.433 -10.095   5.460
   32   2HD   LYS  -2          HD2       LYS  -2 -19.333 -11.335   4.589
   33   1HE   LYS  -2          HE1       LYS  -2 -18.939 -12.304   6.681
   34   2HE   LYS  -2          HE2       LYS  -2 -17.690 -13.005   5.657
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.256 -10.666   7.443
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.079 -11.525   6.588
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.898 -12.272   7.861
   38    H    ALA  -1           HN       ALA  -1 -14.518 -12.447   2.317
   39    HA   ALA  -1           HA       ALA  -1 -12.633 -11.465   0.554
   40   1HB   ALA  -1          HB1       ALA  -1 -13.511 -13.234  -0.981
   41   2HB   ALA  -1          HB2       ALA  -1 -14.827 -13.497   0.165
   42   3HB   ALA  -1          HB3       ALA  -1 -13.160 -13.795   0.656
   43    H    GLY   1           HN       GLY   1 -12.677 -10.402  -1.380
   44   1HA   GLY   1          HA1       GLY   1 -15.128  -8.944  -2.126
   45   2HA   GLY   1          HA2       GLY   1 -13.491  -8.348  -2.361
   46    H    SER   2           HN       SER   2 -13.536  -8.058  -4.502
   47    HA   SER   2           HA       SER   2 -13.287 -10.351  -6.242
   48   1HB   SER   2          HB1       SER   2 -15.239  -8.299  -7.200
   49   2HB   SER   2          HB2       SER   2 -15.098 -10.007  -7.635
   50    HG   SER   2           HG       SER   2 -15.670 -10.251  -5.228
   51    H    ALA   3           HN       ALA   3 -11.832  -9.932  -7.835
   52    HA   ALA   3           HA       ALA   3 -10.147  -7.798  -7.834
   53   1HB   ALA   3          HB1       ALA   3  -9.514  -8.522 -10.143
   54   2HB   ALA   3          HB2       ALA   3 -10.882  -9.635 -10.099
   55   3HB   ALA   3          HB3       ALA   3  -9.565  -9.814  -8.942
   56    H    LYS   4           HN       LYS   4 -13.152  -7.938  -9.816
   57    HA   LYS   4           HA       LYS   4 -12.593  -5.410 -11.028
   58   1HB   LYS   4          HB1       LYS   4 -13.863  -7.422 -12.033
   59   2HB   LYS   4          HB2       LYS   4 -15.268  -6.693 -11.256
   60   1HG   LYS   4          HG1       LYS   4 -14.224  -4.505 -12.432
   61   2HG   LYS   4          HG2       LYS   4 -13.669  -5.736 -13.560
   62   1HD   LYS   4          HD1       LYS   4 -15.776  -4.859 -14.341
   63   2HD   LYS   4          HD2       LYS   4 -16.037  -6.513 -13.775
   64   1HE   LYS   4          HE1       LYS   4 -17.818  -4.975 -13.001
   65   2HE   LYS   4          HE2       LYS   4 -16.921  -5.682 -11.657
   66   1HZ   LYS   4          HZ1       LYS   4 -16.275  -3.026 -12.788
   67   2HZ   LYS   4          HZ2       LYS   4 -15.756  -3.687 -11.322
   68   3HZ   LYS   4          HZ3       LYS   4 -17.374  -3.237 -11.514
   69    H    LYS   5           HN       LYS   5 -13.489  -5.858  -7.975
   70    HA   LYS   5           HA       LYS   5 -15.215  -3.468  -7.891
   71   1HB   LYS   5          HB1       LYS   5 -14.837  -5.610  -5.783
   72   2HB   LYS   5          HB2       LYS   5 -15.790  -4.149  -5.563
   73   1HG   LYS   5          HG1       LYS   5 -16.965  -5.073  -7.791
   74   2HG   LYS   5          HG2       LYS   5 -16.415  -6.604  -7.105
   75   1HD   LYS   5          HD1       LYS   5 -17.676  -4.819  -5.144
   76   2HD   LYS   5          HD2       LYS   5 -18.758  -5.313  -6.446
   77   1HE   LYS   5          HE1       LYS   5 -18.922  -6.867  -4.572
   78   2HE   LYS   5          HE2       LYS   5 -18.226  -7.675  -5.976
   79   1HZ   LYS   5          HZ1       LYS   5 -17.159  -7.866  -3.587
   80   2HZ   LYS   5          HZ2       LYS   5 -16.386  -6.437  -4.074
   81   3HZ   LYS   5          HZ3       LYS   5 -16.208  -7.851  -4.990
   82    H    GLY   6           HN       GLY   6 -12.510  -5.011  -6.119
   83   1HA   GLY   6          HA1       GLY   6 -11.727  -2.814  -4.590
   84   2HA   GLY   6          HA2       GLY   6 -10.649  -4.092  -5.128
   85    H    ALA   7           HN       ALA   7 -11.138  -3.438  -8.006
   86    HA   ALA   7           HA       ALA   7  -9.051  -1.667  -8.494
   87   1HB   ALA   7          HB1       ALA   7  -9.757  -1.717 -10.831
   88   2HB   ALA   7          HB2       ALA   7 -11.301  -2.428 -10.358
   89   3HB   ALA   7          HB3       ALA   7  -9.807  -3.331 -10.118
   90    H    THR   8           HN       THR   8 -12.607  -0.933  -8.813
   91    HA   THR   8           HA       THR   8 -12.360   1.734  -9.490
   92    HB   THR   8           HB       THR   8 -14.532   1.847  -7.828
   93    HG1  THR   8           HG1      THR   8 -14.258  -0.430  -7.420
   94   1HG2  THR   8          HG21      THR   8 -14.392   2.478 -10.233
   95   2HG2  THR   8          HG22      THR   8 -15.859   1.588  -9.822
   96   3HG2  THR   8          HG23      THR   8 -14.533   0.769 -10.649
   97    H    LEU   9           HN       LEU   9 -11.973   0.374  -6.262
   98    HA   LEU   9           HA       LEU   9 -11.982   2.782  -4.794
   99   1HB   LEU   9          HB1       LEU   9 -11.287  -0.052  -4.291
  100   2HB   LEU   9          HB2       LEU   9 -10.443   1.117  -3.278
  101    HG   LEU   9           HG       LEU   9 -12.426   0.527  -2.098
  102   1HD1  LEU   9          HD11      LEU   9 -13.630   2.650  -1.979
  103   2HD1  LEU   9          HD12      LEU   9 -12.939   3.140  -3.526
  104   3HD1  LEU   9          HD13      LEU   9 -11.894   2.934  -2.120
  105   1HD2  LEU   9          HD21      LEU   9 -14.004   1.204  -4.591
  106   2HD2  LEU   9          HD22      LEU   9 -14.675   0.706  -3.038
  107   3HD2  LEU   9          HD23      LEU   9 -13.712  -0.428  -3.986
  108    H    PHE  10           HN       PHE  10  -9.124   0.716  -5.045
  109    HA   PHE  10           HA       PHE  10  -7.109   2.454  -4.598
  110   1HB   PHE  10          HB1       PHE  10  -6.420   0.273  -4.833
  111   2HB   PHE  10          HB2       PHE  10  -7.351   0.019  -6.300
  112    HD1  PHE  10           HD1      PHE  10  -6.422   0.561  -8.502
  113    HD2  PHE  10           HD2      PHE  10  -4.186   1.224  -4.888
  114    HE1  PHE  10           HE1      PHE  10  -4.330   0.805  -9.835
  115    HE2  PHE  10           HE2      PHE  10  -2.127   1.593  -6.229
  116    HZ   PHE  10           HZ       PHE  10  -2.187   1.360  -8.699
  117    H    LYS  11           HN       LYS  11  -8.794   2.116  -7.692
  118    HA   LYS  11           HA       LYS  11  -7.126   3.531  -9.370
  119   1HB   LYS  11          HB1       LYS  11  -9.482   2.232  -9.664
  120   2HB   LYS  11          HB2       LYS  11 -10.000   3.902  -9.899
  121   1HG   LYS  11          HG1       LYS  11  -9.246   3.798 -11.991
  122   2HG   LYS  11          HG2       LYS  11  -7.612   3.650 -11.350
  123   1HD   LYS  11          HD1       LYS  11  -9.493   1.363 -11.975
  124   2HD   LYS  11          HD2       LYS  11  -8.103   1.855 -12.945
  125   1HE   LYS  11          HE1       LYS  11  -6.612   1.328 -11.043
  126   2HE   LYS  11          HE2       LYS  11  -8.008   0.804 -10.105
  127   1HZ   LYS  11          HZ1       LYS  11  -6.986  -0.451 -12.599
  128   2HZ   LYS  11          HZ2       LYS  11  -8.394  -0.924 -11.794
  129   3HZ   LYS  11          HZ3       LYS  11  -6.896  -1.093 -11.031
  130    H    THR  12           HN       THR  12  -9.288   4.924  -7.013
  131    HA   THR  12           HA       THR  12  -8.283   7.593  -7.623
  132    HB   THR  12           HB       THR  12 -10.511   7.233  -8.657
  133    HG1  THR  12           HG1      THR  12  -9.510   9.289  -7.418
  134   1HG2  THR  12          HG21      THR  12 -11.569   7.433  -5.839
  135   2HG2  THR  12          HG22      THR  12 -11.698   6.026  -6.896
  136   3HG2  THR  12          HG23      THR  12 -12.523   7.527  -7.320
  137    H    ARG  13           HN       ARG  13  -7.608   5.604  -5.638
  138    HA   ARG  13           HA       ARG  13  -7.857   7.179  -3.163
  139   1HB   ARG  13          HB1       ARG  13  -8.084   4.181  -3.439
  140   2HB   ARG  13          HB2       ARG  13  -7.868   5.002  -1.909
  141   1HG   ARG  13          HG1       ARG  13 -10.219   5.466  -3.726
  142   2HG   ARG  13          HG2       ARG  13 -10.199   4.260  -2.448
  143   1HD   ARG  13          HD1       ARG  13 -11.245   6.020  -1.388
  144   2HD   ARG  13          HD2       ARG  13  -9.561   6.321  -0.940
  145    HE   ARG  13           HE       ARG  13 -10.152   7.263  -3.364
  146   1HH1  ARG  13          HH11      ARG  13 -10.874   8.005  -0.026
  147   2HH1  ARG  13          HH12      ARG  13 -10.738   9.725  -0.081
  148   1HH2  ARG  13          HH21      ARG  13  -9.958   9.897  -3.408
  149   2HH2  ARG  13          HH22      ARG  13 -10.237  10.762  -1.937
  150    H    CYS  14           HN       CYS  14  -5.957   4.971  -5.101
  151    HA   CYS  14           HA       CYS  14  -3.539   5.657  -3.567
  152   1HB   CYS  14          HB1       CYS  14  -3.896   2.962  -4.816
  153   2HB   CYS  14          HB2       CYS  14  -2.780   3.450  -3.560
  154    H    LEU  15           HN       LEU  15  -4.946   4.811  -6.667
  155    HA   LEU  15           HA       LEU  15  -2.768   4.568  -8.297
  156   1HB   LEU  15          HB1       LEU  15  -5.242   4.329  -8.840
  157   2HB   LEU  15          HB2       LEU  15  -5.256   6.070  -9.094
  158    HG   LEU  15           HG       LEU  15  -3.440   5.772 -10.812
  159   1HD1  LEU  15          HD11      LEU  15  -2.675   3.538  -9.980
  160   2HD1  LEU  15          HD12      LEU  15  -2.961   3.612 -11.719
  161   3HD1  LEU  15          HD13      LEU  15  -4.147   2.846 -10.661
  162   1HD2  LEU  15          HD21      LEU  15  -6.156   4.555 -11.156
  163   2HD2  LEU  15          HD22      LEU  15  -5.003   4.563 -12.491
  164   3HD2  LEU  15          HD23      LEU  15  -5.536   6.085 -11.775
  165    H    GLN  16           HN       GLN  16  -4.148   7.612  -7.137
  166    HA   GLN  16           HA       GLN  16  -3.067   9.535  -8.667
  167   1HB   GLN  16          HB1       GLN  16  -2.908  10.873  -6.449
  168   2HB   GLN  16          HB2       GLN  16  -4.469  10.296  -7.013
  169   1HG   GLN  16          HG1       GLN  16  -3.710   8.207  -5.453
  170   2HG   GLN  16          HG2       GLN  16  -2.933   9.549  -4.610
  171   1HE2  GLN  16          HE21      GLN  16  -4.261  11.101  -3.580
  172   2HE2  GLN  16          HE22      GLN  16  -5.962  10.881  -3.408
  173    H    CYS  17           HN       CYS  17  -1.175   7.696  -6.296
  174    HA   CYS  17           HA       CYS  17   1.252   9.099  -7.186
  175   1HB   CYS  17          HB1       CYS  17   1.266   7.844  -4.507
  176   2HB   CYS  17          HB2       CYS  17   2.021   9.316  -5.092
  177    H    HIS  18           HN       HIS  18  -0.082   5.959  -6.255
  178    HA   HIS  18           HA       HIS  18   2.456   4.576  -6.606
  179   1HB   HIS  18          HB1       HIS  18  -0.231   3.849  -5.504
  180   2HB   HIS  18          HB2       HIS  18   0.934   2.600  -5.893
  181    HD1  HIS  18           HD1      HIS  18   3.414   3.042  -4.539
  182    HD2  HIS  18           HD2      HIS  18  -0.136   4.698  -3.062
  183    HE1  HIS  18           HE1      HIS  18   3.813   3.474  -2.072
  184    H    THR  19           HN       THR  19   2.137   2.312  -7.502
  185    HA   THR  19           HA       THR  19   0.552   2.152  -9.951
  186    HB   THR  19           HB       THR  19   2.832   0.909 -10.722
  187    HG1  THR  19           HG1      THR  19   4.210   3.029 -10.087
  188   1HG2  THR  19          HG21      THR  19   1.604   2.553 -12.059
  189   2HG2  THR  19          HG22      THR  19   3.334   2.891 -12.064
  190   3HG2  THR  19          HG23      THR  19   2.252   3.852 -11.058
  191    H    VAL  20           HN       VAL  20  -0.623   0.300  -9.936
  192    HA   VAL  20           HA       VAL  20  -0.281  -1.707  -7.934
  193    HB   VAL  20           HB       VAL  20  -2.372  -0.725  -9.243
  194   1HG1  VAL  20          HG11      VAL  20  -1.965  -1.802 -11.352
  195   2HG1  VAL  20          HG12      VAL  20  -3.437  -2.442 -10.618
  196   3HG1  VAL  20          HG13      VAL  20  -1.948  -3.388 -10.577
  197   1HG2  VAL  20          HG21      VAL  20  -2.465  -1.937  -7.123
  198   2HG2  VAL  20          HG22      VAL  20  -2.375  -3.467  -7.996
  199   3HG2  VAL  20          HG23      VAL  20  -3.766  -2.407  -8.217
  200    H    GLU  21           HN       GLU  21   0.619  -1.553 -11.266
  201    HA   GLU  21           HA       GLU  21   1.527  -4.355 -11.293
  202   1HB   GLU  21          HB1       GLU  21   1.588  -3.712 -13.899
  203   2HB   GLU  21          HB2       GLU  21   0.142  -4.344 -13.135
  204   1HG   GLU  21          HG1       GLU  21  -0.224  -2.389 -14.668
  205   2HG   GLU  21          HG2       GLU  21  -0.867  -2.187 -13.041
  206    H    LYS  22           HN       LYS  22   3.542  -4.415 -13.108
  207    HA   LYS  22           HA       LYS  22   5.375  -2.364 -12.140
  208   1HB   LYS  22          HB1       LYS  22   5.637  -5.144 -12.549
  209   2HB   LYS  22          HB2       LYS  22   6.792  -4.331 -13.621
  210   1HG   LYS  22          HG1       LYS  22   7.981  -3.438 -11.907
  211   2HG   LYS  22          HG2       LYS  22   6.547  -3.179 -10.913
  212   1HD   LYS  22          HD1       LYS  22   6.499  -5.543 -10.340
  213   2HD   LYS  22          HD2       LYS  22   7.900  -5.834 -11.372
  214   1HE   LYS  22          HE1       LYS  22   8.688  -5.721  -9.115
  215   2HE   LYS  22          HE2       LYS  22   9.212  -4.261  -9.933
  216   1HZ   LYS  22          HZ1       LYS  22   8.497  -3.591  -7.810
  217   2HZ   LYS  22          HZ2       LYS  22   7.098  -4.533  -7.870
  218   3HZ   LYS  22          HZ3       LYS  22   7.221  -3.156  -8.835
  219    H    GLY  23           HN       GLY  23   3.484  -1.933 -14.537
  220   1HA   GLY  23          HA1       GLY  23   5.422  -1.457 -16.682
  221   2HA   GLY  23          HA2       GLY  23   3.680  -1.272 -16.798
  222    H    GLY  24           HN       GLY  24   3.658   0.380 -14.290
  223   1HA   GLY  24          HA1       GLY  24   4.184   2.971 -15.474
  224   2HA   GLY  24          HA2       GLY  24   3.314   2.646 -13.984
  225    HA   PRO  25           HA       PRO  25   8.115   3.348 -13.307
  226   1HB   PRO  25          HB1       PRO  25   8.390   6.059 -13.702
  227   2HB   PRO  25          HB2       PRO  25   8.863   4.830 -14.879
  228   1HG   PRO  25          HG1       PRO  25   6.377   6.487 -14.761
  229   2HG   PRO  25          HG2       PRO  25   7.351   6.024 -16.169
  230   1HD   PRO  25          HD1       PRO  25   5.034   4.789 -15.572
  231   2HD   PRO  25          HD2       PRO  25   6.406   3.915 -16.287
  232    H    HIS  26           HN       HIS  26   8.893   4.462 -11.394
  233    HA   HIS  26           HA       HIS  26   7.036   4.690  -9.321
  234   1HB   HIS  26          HB1       HIS  26   9.862   5.744  -9.579
  235   2HB   HIS  26          HB2       HIS  26   8.965   5.701  -8.071
  236    HD2  HIS  26           HD2      HIS  26  11.269   3.645 -10.197
  237    HE1  HIS  26           HE1      HIS  26   9.836   0.980  -7.217
  238    HE2  HIS  26           HE2      HIS  26  11.570   1.323  -9.040
  239    H    LYS  27           HN       LYS  27   5.741   6.371  -8.702
  240    HA   LYS  27           HA       LYS  27   6.183   9.020  -9.892
  241   1HB   LYS  27          HB1       LYS  27   4.190   7.718 -10.684
  242   2HB   LYS  27          HB2       LYS  27   3.525   7.848  -9.060
  243   1HG   LYS  27          HG1       LYS  27   3.499  10.290  -9.245
  244   2HG   LYS  27          HG2       LYS  27   4.205  10.182 -10.861
  245   1HD   LYS  27          HD1       LYS  27   1.552  10.376 -10.454
  246   2HD   LYS  27          HD2       LYS  27   2.240   9.490 -11.821
  247   1HE   LYS  27          HE1       LYS  27   1.970   7.398 -10.732
  248   2HE   LYS  27          HE2       LYS  27   1.673   8.164  -9.171
  249   1HZ   LYS  27          HZ1       LYS  27  -0.370   7.334 -10.156
  250   2HZ   LYS  27          HZ2       LYS  27  -0.128   8.292 -11.527
  251   3HZ   LYS  27          HZ3       LYS  27  -0.413   9.025 -10.031
  252    H    VAL  28           HN       VAL  28   3.888   9.781  -7.853
  253    HA   VAL  28           HA       VAL  28   5.494  11.060  -5.944
  254    HB   VAL  28           HB       VAL  28   2.588  10.363  -5.545
  255   1HG1  VAL  28          HG11      VAL  28   2.515  12.463  -4.302
  256   2HG1  VAL  28          HG12      VAL  28   4.220  12.746  -4.650
  257   3HG1  VAL  28          HG13      VAL  28   3.742  11.390  -3.629
  258   1HG2  VAL  28          HG21      VAL  28   3.655  12.760  -7.054
  259   2HG2  VAL  28          HG22      VAL  28   1.965  12.410  -6.695
  260   3HG2  VAL  28          HG23      VAL  28   2.865  11.370  -7.799
  261    H    GLY  29           HN       GLY  29   4.302   7.850  -6.123
  262   1HA   GLY  29          HA1       GLY  29   5.466   7.144  -3.516
  263   2HA   GLY  29          HA2       GLY  29   3.891   6.525  -3.985
  264    HA   PRO  30           HA       PRO  30   7.541   3.839  -5.610
  265   1HB   PRO  30          HB1       PRO  30   7.433   1.813  -3.808
  266   2HB   PRO  30          HB2       PRO  30   8.459   3.237  -3.603
  267   1HG   PRO  30          HG1       PRO  30   5.771   2.652  -2.413
  268   2HG   PRO  30          HG2       PRO  30   7.216   3.324  -1.634
  269   1HD   PRO  30          HD1       PRO  30   5.163   4.878  -2.436
  270   2HD   PRO  30          HD2       PRO  30   6.847   5.438  -2.486
  271    H    ASN  31           HN       ASN  31   7.373   1.464  -6.252
  272    HA   ASN  31           HA       ASN  31   4.736   0.980  -7.328
  273   1HB   ASN  31          HB1       ASN  31   6.874   0.774  -8.635
  274   2HB   ASN  31          HB2       ASN  31   7.295  -0.624  -7.656
  275   1HD2  ASN  31          HD21      ASN  31   4.896   0.566  -9.990
  276   2HD2  ASN  31          HD22      ASN  31   4.508  -1.012 -10.594
  277    H    LEU  32           HN       LEU  32   3.291  -0.507  -6.584
  278    HA   LEU  32           HA       LEU  32   3.661  -1.806  -4.041
  279   1HB   LEU  32          HB1       LEU  32   1.219  -1.694  -5.813
  280   2HB   LEU  32          HB2       LEU  32   1.263  -2.122  -4.114
  281    HG   LEU  32           HG       LEU  32   2.049   0.620  -5.125
  282   1HD1  LEU  32          HD11      LEU  32  -0.622  -0.167  -3.954
  283   2HD1  LEU  32          HD12      LEU  32  -0.332   0.017  -5.684
  284   3HD1  LEU  32          HD13      LEU  32  -0.149   1.402  -4.610
  285   1HD2  LEU  32          HD21      LEU  32   2.797  -0.113  -2.819
  286   2HD2  LEU  32          HD22      LEU  32   1.090  -0.194  -2.382
  287   3HD2  LEU  32          HD23      LEU  32   1.803   1.343  -2.871
  288    H    HIS  33           HN       HIS  33   3.419  -2.829  -7.382
  289    HA   HIS  33           HA       HIS  33   2.669  -5.474  -7.262
  290   1HB   HIS  33          HB1       HIS  33   3.085  -3.880  -9.258
  291   2HB   HIS  33          HB2       HIS  33   4.753  -4.437  -9.170
  292    HD2  HIS  33           HD2      HIS  33   1.547  -6.624  -8.800
  293    HE1  HIS  33           HE1      HIS  33   3.672  -8.001 -12.213
  294    HE2  HIS  33           HE2      HIS  33   1.704  -8.449 -10.668
  295    H    GLY  34           HN       GLY  34   3.575  -6.607  -5.565
  296   1HA   GLY  34          HA1       GLY  34   5.156  -8.439  -5.296
  297   2HA   GLY  34          HA2       GLY  34   6.422  -7.340  -5.803
  298    H    ILE  35           HN       ILE  35   4.305  -5.729  -3.627
  299    HA   ILE  35           HA       ILE  35   6.355  -5.665  -1.662
  300    HB   ILE  35           HB       ILE  35   4.878  -4.387  -0.231
  301   1HG1  ILE  35          HG11      ILE  35   2.746  -5.132  -2.192
  302   2HG1  ILE  35          HG12      ILE  35   2.643  -4.905  -0.448
  303   1HG2  ILE  35          HG21      ILE  35   4.922  -2.418  -1.583
  304   2HG2  ILE  35          HG22      ILE  35   4.913  -3.373  -3.064
  305   3HG2  ILE  35          HG23      ILE  35   6.311  -3.426  -1.990
  306   1HD1  ILE  35          HD11      ILE  35   1.398  -3.175  -1.667
  307   2HD1  ILE  35          HD12      ILE  35   2.882  -2.684  -2.485
  308   3HD1  ILE  35          HD13      ILE  35   2.730  -2.478  -0.741
  309    H    PHE  36           HN       PHE  36   3.388  -7.598  -1.832
  310    HA   PHE  36           HA       PHE  36   3.331  -8.498   0.806
  311   1HB   PHE  36          HB1       PHE  36   2.308  -9.774  -1.730
  312   2HB   PHE  36          HB2       PHE  36   2.006 -10.434  -0.124
  313    HD1  PHE  36           HD1      PHE  36   1.354  -8.296   1.582
  314    HD2  PHE  36           HD2      PHE  36   0.418  -8.727  -2.595
  315    HE1  PHE  36           HE1      PHE  36  -0.562  -6.733   1.858
  316    HE2  PHE  36           HE2      PHE  36  -1.499  -7.165  -2.322
  317    HZ   PHE  36           HZ       PHE  36  -1.984  -6.159  -0.100
  318    H    GLY  37           HN       GLY  37   4.849  -9.429   1.863
  319   1HA   GLY  37          HA1       GLY  37   6.037 -11.417   2.460
  320   2HA   GLY  37          HA2       GLY  37   6.405 -11.670   0.765
  321    H    ARG  38           HN       ARG  38   6.894  -8.438   1.226
  322    HA   ARG  38           HA       ARG  38   9.771  -8.744   1.793
  323   1HB   ARG  38          HB1       ARG  38   8.199  -7.036  -0.091
  324   2HB   ARG  38          HB2       ARG  38   9.652  -6.336   0.608
  325   1HG   ARG  38          HG1       ARG  38  11.043  -7.682  -0.583
  326   2HG   ARG  38          HG2       ARG  38   9.923  -9.046  -0.558
  327   1HD   ARG  38          HD1       ARG  38   9.860  -8.417  -2.796
  328   2HD   ARG  38          HD2       ARG  38   8.478  -7.542  -2.135
  329    HE   ARG  38           HE       ARG  38  10.595  -6.499  -1.729
  330   1HH1  ARG  38          HH21      ARG  38   8.523  -6.980  -4.440
  331   2HH1  ARG  38          HH22      ARG  38   8.643  -5.393  -5.004
  332   1HH2  ARG  38          HH11      ARG  38  11.147  -4.176  -3.281
  333   2HH2  ARG  38          HH12      ARG  38  10.527  -4.417  -4.858
  334    H    HIS  39           HN       HIS  39  10.721  -6.655   2.693
  335    HA   HIS  39           HA       HIS  39   9.175  -5.897   5.046
  336   1HB   HIS  39          HB1       HIS  39  12.053  -5.199   4.401
  337   2HB   HIS  39          HB2       HIS  39  11.269  -5.172   5.983
  338    HD2  HIS  39           HD2      HIS  39  10.910  -7.496   7.256
  339    HE1  HIS  39           HE1      HIS  39  12.940  -9.994   4.474
  340    HE2  HIS  39           HE2      HIS  39  11.814  -9.898   6.748
  341    H    SER  40           HN       SER  40   9.135  -3.587   5.723
  342    HA   SER  40           HA       SER  40   8.231  -1.864   3.726
  343   1HB   SER  40          HB1       SER  40   9.344  -0.699   6.248
  344   2HB   SER  40          HB2       SER  40   7.923  -0.219   5.332
  345    HG   SER  40           HG       SER  40   7.132  -2.417   6.062
  346    H    GLY  41           HN       GLY  41   9.111  -0.248   2.554
  347   1HA   GLY  41          HA1       GLY  41  10.709   1.168   1.683
  348   2HA   GLY  41          HA2       GLY  41  11.769   0.745   3.006
  349    H    GLN  42           HN       GLN  42  10.479  -1.367   0.330
  350    HA   GLN  42           HA       GLN  42  13.275  -1.766  -0.461
  351   1HB   GLN  42          HB1       GLN  42  11.247  -3.977  -0.239
  352   2HB   GLN  42          HB2       GLN  42  12.907  -4.152  -0.796
  353   1HG   GLN  42          HG1       GLN  42  13.723  -3.391   1.400
  354   2HG   GLN  42          HG2       GLN  42  12.059  -3.242   1.959
  355   1HE2  GLN  42          HE21      GLN  42  14.158  -4.937   3.081
  356   2HE2  GLN  42          HE22      GLN  42  13.599  -6.563   2.939
  357    H    ALA  43           HN       ALA  43  11.100  -0.146  -1.913
  358    HA   ALA  43           HA       ALA  43  10.406  -1.392  -4.306
  359   1HB   ALA  43          HB1       ALA  43  10.950   1.532  -3.839
  360   2HB   ALA  43          HB2       ALA  43   9.434   0.693  -3.515
  361   3HB   ALA  43          HB3       ALA  43  10.020   0.846  -5.170
  362    H    GLU  44           HN       GLU  44  11.230  -1.437  -6.386
  363    HA   GLU  44           HA       GLU  44  14.016  -1.737  -6.681
  364   1HB   GLU  44          HB1       GLU  44  11.992  -1.747  -8.934
  365   2HB   GLU  44          HB2       GLU  44  13.560  -2.547  -8.891
  366   1HG   GLU  44          HG1       GLU  44  12.108  -4.306  -8.476
  367   2HG   GLU  44          HG2       GLU  44  12.614  -3.846  -6.862
  368    H    GLY  45           HN       GLY  45  14.913   0.274  -6.129
  369   1HA   GLY  45          HA1       GLY  45  16.284   1.991  -6.907
  370   2HA   GLY  45          HA2       GLY  45  15.342   2.070  -8.380
  371    H    TYR  46           HN       TYR  46  13.812   2.286  -5.214
  372    HA   TYR  46           HA       TYR  46  13.404   5.168  -5.545
  373   1HB   TYR  46          HB1       TYR  46  11.468   3.757  -6.283
  374   2HB   TYR  46          HB2       TYR  46  11.268   3.271  -4.605
  375    HD1  TYR  46           HD1      TYR  46  10.991   6.070  -7.005
  376    HD2  TYR  46           HD2      TYR  46  10.414   4.797  -2.943
  377    HE1  TYR  46           HE1      TYR  46   9.504   8.031  -6.616
  378    HE2  TYR  46           HE2      TYR  46   8.836   6.688  -2.565
  379    HH   TYR  46           HH       TYR  46   7.730   8.715  -5.211
  380    H    SER  47           HN       SER  47  13.500   6.456  -3.787
  381    HA   SER  47           HA       SER  47  14.687   5.430  -1.375
  382   1HB   SER  47          HB1       SER  47  14.012   8.244  -1.260
  383   2HB   SER  47          HB2       SER  47  15.596   7.466  -1.223
  384    HG   SER  47           HG       SER  47  15.771   7.665  -3.354
  385    H    TYR  48           HN       TYR  48  13.974   5.683   0.690
  386    HA   TYR  48           HA       TYR  48  11.156   6.229   1.286
  387   1HB   TYR  48          HB1       TYR  48  12.964   3.964   2.087
  388   2HB   TYR  48          HB2       TYR  48  11.530   4.358   3.027
  389    HD1  TYR  48           HD1      TYR  48   9.293   4.099   2.092
  390    HD2  TYR  48           HD2      TYR  48  12.783   2.961  -0.147
  391    HE1  TYR  48           HE1      TYR  48   7.878   2.674   0.626
  392    HE2  TYR  48           HE2      TYR  48  11.379   1.533  -1.619
  393    HH   TYR  48           HH       TYR  48   8.485   0.387  -0.748
  394    H    THR  49           HN       THR  49  10.778   6.776   3.686
  395    HA   THR  49           HA       THR  49  12.535   8.827   4.629
  396    HB   THR  49           HB       THR  49  10.972   8.614   6.725
  397    HG1  THR  49           HG1      THR  49   9.169   7.612   4.843
  398   1HG2  THR  49          HG21      THR  49   9.845   9.588   4.114
  399   2HG2  THR  49          HG22      THR  49  11.027  10.467   5.084
  400   3HG2  THR  49          HG23      THR  49   9.421  10.137   5.736
  401    H    ASP  50           HN       ASP  50  13.318   8.993   6.866
  402    HA   ASP  50           HA       ASP  50  15.099   7.011   7.629
  403   1HB   ASP  50          HB1       ASP  50  15.303   9.383   8.201
  404   2HB   ASP  50          HB2       ASP  50  13.899   9.264   9.258
  405    H    ALA  51           HN       ALA  51  11.782   7.534   8.704
  406    HA   ALA  51           HA       ALA  51  11.891   5.595  10.824
  407   1HB   ALA  51          HB1       ALA  51   9.590   7.216   9.737
  408   2HB   ALA  51          HB2       ALA  51  10.642   7.670  11.078
  409   3HB   ALA  51          HB3       ALA  51   9.577   6.273  11.229
  410    H    ASN  52           HN       ASN  52  10.617   5.583   7.475
  411    HA   ASN  52           HA       ASN  52   9.095   3.190   7.823
  412   1HB   ASN  52          HB1       ASN  52   8.260   4.437   6.090
  413   2HB   ASN  52          HB2       ASN  52   9.851   4.953   5.543
  414   1HD2  ASN  52          HD21      ASN  52   7.312   2.660   5.062
  415   2HD2  ASN  52          HD22      ASN  52   8.093   1.860   3.747
  416    H    ILE  53           HN       ILE  53  12.383   3.834   6.688
  417    HA   ILE  53           HA       ILE  53  12.992   1.191   5.886
  418    HB   ILE  53           HB       ILE  53  14.759   3.491   6.661
  419   1HG1  ILE  53          HG11      ILE  53  14.099   2.381   3.911
  420   2HG1  ILE  53          HG12      ILE  53  13.274   3.759   4.635
  421   1HG2  ILE  53          HG21      ILE  53  15.509   0.826   5.442
  422   2HG2  ILE  53          HG22      ILE  53  16.117   1.536   6.938
  423   3HG2  ILE  53          HG23      ILE  53  16.554   2.248   5.385
  424   1HD1  ILE  53          HD11      ILE  53  15.064   4.369   3.002
  425   2HD1  ILE  53          HD12      ILE  53  16.247   3.672   4.108
  426   3HD1  ILE  53          HD13      ILE  53  15.289   5.066   4.606
  427    H    LYS  54           HN       LYS  54  14.429   2.836   8.760
  428    HA   LYS  54           HA       LYS  54  15.230   0.803  10.296
  429   1HB   LYS  54          HB1       LYS  54  13.702   3.257  11.148
  430   2HB   LYS  54          HB2       LYS  54  14.526   2.182  12.281
  431   1HG   LYS  54          HG1       LYS  54  16.658   2.612  11.256
  432   2HG   LYS  54          HG2       LYS  54  15.900   3.517   9.943
  433   1HD   LYS  54          HD1       LYS  54  15.096   5.182  11.613
  434   2HD   LYS  54          HD2       LYS  54  15.993   4.305  12.864
  435   1HE   LYS  54          HE1       LYS  54  18.082   4.787  11.853
  436   2HE   LYS  54          HE2       LYS  54  17.319   5.309  10.348
  437   1HZ   LYS  54          HZ1       LYS  54  16.238   7.069  11.899
  438   2HZ   LYS  54          HZ2       LYS  54  17.812   7.291  11.312
  439   3HZ   LYS  54          HZ3       LYS  54  17.573   6.731  12.892
  440    H    LYS  55           HN       LYS  55  11.967   1.135   9.352
  441    HA   LYS  55           HA       LYS  55  10.800  -0.317  11.577
  442   1HB   LYS  55          HB1       LYS  55   9.775   1.645  10.347
  443   2HB   LYS  55          HB2       LYS  55   9.458   0.546   9.025
  444   1HG   LYS  55          HG1       LYS  55   7.485   0.965  10.376
  445   2HG   LYS  55          HG2       LYS  55   7.939  -0.729  10.389
  446   1HD   LYS  55          HD1       LYS  55   8.992  -0.323  12.644
  447   2HD   LYS  55          HD2       LYS  55   8.277   1.287  12.611
  448   1HE   LYS  55          HE1       LYS  55   6.850  -0.183  13.893
  449   2HE   LYS  55          HE2       LYS  55   6.032   0.235  12.387
  450   1HZ   LYS  55          HZ1       LYS  55   5.725  -2.050  12.582
  451   2HZ   LYS  55          HZ2       LYS  55   7.292  -2.323  13.148
  452   3HZ   LYS  55          HZ3       LYS  55   7.045  -1.935  11.523
  453    H    ASN  56           HN       ASN  56  11.576  -1.019   8.228
  454    HA   ASN  56           HA       ASN  56  11.209  -2.764   6.832
  455   1HB   ASN  56          HB1       ASN  56  13.220  -3.315   8.872
  456   2HB   ASN  56          HB2       ASN  56  12.650  -4.762   8.071
  457   1HD2  ASN  56          HD21      ASN  56  14.146  -1.552   7.382
  458   2HD2  ASN  56          HD22      ASN  56  14.574  -2.144   5.836
  459    H    VAL  57           HN       VAL  57   8.806  -2.691   8.117
  460    HA   VAL  57           HA       VAL  57   8.140  -5.122   9.440
  461    HB   VAL  57           HB       VAL  57   6.895  -2.680   9.088
  462   1HG1  VAL  57          HG11      VAL  57   5.072  -4.777   7.913
  463   2HG1  VAL  57          HG12      VAL  57   5.710  -3.376   7.052
  464   3HG1  VAL  57          HG13      VAL  57   4.607  -3.150   8.410
  465   1HG2  VAL  57          HG21      VAL  57   6.941  -4.035  11.070
  466   2HG2  VAL  57          HG22      VAL  57   5.916  -5.250  10.306
  467   3HG2  VAL  57          HG23      VAL  57   5.270  -3.648  10.660
  468    H    LEU  58           HN       LEU  58   7.267  -7.014   8.653
  469    HA   LEU  58           HA       LEU  58   7.661  -7.470   5.829
  470   1HB   LEU  58          HB1       LEU  58   8.434  -9.094   7.565
  471   2HB   LEU  58          HB2       LEU  58   6.750  -9.434   7.941
  472    HG   LEU  58           HG       LEU  58   6.543  -9.984   5.386
  473   1HD1  LEU  58          HD11      LEU  58   9.520 -10.257   5.844
  474   2HD1  LEU  58          HD12      LEU  58   8.726  -9.155   4.719
  475   3HD1  LEU  58          HD13      LEU  58   8.647 -10.896   4.449
  476   1HD2  LEU  58          HD21      LEU  58   6.288 -11.735   7.047
  477   2HD2  LEU  58          HD22      LEU  58   8.033 -11.813   7.280
  478   3HD2  LEU  58          HD23      LEU  58   7.327 -12.317   5.746
  479    H    TRP  59           HN       TRP  59   6.137  -6.555   4.625
  480    HA   TRP  59           HA       TRP  59   3.478  -6.073   5.270
  481   1HB   TRP  59          HB1       TRP  59   4.809  -6.418   2.586
  482   2HB   TRP  59          HB2       TRP  59   3.174  -5.821   2.794
  483    HD1  TRP  59           HD1      TRP  59   6.351  -4.536   1.996
  484    HE1  TRP  59           HE1      TRP  59   6.636  -2.073   2.706
  485    HE3  TRP  59           HE3      TRP  59   2.376  -4.072   5.180
  486    HZ2  TRP  59           HZ2      TRP  59   5.448  -0.202   4.513
  487    HZ3  TRP  59           HZ3      TRP  59   1.963  -1.941   6.348
  488    HH2  TRP  59           HH2      TRP  59   3.467  -0.009   6.032
  489    H    ASP  60           HN       ASP  60   2.010  -7.467   5.734
  490    HA   ASP  60           HA       ASP  60   1.604  -9.978   4.287
  491   1HB   ASP  60          HB1       ASP  60   2.057 -10.993   6.231
  492   2HB   ASP  60          HB2       ASP  60   2.138  -9.458   7.073
  493    H    GLU  61           HN       GLU  61  -0.821 -10.707   5.196
  494    HA   GLU  61           HA       GLU  61  -2.585  -8.995   3.741
  495   1HB   GLU  61          HB1       GLU  61  -2.618 -11.643   4.160
  496   2HB   GLU  61          HB2       GLU  61  -3.700 -11.163   5.463
  497   1HG   GLU  61          HG1       GLU  61  -5.339 -11.216   3.938
  498   2HG   GLU  61          HG2       GLU  61  -4.646  -9.723   3.298
  499    H    ASN  62           HN       ASN  62  -2.465  -9.950   7.193
  500    HA   ASN  62           HA       ASN  62  -4.429  -8.050   8.002
  501   1HB   ASN  62          HB1       ASN  62  -4.160 -10.119   9.191
  502   2HB   ASN  62          HB2       ASN  62  -2.473  -9.775   9.528
  503   1HD2  ASN  62          HD21      ASN  62  -1.966  -8.367  11.195
  504   2HD2  ASN  62          HD22      ASN  62  -3.145  -7.807  12.327
  505    H    ASN  63           HN       ASN  63  -0.833  -8.056   8.294
  506    HA   ASN  63           HA       ASN  63  -0.520  -5.657   9.636
  507   1HB   ASN  63          HB1       ASN  63   1.384  -6.918   9.514
  508   2HB   ASN  63          HB2       ASN  63   1.165  -7.299   7.817
  509   1HD2  ASN  63          HD21      ASN  63   1.954  -4.477   9.911
  510   2HD2  ASN  63          HD22      ASN  63   2.842  -3.785   8.597
  511    H    MET  64           HN       MET  64  -0.783  -5.951   6.025
  512    HA   MET  64           HA       MET  64  -0.269  -3.313   5.383
  513   1HB   MET  64          HB1       MET  64  -0.477  -4.780   3.594
  514   2HB   MET  64          HB2       MET  64  -2.032  -5.390   4.141
  515   1HG   MET  64          HG1       MET  64  -3.030  -3.188   3.591
  516   2HG   MET  64          HG2       MET  64  -1.483  -2.685   2.938
  517   1HE   MET  64          HE1       MET  64  -3.933  -6.152   1.103
  518   2HE   MET  64          HE2       MET  64  -4.393  -5.343   2.602
  519   3HE   MET  64          HE3       MET  64  -2.918  -6.308   2.538
  520    H    SER  65           HN       SER  65  -3.389  -4.606   6.553
  521    HA   SER  65           HA       SER  65  -4.818  -2.169   6.379
  522   1HB   SER  65          HB1       SER  65  -5.504  -4.307   8.366
  523   2HB   SER  65          HB2       SER  65  -6.578  -3.246   7.464
  524    HG   SER  65           HG       SER  65  -5.381  -5.632   6.723
  525    H    GLU  66           HN       GLU  66  -2.933  -3.580   9.030
  526    HA   GLU  66           HA       GLU  66  -3.582  -1.858  11.103
  527   1HB   GLU  66          HB1       GLU  66  -2.258  -3.498  11.933
  528   2HB   GLU  66          HB2       GLU  66  -1.392  -3.694  10.412
  529   1HG   GLU  66          HG1       GLU  66  -0.211  -1.489  11.028
  530   2HG   GLU  66          HG2       GLU  66  -0.832  -1.777  12.653
  531    H    TYR  67           HN       TYR  67  -1.208  -1.465   8.529
  532    HA   TYR  67           HA       TYR  67  -0.314   1.153   9.302
  533   1HB   TYR  67          HB1       TYR  67   1.315  -0.201   8.331
  534   2HB   TYR  67          HB2       TYR  67   0.242  -0.746   7.056
  535    HD1  TYR  67           HD1      TYR  67   0.115   0.406   4.960
  536    HD2  TYR  67           HD2      TYR  67   2.285   2.095   8.260
  537    HE1  TYR  67           HE1      TYR  67   1.248   1.983   3.400
  538    HE2  TYR  67           HE2      TYR  67   3.467   3.642   6.714
  539    HH   TYR  67           HH       TYR  67   2.588   3.936   3.342
  540    H    LEU  68           HN       LEU  68  -2.510  -0.099   6.728
  541    HA   LEU  68           HA       LEU  68  -2.791   2.328   5.362
  542   1HB   LEU  68          HB1       LEU  68  -4.630  -0.025   5.652
  543   2HB   LEU  68          HB2       LEU  68  -5.040   1.360   4.656
  544    HG   LEU  68           HG       LEU  68  -2.740  -0.562   4.257
  545   1HD1  LEU  68          HD11      LEU  68  -3.934  -1.076   2.221
  546   2HD1  LEU  68          HD12      LEU  68  -5.083   0.230   2.512
  547   3HD1  LEU  68          HD13      LEU  68  -5.066  -1.181   3.570
  548   1HD2  LEU  68          HD21      LEU  68  -2.199   0.739   2.222
  549   2HD2  LEU  68          HD22      LEU  68  -1.921   1.689   3.681
  550   3HD2  LEU  68          HD23      LEU  68  -3.363   1.973   2.706
  551    H    THR  69           HN       THR  69  -4.632   1.217   8.224
  552    HA   THR  69           HA       THR  69  -6.640   3.161   8.173
  553    HB   THR  69           HB       THR  69  -5.551   2.166  10.774
  554    HG1  THR  69           HG1      THR  69  -5.629   0.328   9.552
  555   1HG2  THR  69          HG21      THR  69  -7.538   3.644  10.811
  556   2HG2  THR  69          HG22      THR  69  -7.916   2.013  11.365
  557   3HG2  THR  69          HG23      THR  69  -8.374   2.519   9.740
  558    H    ASN  70           HN       ASN  70  -3.309   3.451   9.263
  559    HA   ASN  70           HA       ASN  70  -3.430   6.279   9.190
  560   1HB   ASN  70          HB1       ASN  70  -4.516   5.772  11.425
  561   2HB   ASN  70          HB2       ASN  70  -2.950   5.175  11.962
  562   1HD2  ASN  70          HD21      ASN  70  -4.137   7.264  13.295
  563   2HD2  ASN  70          HD22      ASN  70  -3.032   8.569  13.050
  564    HA   PRO  71           HA       PRO  71   0.742   4.542   8.242
  565   1HB   PRO  71          HB1       PRO  71   1.349   6.598   6.514
  566   2HB   PRO  71          HB2       PRO  71   0.560   5.092   6.039
  567   1HG   PRO  71          HG1       PRO  71  -0.650   7.764   6.624
  568   2HG   PRO  71          HG2       PRO  71  -1.054   6.607   5.342
  569   1HD   PRO  71          HD1       PRO  71  -2.562   6.847   7.551
  570   2HD   PRO  71          HD2       PRO  71  -2.305   5.275   6.766
  571    H    LYS  72           HN       LYS  72  -0.180   7.880   8.995
  572    HA   LYS  72           HA       LYS  72   2.366   8.858   9.707
  573   1HB   LYS  72          HB1       LYS  72  -0.409   9.801  10.419
  574   2HB   LYS  72          HB2       LYS  72   1.044  10.655  10.912
  575   1HG   LYS  72          HG1       LYS  72   1.642  10.836   8.470
  576   2HG   LYS  72          HG2       LYS  72   0.037  10.210   8.108
  577   1HD   LYS  72          HD1       LYS  72   0.632  12.748   9.643
  578   2HD   LYS  72          HD2       LYS  72   0.134  12.665   7.953
  579   1HE   LYS  72          HE1       LYS  72  -1.506  11.576  10.239
  580   2HE   LYS  72          HE2       LYS  72  -1.696  13.203   9.604
  581   1HZ   LYS  72          HZ1       LYS  72  -2.192  10.656   8.171
  582   2HZ   LYS  72          HZ2       LYS  72  -2.211  12.173   7.428
  583   3HZ   LYS  72          HZ3       LYS  72  -3.336  11.821   8.637
  584    H    LYS  73           HN       LYS  73  -0.100   7.191  11.598
  585    HA   LYS  73           HA       LYS  73   1.249   7.671  14.092
  586   1HB   LYS  73          HB1       LYS  73  -1.147   7.438  14.129
  587   2HB   LYS  73          HB2       LYS  73  -1.050   5.839  13.407
  588   1HG   LYS  73          HG1       LYS  73  -1.520   5.712  15.804
  589   2HG   LYS  73          HG2       LYS  73   0.022   4.963  15.413
  590   1HD   LYS  73          HD1       LYS  73   0.907   7.416  16.039
  591   2HD   LYS  73          HD2       LYS  73  -0.563   7.405  17.011
  592   1HE   LYS  73          HE1       LYS  73   1.428   6.646  18.271
  593   2HE   LYS  73          HE2       LYS  73   0.171   5.416  18.181
  594   1HZ   LYS  73          HZ1       LYS  73   2.662   4.845  17.718
  595   2HZ   LYS  73          HZ2       LYS  73   2.289   5.390  16.162
  596   3HZ   LYS  73          HZ3       LYS  73   1.422   4.104  16.832
  597    H    TYR  74           HN       TYR  74   1.132   4.954  11.823
  598    HA   TYR  74           HA       TYR  74   2.684   3.188  13.443
  599   1HB   TYR  74          HB1       TYR  74   1.021   2.624  11.575
  600   2HB   TYR  74          HB2       TYR  74   2.347   2.971  10.465
  601    HD1  TYR  74           HD1      TYR  74   3.168   0.917   9.606
  602    HD2  TYR  74           HD2      TYR  74   2.252   1.331  13.786
  603    HE1  TYR  74           HE1      TYR  74   4.013  -1.396  10.019
  604    HE2  TYR  74           HE2      TYR  74   3.081  -0.967  14.212
  605    HH   TYR  74           HH       TYR  74   3.262  -3.157  12.667
  606    H    ILE  75           HN       ILE  75   3.465   5.272  10.716
  607    HA   ILE  75           HA       ILE  75   6.331   5.059  11.310
  608    HB   ILE  75           HB       ILE  75   5.117   5.162   8.535
  609   1HG1  ILE  75          HG11      ILE  75   6.529   2.936  10.043
  610   2HG1  ILE  75          HG12      ILE  75   4.898   2.904   9.390
  611   1HG2  ILE  75          HG21      ILE  75   7.460   4.985   7.772
  612   2HG2  ILE  75          HG22      ILE  75   8.007   5.041   9.447
  613   3HG2  ILE  75          HG23      ILE  75   7.204   6.441   8.736
  614   1HD1  ILE  75          HD11      ILE  75   5.829   2.934   7.105
  615   2HD1  ILE  75          HD12      ILE  75   6.394   1.548   8.036
  616   3HD1  ILE  75          HD13      ILE  75   7.457   2.931   7.781
  617    HA   PRO  76           HA       PRO  76   4.987   9.421  11.793
  618   1HB   PRO  76          HB1       PRO  76   6.970  10.031  13.565
  619   2HB   PRO  76          HB2       PRO  76   5.426   9.311  14.034
  620   1HG   PRO  76          HG1       PRO  76   8.080   7.998  13.612
  621   2HG   PRO  76          HG2       PRO  76   6.879   7.713  14.885
  622   1HD   PRO  76          HD1       PRO  76   7.144   6.077  12.750
  623   2HD   PRO  76          HD2       PRO  76   5.577   6.375  13.531
  624    H    GLY  77           HN       GLY  77   5.555  10.714  10.151
  625   1HA   GLY  77          HA1       GLY  77   7.057  12.329   9.255
  626   2HA   GLY  77          HA2       GLY  77   8.397  11.274   9.661
  627    H    THR  78           HN       THR  78   6.160   9.268   8.296
  628    HA   THR  78           HA       THR  78   7.580   8.791   5.918
  629    HB   THR  78           HB       THR  78   5.796   7.407   7.381
  630    HG1  THR  78           HG1      THR  78   7.196   7.009   5.160
  631   1HG2  THR  78          HG21      THR  78   3.788   8.445   6.455
  632   2HG2  THR  78          HG22      THR  78   3.902   6.747   5.993
  633   3HG2  THR  78          HG23      THR  78   4.305   8.007   4.826
  634    H    LYS  79           HN       LYS  79   7.033   9.030   3.749
  635    HA   LYS  79           HA       LYS  79   5.888  11.540   3.023
  636   1HB   LYS  79          HB1       LYS  79   6.499   9.287   1.126
  637   2HB   LYS  79          HB2       LYS  79   6.535  11.014   0.810
  638   1HG   LYS  79          HG1       LYS  79   8.495  11.148   2.409
  639   2HG   LYS  79          HG2       LYS  79   8.523   9.377   2.374
  640   1HD   LYS  79          HD1       LYS  79   8.338  10.056  -0.307
  641   2HD   LYS  79          HD2       LYS  79   9.420  11.292   0.347
  642   1HE   LYS  79          HE1       LYS  79  10.918   9.602  -0.180
  643   2HE   LYS  79          HE2       LYS  79  10.581   9.262   1.517
  644   1HZ   LYS  79          HZ1       LYS  79   9.439   7.392   1.011
  645   2HZ   LYS  79          HZ2       LYS  79  10.446   7.414  -0.345
  646   3HZ   LYS  79          HZ3       LYS  79   8.866   7.992  -0.467
  647    H    MET  80           HN       MET  80   4.327   8.497   3.541
  648    HA   MET  80           HA       MET  80   2.257   8.954   1.593
  649   1HB   MET  80          HB1       MET  80   2.643   6.696   1.759
  650   2HB   MET  80          HB2       MET  80   2.874   6.750   3.510
  651   1HG   MET  80          HG1       MET  80   0.641   6.736   3.960
  652   2HG   MET  80          HG2       MET  80   0.214   7.514   2.448
  653   1HE   MET  80          HE1       MET  80  -1.230   4.935   4.048
  654   2HE   MET  80          HE2       MET  80  -1.839   4.157   2.586
  655   3HE   MET  80          HE3       MET  80  -1.893   5.913   2.738
  656    H    ALA  81           HN       ALA  81   1.415  10.887   2.126
  657    HA   ALA  81           HA       ALA  81   0.138  11.347   4.674
  658   1HB   ALA  81          HB1       ALA  81   0.349  13.246   2.361
  659   2HB   ALA  81          HB2       ALA  81   1.614  13.013   3.566
  660   3HB   ALA  81          HB3       ALA  81   0.033  13.623   4.055
  661    H    PHE  82           HN       PHE  82  -0.956   9.577   2.519
  662    HA   PHE  82           HA       PHE  82  -3.224  10.288   1.258
  663   1HB   PHE  82          HB1       PHE  82  -2.420   8.244   0.660
  664   2HB   PHE  82          HB2       PHE  82  -2.140   7.735   2.320
  665    HD1  PHE  82           HD1      PHE  82  -4.809   8.284  -0.233
  666    HD2  PHE  82           HD2      PHE  82  -3.707   6.405   3.478
  667    HE1  PHE  82           HE1      PHE  82  -6.982   7.071  -0.199
  668    HE2  PHE  82           HE2      PHE  82  -5.882   5.205   3.518
  669    HZ   PHE  82           HZ       PHE  82  -7.528   5.554   1.690
  670    H    GLY  83           HN       GLY  83  -3.071   9.698   4.750
  671   1HA   GLY  83          HA1       GLY  83  -4.862  10.822   6.031
  672   2HA   GLY  83          HA2       GLY  83  -5.988  10.204   4.843
  673    H    GLY  84           HN       GLY  84  -5.452   7.542   4.718
  674   1HA   GLY  84          HA1       GLY  84  -5.004   5.591   6.103
  675   2HA   GLY  84          HA2       GLY  84  -5.626   6.495   7.471
  676    H    LEU  85           HN       LEU  85  -6.334   4.021   5.526
  677    HA   LEU  85           HA       LEU  85  -9.102   4.419   4.908
  678   1HB   LEU  85          HB1       LEU  85  -7.282   2.021   4.804
  679   2HB   LEU  85          HB2       LEU  85  -8.990   1.913   4.435
  680    HG   LEU  85           HG       LEU  85  -7.024   3.661   2.931
  681   1HD1  LEU  85          HD11      LEU  85  -6.546   1.279   2.625
  682   2HD1  LEU  85          HD12      LEU  85  -7.246   1.965   1.158
  683   3HD1  LEU  85          HD13      LEU  85  -8.239   0.978   2.231
  684   1HD2  LEU  85          HD21      LEU  85  -8.779   3.805   1.229
  685   2HD2  LEU  85          HD22      LEU  85  -9.356   4.466   2.759
  686   3HD2  LEU  85          HD23      LEU  85  -9.864   2.857   2.246
  687    H    LYS  86           HN       LYS  86 -10.031   4.966   6.777
  688    HA   LYS  86           HA       LYS  86 -10.044   3.574   9.231
  689   1HB   LYS  86          HB1       LYS  86 -12.088   5.572   8.261
  690   2HB   LYS  86          HB2       LYS  86 -11.659   5.197   9.925
  691   1HG   LYS  86          HG1       LYS  86  -9.611   6.307   8.023
  692   2HG   LYS  86          HG2       LYS  86 -10.734   7.369   8.876
  693   1HD   LYS  86          HD1       LYS  86  -9.952   6.427  11.031
  694   2HD   LYS  86          HD2       LYS  86  -8.796   5.423  10.157
  695   1HE   LYS  86          HE1       LYS  86  -8.846   8.449  10.155
  696   2HE   LYS  86          HE2       LYS  86  -7.746   7.449  11.100
  697   1HZ   LYS  86          HZ1       LYS  86  -7.893   7.270   8.151
  698   2HZ   LYS  86          HZ2       LYS  86  -6.668   6.713   9.174
  699   3HZ   LYS  86          HZ3       LYS  86  -6.875   8.373   8.939
  700    H    LYS  87           HN       LYS  87 -12.109   3.314   6.410
  701    HA   LYS  87           HA       LYS  87 -14.209   1.805   7.698
  702   1HB   LYS  87          HB1       LYS  87 -13.628   2.239   4.777
  703   2HB   LYS  87          HB2       LYS  87 -15.099   1.577   5.438
  704   1HG   LYS  87          HG1       LYS  87 -15.552   3.872   6.452
  705   2HG   LYS  87          HG2       LYS  87 -14.189   4.461   5.451
  706   1HD   LYS  87          HD1       LYS  87 -15.397   2.789   3.740
  707   2HD   LYS  87          HD2       LYS  87 -16.787   3.286   4.644
  708   1HE   LYS  87          HE1       LYS  87 -16.832   5.357   3.624
  709   2HE   LYS  87          HE2       LYS  87 -15.109   5.290   3.188
  710   1HZ   LYS  87          HZ1       LYS  87 -17.069   3.305   2.181
  711   2HZ   LYS  87          HZ2       LYS  87 -15.505   3.589   1.616
  712   3HZ   LYS  87          HZ3       LYS  87 -16.724   4.733   1.331
  713    H    GLU  88           HN       GLU  88 -13.684  -0.232   8.311
  714    HA   GLU  88           HA       GLU  88 -11.787  -1.947   7.219
  715   1HB   GLU  88          HB1       GLU  88 -12.994  -1.991   9.482
  716   2HB   GLU  88          HB2       GLU  88 -14.241  -2.913   8.647
  717   1HG   GLU  88          HG1       GLU  88 -12.798  -4.723   8.227
  718   2HG   GLU  88          HG2       GLU  88 -11.352  -3.753   8.540
  719    H    LYS  89           HN       LYS  89 -15.280  -1.853   6.463
  720    HA   LYS  89           HA       LYS  89 -15.393  -4.180   4.919
  721   1HB   LYS  89          HB1       LYS  89 -17.139  -1.842   4.267
  722   2HB   LYS  89          HB2       LYS  89 -17.551  -3.550   4.403
  723   1HG   LYS  89          HG1       LYS  89 -16.697  -1.933   6.789
  724   2HG   LYS  89          HG2       LYS  89 -18.371  -1.987   6.257
  725   1HD   LYS  89          HD1       LYS  89 -18.673  -3.905   7.373
  726   2HD   LYS  89          HD2       LYS  89 -17.366  -4.668   6.452
  727   1HE   LYS  89          HE1       LYS  89 -15.990  -3.031   8.181
  728   2HE   LYS  89          HE2       LYS  89 -17.346  -3.560   9.175
  729   1HZ   LYS  89          HZ1       LYS  89 -15.558  -5.084   9.455
  730   2HZ   LYS  89          HZ2       LYS  89 -15.373  -5.283   7.788
  731   3HZ   LYS  89          HZ3       LYS  89 -16.761  -5.870   8.553
  732    H    ASP  90           HN       ASP  90 -14.729  -0.902   4.021
  733    HA   ASP  90           HA       ASP  90 -14.397  -1.052   1.291
  734   1HB   ASP  90          HB1       ASP  90 -13.700   0.728   3.533
  735   2HB   ASP  90          HB2       ASP  90 -12.712   0.933   2.098
  736    H    ARG  91           HN       ARG  91 -11.863  -1.475   3.859
  737    HA   ARG  91           HA       ARG  91  -9.779  -2.057   2.023
  738   1HB   ARG  91          HB1       ARG  91  -9.824  -3.081   4.865
  739   2HB   ARG  91          HB2       ARG  91  -8.420  -2.807   3.840
  740   1HG   ARG  91          HG1       ARG  91  -8.903  -0.387   3.872
  741   2HG   ARG  91          HG2       ARG  91 -10.255  -0.686   4.951
  742   1HD   ARG  91          HD1       ARG  91  -7.316  -1.065   5.525
  743   2HD   ARG  91          HD2       ARG  91  -8.397   0.122   6.236
  744    HE   ARG  91           HE       ARG  91  -8.256  -2.379   6.221
  745   1HH1  ARG  91          HH21      ARG  91  -9.118   0.420   8.091
  746   2HH1  ARG  91          HH22      ARG  91  -9.760  -0.273   9.540
  747   1HH2  ARG  91          HH11      ARG  91  -9.203  -3.529   8.606
  748   2HH2  ARG  91          HH12      ARG  91  -9.810  -2.477   9.833
  749    H    ASN  92           HN       ASN  92 -12.124  -4.184   3.613
  750    HA   ASN  92           HA       ASN  92 -11.119  -6.663   3.166
  751   1HB   ASN  92          HB1       ASN  92 -13.947  -5.655   2.952
  752   2HB   ASN  92          HB2       ASN  92 -13.560  -7.360   2.786
  753   1HD2  ASN  92          HD21      ASN  92 -15.262  -6.427   4.735
  754   2HD2  ASN  92          HD22      ASN  92 -14.468  -6.910   6.194
  755    H    ASP  93           HN       ASP  93 -13.180  -5.037   0.703
  756    HA   ASP  93           HA       ASP  93 -12.605  -6.829  -1.386
  757   1HB   ASP  93          HB1       ASP  93 -14.357  -4.761  -1.055
  758   2HB   ASP  93          HB2       ASP  93 -13.222  -4.069  -2.204
  759    H    LEU  94           HN       LEU  94 -10.959  -3.739  -0.515
  760    HA   LEU  94           HA       LEU  94  -9.317  -3.448  -2.693
  761   1HB   LEU  94          HB1       LEU  94  -9.499  -2.427   0.044
  762   2HB   LEU  94          HB2       LEU  94  -7.895  -2.452  -0.588
  763    HG   LEU  94           HG       LEU  94 -10.131  -1.208  -2.155
  764   1HD1  LEU  94          HD11      LEU  94  -9.960  -0.262   0.175
  765   2HD1  LEU  94          HD12      LEU  94  -9.708   0.901  -1.130
  766   3HD1  LEU  94          HD13      LEU  94  -8.326   0.265  -0.239
  767   1HD2  LEU  94          HD21      LEU  94  -7.211  -0.435  -2.109
  768   2HD2  LEU  94          HD22      LEU  94  -8.457   0.117  -3.226
  769   3HD2  LEU  94          HD23      LEU  94  -7.898  -1.555  -3.287
  770    H    ILE  95           HN       ILE  95  -8.788  -5.453   0.184
  771    HA   ILE  95           HA       ILE  95  -6.121  -6.199  -0.284
  772    HB   ILE  95           HB       ILE  95  -8.339  -7.603   1.216
  773   1HG1  ILE  95          HG11      ILE  95  -5.959  -6.069   2.300
  774   2HG1  ILE  95          HG12      ILE  95  -7.517  -5.311   1.987
  775   1HG2  ILE  95          HG21      ILE  95  -5.376  -8.230   1.201
  776   2HG2  ILE  95          HG22      ILE  95  -6.677  -9.286   0.653
  777   3HG2  ILE  95          HG23      ILE  95  -6.537  -8.877   2.363
  778   1HD1  ILE  95          HD11      ILE  95  -7.225  -5.929   4.356
  779   2HD1  ILE  95          HD12      ILE  95  -7.069  -7.621   3.882
  780   3HD1  ILE  95          HD13      ILE  95  -8.588  -6.768   3.613
  781    H    THR  96           HN       THR  96  -9.147  -7.932  -1.142
  782    HA   THR  96           HA       THR  96  -8.075 -10.062  -2.546
  783    HB   THR  96           HB       THR  96 -10.577  -8.790  -3.589
  784    HG1  THR  96           HG1      THR  96 -10.980  -8.643  -1.425
  785   1HG2  THR  96          HG21      THR  96  -9.727 -11.623  -2.950
  786   2HG2  THR  96          HG22      THR  96  -9.917 -10.915  -4.555
  787   3HG2  THR  96          HG23      THR  96 -11.330 -11.166  -3.529
  788    H    TYR  97           HN       TYR  97  -8.741  -6.774  -3.805
  789    HA   TYR  97           HA       TYR  97  -8.014  -7.345  -6.476
  790   1HB   TYR  97          HB1       TYR  97  -9.310  -5.389  -6.025
  791   2HB   TYR  97          HB2       TYR  97  -8.067  -4.742  -4.961
  792    HD1  TYR  97           HD1      TYR  97  -6.782  -3.023  -5.785
  793    HD2  TYR  97           HD2      TYR  97  -8.335  -5.957  -8.518
  794    HE1  TYR  97           HE1      TYR  97  -5.743  -1.798  -7.682
  795    HE2  TYR  97           HE2      TYR  97  -7.404  -4.676 -10.436
  796    HH   TYR  97           HH       TYR  97  -5.086  -2.644 -10.348
  797    H    LEU  98           HN       LEU  98  -6.055  -5.712  -3.936
  798    HA   LEU  98           HA       LEU  98  -3.680  -5.527  -5.412
  799   1HB   LEU  98          HB1       LEU  98  -4.537  -4.658  -2.977
  800   2HB   LEU  98          HB2       LEU  98  -3.415  -5.927  -2.499
  801    HG   LEU  98           HG       LEU  98  -1.646  -4.868  -3.909
  802   1HD1  LEU  98          HD11      LEU  98  -3.596  -2.571  -4.159
  803   2HD1  LEU  98          HD12      LEU  98  -3.257  -3.714  -5.458
  804   3HD1  LEU  98          HD13      LEU  98  -1.972  -2.674  -4.840
  805   1HD2  LEU  98          HD21      LEU  98  -1.316  -2.861  -2.474
  806   2HD2  LEU  98          HD22      LEU  98  -1.693  -4.316  -1.551
  807   3HD2  LEU  98          HD23      LEU  98  -2.940  -3.100  -1.827
  808    H    LYS  99           HN       LYS  99  -4.764  -7.954  -3.117
  809    HA   LYS  99           HA       LYS  99  -2.555  -9.657  -3.143
  810   1HB   LYS  99          HB1       LYS  99  -3.818 -10.379  -1.439
  811   2HB   LYS  99          HB2       LYS  99  -5.286  -9.718  -2.137
  812   1HG   LYS  99          HG1       LYS  99  -5.587 -11.711  -3.486
  813   2HG   LYS  99          HG2       LYS  99  -4.060 -12.363  -2.925
  814   1HD   LYS  99          HD1       LYS  99  -5.937 -11.770  -0.752
  815   2HD   LYS  99          HD2       LYS  99  -6.546 -12.960  -1.906
  816   1HE   LYS  99          HE1       LYS  99  -5.301 -13.981  -0.030
  817   2HE   LYS  99          HE2       LYS  99  -4.598 -14.335  -1.601
  818   1HZ   LYS  99          HZ1       LYS  99  -3.385 -13.183   0.631
  819   2HZ   LYS  99          HZ2       LYS  99  -3.370 -12.039  -0.617
  820   3HZ   LYS  99          HZ3       LYS  99  -2.703 -13.573  -0.879
  821    H    LYS 100           HN       LYS 100  -5.333  -9.508  -5.355
  822    HA   LYS 100           HA       LYS 100  -4.695 -11.842  -6.822
  823   1HB   LYS 100          HB1       LYS 100  -6.924 -10.580  -6.601
  824   2HB   LYS 100          HB2       LYS 100  -6.354  -9.652  -7.970
  825   1HG   LYS 100          HG1       LYS 100  -7.927 -11.533  -8.529
  826   2HG   LYS 100          HG2       LYS 100  -6.391 -11.584  -9.399
  827   1HD   LYS 100          HD1       LYS 100  -6.441 -12.995  -6.838
  828   2HD   LYS 100          HD2       LYS 100  -7.537 -13.645  -8.018
  829   1HE   LYS 100          HE1       LYS 100  -5.749 -15.035  -8.237
  830   2HE   LYS 100          HE2       LYS 100  -5.326 -13.821  -9.456
  831   1HZ   LYS 100          HZ1       LYS 100  -3.554 -14.473  -7.697
  832   2HZ   LYS 100          HZ2       LYS 100  -4.453 -13.502  -6.646
  833   3HZ   LYS 100          HZ3       LYS 100  -3.778 -12.828  -8.046
  834    H    ALA 101           HN       ALA 101  -3.717  -8.634  -7.213
  835    HA   ALA 101           HA       ALA 101  -2.481  -8.781  -9.776
  836   1HB   ALA 101          HB1       ALA 101  -2.378  -6.643  -7.645
  837   2HB   ALA 101          HB2       ALA 101  -3.596  -6.766  -8.914
  838   3HB   ALA 101          HB3       ALA 101  -1.911  -6.460  -9.336
  839    H    THR 102           HN       THR 102  -1.314  -8.912  -6.433
  840    HA   THR 102           HA       THR 102   1.486  -8.994  -7.083
  841    HB   THR 102           HB       THR 102   0.242  -9.681  -4.424
  842    HG1  THR 102           HG1      THR 102  -0.422  -7.579  -5.162
  843   1HG2  THR 102          HG21      THR 102   2.381  -8.743  -3.557
  844   2HG2  THR 102          HG22      THR 102   2.956  -8.615  -5.220
  845   3HG2  THR 102          HG23      THR 102   2.603 -10.199  -4.529
  846    H    GLU 103           HN       GLU 103  -1.004 -11.378  -6.213
  847    HA   GLU 103           HA       GLU 103   0.841 -13.508  -7.071
  848   1HB   GLU 103          HB1       GLU 103  -0.666 -14.856  -5.261
  849   2HB   GLU 103          HB2       GLU 103   0.910 -14.166  -4.907
  850   1HG   GLU 103          HG1       GLU 103   0.039 -12.840  -3.372
  851   2HG   GLU 103          HG2       GLU 103  -1.103 -12.173  -4.534
  852    HHA  HEC 104           HA       HEC 104   5.260   3.323   1.407
  853    HHB  HEC 104           HB       HEC 104  -0.410   0.362   0.273
  854    HHC  HEC 104           HC       HEC 104  -3.019   6.075  -1.331
  855    HHD  HEC 104           HD       HEC 104   2.894   8.675  -1.384
  856   1HMA  HEC 104          HMA1      HEC 104   1.419  -1.007   2.080
  857   2HMA  HEC 104          HMA2      HEC 104   2.930  -1.371   1.244
  858   3HMA  HEC 104          HMA3      HEC 104   1.429  -1.226   0.330
  859   1HAA  HEC 104          HAA1      HEC 104   4.468  -0.341   2.128
  860   2HAA  HEC 104          HAA2      HEC 104   5.138   1.241   2.483
  861   1HBA  HEC 104          HBA1      HEC 104   5.973   1.378   0.148
  862   2HBA  HEC 104          HBA2      HEC 104   5.363  -0.243  -0.141
  863   1HMB  HEC 104          HMB1      HEC 104  -2.293   0.026  -0.327
  864   2HMB  HEC 104          HMB2      HEC 104  -3.237   0.602  -1.701
  865   3HMB  HEC 104          HMB3      HEC 104  -3.881   0.749  -0.066
  866    HAB  HEC 104           HAB      HEC 104  -4.411   4.733  -1.349
  867   1HBB  HEC 104          HBB1      HEC 104  -4.704   3.530   0.954
  868   2HBB  HEC 104          HBB2      HEC 104  -5.702   2.440  -0.008
  869   3HBB  HEC 104          HBB3      HEC 104  -6.072   4.165   0.039
  870   1HMC  HEC 104          HMC1      HEC 104  -3.101   8.640  -1.517
  871   2HMC  HEC 104          HMC2      HEC 104  -2.774   7.902  -3.085
  872   3HMC  HEC 104          HMC3      HEC 104  -2.177   9.523  -2.731
  873    HAC  HEC 104           HAC      HEC 104   1.671   9.701  -2.658
  874   1HBC  HEC 104          HBC1      HEC 104   0.885  11.098  -0.989
  875   2HBC  HEC 104          HBC2      HEC 104  -0.781  11.007  -1.558
  876   3HBC  HEC 104          HBC3      HEC 104   0.429  11.870  -2.507
  877   1HMD  HEC 104          HMD1      HEC 104   5.035   9.102  -0.503
  878   2HMD  HEC 104          HMD2      HEC 104   5.479   8.107  -1.890
  879   3HMD  HEC 104          HMD3      HEC 104   6.517   8.147  -0.465
  880   1HAD  HEC 104          HAD1      HEC 104   7.349   6.289   0.322
  881   2HAD  HEC 104          HAD2      HEC 104   6.920   4.749   1.058
  882   1HBD  HEC 104          HBD1      HEC 104   6.418   5.713   3.105
  883   2HBD  HEC 104          HBD2      HEC 104   6.074   7.279   2.403
  884    H2   4NL 105           H2       4NL 105   0.413 -12.897  -1.295
  885    H6   4NL 105           H6       4NL 105   1.587 -13.331   3.869
  886    H3   4NL 105           H3       4NL 105  -1.685 -10.339   1.520
  887    H5   4NL 105           H5       4NL 105  -1.334 -11.606  -1.861
  888    H4   4NL 105           H4       4NL 105  -0.118 -11.059   3.342
  889    H1   4NL 105           H1       4NL 105   1.980 -13.617   0.527
  890    H7   4NL 105           H7       4NL 105   2.919 -12.496   3.033
  Start of MODEL   20
    1   1H    THR  -5          HT1       THR  -5 -11.122  -4.023  13.732
    2   2H    THR  -5          HT2       THR  -5 -12.695  -4.613  13.937
    3   3H    THR  -5          HT3       THR  -5 -12.160  -4.165  12.397
    4    HA   THR  -5           HA       THR  -5 -10.648  -5.955  12.276
    5    HB   THR  -5           HB       THR  -5 -11.533  -6.960  14.978
    6    HG1  THR  -5           HG1      THR  -5  -9.216  -5.992  15.400
    7   1HG2  THR  -5          HG21      THR  -5  -8.998  -7.274  13.356
    8   2HG2  THR  -5          HG22      THR  -5 -10.300  -8.458  13.462
    9   3HG2  THR  -5          HG23      THR  -5  -9.345  -8.067  14.893
   10    H    GLU  -4           HN       GLU  -4 -12.227  -6.453  10.711
   11    HA   GLU  -4           HA       GLU  -4 -13.905  -8.679  11.181
   12   1HB   GLU  -4          HB1       GLU  -4 -15.290  -6.728  12.162
   13   2HB   GLU  -4          HB2       GLU  -4 -15.431  -6.144  10.508
   14   1HG   GLU  -4          HG1       GLU  -4 -16.255  -8.928  11.301
   15   2HG   GLU  -4          HG2       GLU  -4 -17.351  -7.557  11.414
   16    H    PHE  -3           HN       PHE  -3 -12.456  -9.280   9.513
   17    HA   PHE  -3           HA       PHE  -3 -12.520  -7.908   6.979
   18   1HB   PHE  -3          HB1       PHE  -3 -10.364  -8.669   7.586
   19   2HB   PHE  -3          HB2       PHE  -3 -10.945 -10.296   7.919
   20    HD1  PHE  -3           HD1      PHE  -3 -10.149  -7.865   5.221
   21    HD2  PHE  -3           HD2      PHE  -3 -11.142 -11.938   6.180
   22    HE1  PHE  -3           HE1      PHE  -3  -9.670  -8.533   2.873
   23    HE2  PHE  -3           HE2      PHE  -3 -10.712 -12.599   3.821
   24    HZ   PHE  -3           HZ       PHE  -3 -10.004 -10.890   2.158
   25    H    LYS  -2           HN       LYS  -2 -13.369  -8.520   5.141
   26    HA   LYS  -2           HA       LYS  -2 -14.908 -10.979   4.849
   27   1HB   LYS  -2          HB1       LYS  -2 -16.216  -8.727   5.585
   28   2HB   LYS  -2          HB2       LYS  -2 -16.189  -8.488   3.838
   29   1HG   LYS  -2          HG1       LYS  -2 -18.090  -9.713   3.909
   30   2HG   LYS  -2          HG2       LYS  -2 -16.962 -11.066   3.920
   31   1HD   LYS  -2          HD1       LYS  -2 -18.017  -9.801   6.451
   32   2HD   LYS  -2          HD2       LYS  -2 -18.842 -11.131   5.640
   33   1HE   LYS  -2          HE1       LYS  -2 -17.268 -12.667   6.265
   34   2HE   LYS  -2          HE2       LYS  -2 -15.952 -11.500   6.220
   35   1HZ   LYS  -2          HZ1       LYS  -2 -16.793 -10.576   8.322
   36   2HZ   LYS  -2          HZ2       LYS  -2 -16.341 -12.197   8.466
   37   3HZ   LYS  -2          HZ3       LYS  -2 -17.976 -11.792   8.366
   38    H    ALA  -1           HN       ALA  -1 -14.454 -11.869   2.984
   39    HA   ALA  -1           HA       ALA  -1 -12.481 -11.007   1.246
   40   1HB   ALA  -1          HB1       ALA  -1 -14.661 -13.055   0.836
   41   2HB   ALA  -1          HB2       ALA  -1 -13.063 -13.333   1.531
   42   3HB   ALA  -1          HB3       ALA  -1 -13.220 -12.897  -0.170
   43    H    GLY   1           HN       GLY   1 -12.445 -10.099  -0.772
   44   1HA   GLY   1          HA1       GLY   1 -14.875  -8.738  -1.742
   45   2HA   GLY   1          HA2       GLY   1 -13.244  -8.106  -1.907
   46    H    SER   2           HN       SER   2 -13.153  -7.949  -4.062
   47    HA   SER   2           HA       SER   2 -12.621 -10.272  -5.645
   48   1HB   SER   2          HB1       SER   2 -14.686  -8.757  -7.048
   49   2HB   SER   2          HB2       SER   2 -14.525 -10.504  -6.830
   50    HG   SER   2           HG       SER   2 -15.331 -10.161  -4.659
   51    H    ALA   3           HN       ALA   3 -11.469  -9.748  -7.518
   52    HA   ALA   3           HA       ALA   3  -9.947  -7.484  -7.604
   53   1HB   ALA   3          HB1       ALA   3  -9.406  -9.517  -8.794
   54   2HB   ALA   3          HB2       ALA   3  -9.368  -8.138  -9.893
   55   3HB   ALA   3          HB3       ALA   3 -10.739  -9.244  -9.917
   56    H    LYS   4           HN       LYS   4 -13.142  -7.813  -9.208
   57    HA   LYS   4           HA       LYS   4 -12.878  -5.275 -10.505
   58   1HB   LYS   4          HB1       LYS   4 -14.067  -7.257 -11.477
   59   2HB   LYS   4          HB2       LYS   4 -15.400  -6.886 -10.383
   60   1HG   LYS   4          HG1       LYS   4 -14.651  -4.462 -11.657
   61   2HG   LYS   4          HG2       LYS   4 -14.779  -5.694 -12.906
   62   1HD   LYS   4          HD1       LYS   4 -17.041  -5.927 -12.630
   63   2HD   LYS   4          HD2       LYS   4 -16.979  -5.534 -10.908
   64   1HE   LYS   4          HE1       LYS   4 -16.512  -3.501 -13.099
   65   2HE   LYS   4          HE2       LYS   4 -18.089  -3.786 -12.361
   66   1HZ   LYS   4          HZ1       LYS   4 -17.459  -2.830 -10.424
   67   2HZ   LYS   4          HZ2       LYS   4 -16.450  -1.961 -11.463
   68   3HZ   LYS   4          HZ3       LYS   4 -15.829  -3.267 -10.588
   69    H    LYS   5           HN       LYS   5 -13.363  -5.727  -7.367
   70    HA   LYS   5           HA       LYS   5 -15.120  -3.364  -7.113
   71   1HB   LYS   5          HB1       LYS   5 -14.666  -5.576  -5.094
   72   2HB   LYS   5          HB2       LYS   5 -15.569  -4.101  -4.771
   73   1HG   LYS   5          HG1       LYS   5 -16.938  -4.884  -6.907
   74   2HG   LYS   5          HG2       LYS   5 -16.327  -6.467  -6.417
   75   1HD   LYS   5          HD1       LYS   5 -17.424  -4.847  -4.214
   76   2HD   LYS   5          HD2       LYS   5 -18.607  -5.303  -5.440
   77   1HE   LYS   5          HE1       LYS   5 -18.511  -6.953  -3.618
   78   2HE   LYS   5          HE2       LYS   5 -18.016  -7.660  -5.156
   79   1HZ   LYS   5          HZ1       LYS   5 -16.614  -8.082  -3.037
   80   2HZ   LYS   5          HZ2       LYS   5 -15.990  -6.535  -3.344
   81   3HZ   LYS   5          HZ3       LYS   5 -15.829  -7.757  -4.505
   82    H    GLY   6           HN       GLY   6 -12.441  -5.005  -5.375
   83   1HA   GLY   6          HA1       GLY   6 -11.496  -2.820  -3.939
   84   2HA   GLY   6          HA2       GLY   6 -10.497  -4.159  -4.480
   85    H    ALA   7           HN       ALA   7 -11.063  -3.522  -7.358
   86    HA   ALA   7           HA       ALA   7  -8.895  -1.845  -7.911
   87   1HB   ALA   7          HB1       ALA   7 -11.160  -2.626  -9.747
   88   2HB   ALA   7          HB2       ALA   7  -9.688  -3.556  -9.467
   89   3HB   ALA   7          HB3       ALA   7  -9.596  -1.976 -10.241
   90    H    THR   8           HN       THR   8 -12.439  -1.047  -8.149
   91    HA   THR   8           HA       THR   8 -12.175   1.553  -9.038
   92    HB   THR   8           HB       THR   8 -14.254   1.832  -7.270
   93    HG1  THR   8           HG1      THR   8 -13.933  -0.469  -6.795
   94   1HG2  THR   8          HG21      THR   8 -14.395   0.600 -10.023
   95   2HG2  THR   8          HG22      THR   8 -14.250   2.329  -9.697
   96   3HG2  THR   8          HG23      THR   8 -15.692   1.452  -9.180
   97    H    LEU   9           HN       LEU   9 -11.638   0.432  -5.741
   98    HA   LEU   9           HA       LEU   9 -11.537   2.956  -4.473
   99   1HB   LEU   9          HB1       LEU   9 -10.899   0.152  -3.760
  100   2HB   LEU   9          HB2       LEU   9  -9.996   1.378  -2.874
  101    HG   LEU   9           HG       LEU   9 -11.945   0.954  -1.584
  102   1HD1  LEU   9          HD11      LEU   9 -11.399   3.332  -1.821
  103   2HD1  LEU   9          HD12      LEU   9 -13.139   3.099  -1.661
  104   3HD1  LEU   9          HD13      LEU   9 -12.437   3.430  -3.244
  105   1HD2  LEU   9          HD21      LEU   9 -13.300  -0.154  -3.347
  106   2HD2  LEU   9          HD22      LEU   9 -13.610   1.428  -4.064
  107   3HD2  LEU   9          HD23      LEU   9 -14.219   1.058  -2.450
  108    H    PHE  10           HN       PHE  10  -8.750   0.784  -4.650
  109    HA   PHE  10           HA       PHE  10  -6.666   2.477  -4.436
  110   1HB   PHE  10          HB1       PHE  10  -6.557   0.004  -4.631
  111   2HB   PHE  10          HB2       PHE  10  -6.778   0.152  -6.367
  112    HD1  PHE  10           HD1      PHE  10  -4.983   1.660  -7.619
  113    HD2  PHE  10           HD2      PHE  10  -4.425  -0.179  -3.771
  114    HE1  PHE  10           HE1      PHE  10  -2.511   1.780  -7.914
  115    HE2  PHE  10           HE2      PHE  10  -1.964   0.059  -4.013
  116    HZ   PHE  10           HZ       PHE  10  -1.000   1.014  -6.092
  117    H    LYS  11           HN       LYS  11  -8.456   1.915  -7.446
  118    HA   LYS  11           HA       LYS  11  -6.751   3.300  -9.189
  119   1HB   LYS  11          HB1       LYS  11  -8.874   1.671  -9.521
  120   2HB   LYS  11          HB2       LYS  11  -9.610   3.224  -9.918
  121   1HG   LYS  11          HG1       LYS  11  -8.550   3.337 -11.881
  122   2HG   LYS  11          HG2       LYS  11  -6.997   2.952 -11.144
  123   1HD   LYS  11          HD1       LYS  11  -9.101   1.008 -12.108
  124   2HD   LYS  11          HD2       LYS  11  -7.496   1.269 -12.791
  125   1HE   LYS  11          HE1       LYS  11  -6.472   0.404 -10.733
  126   2HE   LYS  11          HE2       LYS  11  -8.068   0.171 -10.026
  127   1HZ   LYS  11          HZ1       LYS  11  -8.553  -1.514 -11.627
  128   2HZ   LYS  11          HZ2       LYS  11  -7.054  -1.879 -10.938
  129   3HZ   LYS  11          HZ3       LYS  11  -7.124  -1.202 -12.485
  130    H    THR  12           HN       THR  12  -8.967   4.634  -6.940
  131    HA   THR  12           HA       THR  12  -8.474   7.329  -7.927
  132    HB   THR  12           HB       THR  12 -10.694   6.403  -8.708
  133    HG1  THR  12           HG1      THR  12  -9.963   8.652  -8.577
  134   1HG2  THR  12          HG21      THR  12 -12.618   6.886  -7.203
  135   2HG2  THR  12          HG22      THR  12 -11.480   6.987  -5.858
  136   3HG2  THR  12          HG23      THR  12 -11.672   5.471  -6.739
  137    H    ARG  13           HN       ARG  13  -7.397   5.720  -5.775
  138    HA   ARG  13           HA       ARG  13  -7.635   7.584  -3.533
  139   1HB   ARG  13          HB1       ARG  13  -7.971   4.592  -3.316
  140   2HB   ARG  13          HB2       ARG  13  -7.648   5.629  -1.944
  141   1HG   ARG  13          HG1       ARG  13 -10.073   5.888  -3.706
  142   2HG   ARG  13          HG2       ARG  13 -10.026   4.924  -2.237
  143   1HD   ARG  13          HD1       ARG  13 -11.062   7.123  -1.867
  144   2HD   ARG  13          HD2       ARG  13  -9.582   6.936  -0.918
  145    HE   ARG  13           HE       ARG  13  -9.607   7.962  -3.513
  146   1HH1  ARG  13          HH11      ARG  13  -9.370   8.694  -0.104
  147   2HH1  ARG  13          HH12      ARG  13  -8.305  10.051  -0.177
  148   1HH2  ARG  13          HH21      ARG  13  -7.953  10.023  -3.580
  149   2HH2  ARG  13          HH22      ARG  13  -7.549  10.794  -2.087
  150    H    CYS  14           HN       CYS  14  -5.858   5.085  -5.194
  151    HA   CYS  14           HA       CYS  14  -3.416   5.744  -3.677
  152   1HB   CYS  14          HB1       CYS  14  -3.846   3.110  -5.032
  153   2HB   CYS  14          HB2       CYS  14  -2.730   3.511  -3.746
  154    H    LEU  15           HN       LEU  15  -4.788   5.018  -6.838
  155    HA   LEU  15           HA       LEU  15  -2.594   4.808  -8.457
  156   1HB   LEU  15          HB1       LEU  15  -5.204   4.780  -8.899
  157   2HB   LEU  15          HB2       LEU  15  -4.902   6.431  -9.425
  158    HG   LEU  15           HG       LEU  15  -3.143   5.555 -10.995
  159   1HD1  LEU  15          HD11      LEU  15  -3.149   3.178 -11.554
  160   2HD1  LEU  15          HD12      LEU  15  -4.300   2.866 -10.254
  161   3HD1  LEU  15          HD13      LEU  15  -2.671   3.427  -9.875
  162   1HD2  LEU  15          HD21      LEU  15  -4.785   4.469 -12.584
  163   2HD2  LEU  15          HD22      LEU  15  -5.246   6.059 -11.974
  164   3HD2  LEU  15          HD23      LEU  15  -5.987   4.606 -11.301
  165    H    GLN  16           HN       GLN  16  -4.004   7.842  -7.283
  166    HA   GLN  16           HA       GLN  16  -2.831   9.793  -8.696
  167   1HB   GLN  16          HB1       GLN  16  -2.744  11.068  -6.450
  168   2HB   GLN  16          HB2       GLN  16  -4.291  10.500  -7.059
  169   1HG   GLN  16          HG1       GLN  16  -3.911   8.439  -5.560
  170   2HG   GLN  16          HG2       GLN  16  -2.661   9.410  -4.779
  171   1HE2  GLN  16          HE21      GLN  16  -3.325  11.285  -3.584
  172   2HE2  GLN  16          HE22      GLN  16  -4.973  11.525  -3.137
  173    H    CYS  17           HN       CYS  17  -1.048   7.818  -6.358
  174    HA   CYS  17           HA       CYS  17   1.430   9.210  -7.114
  175   1HB   CYS  17          HB1       CYS  17   1.306   7.866  -4.473
  176   2HB   CYS  17          HB2       CYS  17   2.157   9.312  -4.988
  177    H    HIS  18           HN       HIS  18  -0.004   6.072  -6.353
  178    HA   HIS  18           HA       HIS  18   2.514   4.648  -6.736
  179   1HB   HIS  18          HB1       HIS  18  -0.180   3.919  -5.643
  180   2HB   HIS  18          HB2       HIS  18   0.995   2.683  -6.043
  181    HD1  HIS  18           HD1      HIS  18   3.472   3.142  -4.674
  182    HD2  HIS  18           HD2      HIS  18  -0.115   4.699  -3.179
  183    HE1  HIS  18           HE1      HIS  18   3.851   3.526  -2.196
  184    H    THR  19           HN       THR  19   2.004   2.358  -7.630
  185    HA   THR  19           HA       THR  19   0.403   2.304 -10.058
  186    HB   THR  19           HB       THR  19   2.681   1.091 -10.930
  187    HG1  THR  19           HG1      THR  19   4.328   2.686 -10.493
  188   1HG2  THR  19          HG21      THR  19   1.896   3.987 -11.250
  189   2HG2  THR  19          HG22      THR  19   1.416   2.640 -12.281
  190   3HG2  THR  19          HG23      THR  19   3.100   3.160 -12.237
  191    H    VAL  20           HN       VAL  20  -0.763   0.443 -10.047
  192    HA   VAL  20           HA       VAL  20  -0.238  -1.657  -8.161
  193    HB   VAL  20           HB       VAL  20  -2.458  -0.578  -9.162
  194   1HG1  VAL  20          HG11      VAL  20  -2.302  -1.594 -11.347
  195   2HG1  VAL  20          HG12      VAL  20  -3.713  -2.195 -10.473
  196   3HG1  VAL  20          HG13      VAL  20  -2.273  -3.203 -10.619
  197   1HG2  VAL  20          HG21      VAL  20  -2.456  -1.771  -7.105
  198   2HG2  VAL  20          HG22      VAL  20  -2.220  -3.311  -7.929
  199   3HG2  VAL  20          HG23      VAL  20  -3.734  -2.432  -8.124
  200    H    GLU  21           HN       GLU  21   0.499  -1.241 -11.458
  201    HA   GLU  21           HA       GLU  21   1.242  -4.068 -11.822
  202   1HB   GLU  21          HB1       GLU  21   1.318  -3.149 -14.337
  203   2HB   GLU  21          HB2       GLU  21  -0.163  -3.761 -13.628
  204   1HG   GLU  21          HG1       GLU  21  -0.399  -1.629 -14.937
  205   2HG   GLU  21          HG2       GLU  21  -1.024  -1.566 -13.292
  206    H    LYS  22           HN       LYS  22   3.212  -3.958 -13.738
  207    HA   LYS  22           HA       LYS  22   5.173  -2.182 -12.502
  208   1HB   LYS  22          HB1       LYS  22   5.260  -4.914 -13.222
  209   2HB   LYS  22          HB2       LYS  22   6.483  -4.060 -14.177
  210   1HG   LYS  22          HG1       LYS  22   7.667  -3.392 -12.345
  211   2HG   LYS  22          HG2       LYS  22   6.230  -3.265 -11.331
  212   1HD   LYS  22          HD1       LYS  22   6.158  -5.644 -11.037
  213   2HD   LYS  22          HD2       LYS  22   7.460  -5.871 -12.205
  214   1HE   LYS  22          HE1       LYS  22   8.402  -6.103 -10.011
  215   2HE   LYS  22          HE2       LYS  22   8.975  -4.589 -10.686
  216   1HZ   LYS  22          HZ1       LYS  22   7.190  -3.482  -9.309
  217   2HZ   LYS  22          HZ2       LYS  22   8.443  -4.191  -8.427
  218   3HZ   LYS  22          HZ3       LYS  22   6.949  -4.970  -8.540
  219    H    GLY  23           HN       GLY  23   3.341  -1.373 -14.848
  220   1HA   GLY  23          HA1       GLY  23   5.380  -0.733 -16.867
  221   2HA   GLY  23          HA2       GLY  23   3.645  -0.537 -17.056
  222    H    GLY  24           HN       GLY  24   3.536   0.834 -14.361
  223   1HA   GLY  24          HA1       GLY  24   4.003   3.541 -15.253
  224   2HA   GLY  24          HA2       GLY  24   3.189   3.037 -13.781
  225    HA   PRO  25           HA       PRO  25   8.019   3.688 -13.186
  226   1HB   PRO  25          HB1       PRO  25   8.335   6.412 -13.447
  227   2HB   PRO  25          HB2       PRO  25   8.771   5.234 -14.688
  228   1HG   PRO  25          HG1       PRO  25   6.316   6.924 -14.456
  229   2HG   PRO  25          HG2       PRO  25   7.263   6.512 -15.898
  230   1HD   PRO  25          HD1       PRO  25   4.934   5.289 -15.331
  231   2HD   PRO  25          HD2       PRO  25   6.282   4.424 -16.099
  232    H    HIS  26           HN       HIS  26   8.846   4.622 -11.223
  233    HA   HIS  26           HA       HIS  26   7.024   4.843  -9.113
  234   1HB   HIS  26          HB1       HIS  26   9.908   5.733  -9.343
  235   2HB   HIS  26          HB2       HIS  26   9.023   5.641  -7.830
  236    HD2  HIS  26           HD2      HIS  26  11.147   3.586 -10.154
  237    HE1  HIS  26           HE1      HIS  26   9.644   0.840  -7.286
  238    HE2  HIS  26           HE2      HIS  26  11.336   1.185  -9.146
  239    H    LYS  27           HN       LYS  27   5.522   6.489  -9.093
  240    HA   LYS  27           HA       LYS  27   6.209   9.174  -9.920
  241   1HB   LYS  27          HB1       LYS  27   3.650   7.739  -9.271
  242   2HB   LYS  27          HB2       LYS  27   3.685   9.485  -9.418
  243   1HG   LYS  27          HG1       LYS  27   4.264   9.412 -11.695
  244   2HG   LYS  27          HG2       LYS  27   4.787   7.727 -11.592
  245   1HD   LYS  27          HD1       LYS  27   1.943   8.765 -11.423
  246   2HD   LYS  27          HD2       LYS  27   2.645   7.792 -12.722
  247   1HE   LYS  27          HE1       LYS  27   2.683   5.858 -11.437
  248   2HE   LYS  27          HE2       LYS  27   2.697   6.749  -9.914
  249   1HZ   LYS  27          HZ1       LYS  27   0.569   5.720 -10.220
  250   2HZ   LYS  27          HZ2       LYS  27   0.388   6.420 -11.747
  251   3HZ   LYS  27          HZ3       LYS  27   0.381   7.400 -10.370
  252    H    VAL  28           HN       VAL  28   4.003   9.837  -7.660
  253    HA   VAL  28           HA       VAL  28   5.801  10.977  -5.785
  254    HB   VAL  28           HB       VAL  28   2.852  10.489  -5.372
  255   1HG1  VAL  28          HG11      VAL  28   2.981  12.487  -3.950
  256   2HG1  VAL  28          HG12      VAL  28   4.714  12.595  -4.257
  257   3HG1  VAL  28          HG13      VAL  28   4.060  11.217  -3.372
  258   1HG2  VAL  28          HG21      VAL  28   4.107  12.937  -6.633
  259   2HG2  VAL  28          HG22      VAL  28   2.393  12.664  -6.327
  260   3HG2  VAL  28          HG23      VAL  28   3.239  11.688  -7.527
  261    H    GLY  29           HN       GLY  29   4.341   7.888  -6.088
  262   1HA   GLY  29          HA1       GLY  29   5.440   6.972  -3.511
  263   2HA   GLY  29          HA2       GLY  29   3.871   6.436  -4.088
  264    HA   PRO  30           HA       PRO  30   7.586   3.846  -5.796
  265   1HB   PRO  30          HB1       PRO  30   7.645   1.812  -4.011
  266   2HB   PRO  30          HB2       PRO  30   8.605   3.283  -3.824
  267   1HG   PRO  30          HG1       PRO  30   5.986   2.560  -2.557
  268   2HG   PRO  30          HG2       PRO  30   7.428   3.276  -1.810
  269   1HD   PRO  30          HD1       PRO  30   5.293   4.762  -2.519
  270   2HD   PRO  30          HD2       PRO  30   6.952   5.386  -2.618
  271    H    ASN  31           HN       ASN  31   7.451   1.677  -6.725
  272    HA   ASN  31           HA       ASN  31   4.825   1.017  -7.604
  273   1HB   ASN  31          HB1       ASN  31   6.903   0.846  -8.979
  274   2HB   ASN  31          HB2       ASN  31   7.438  -0.490  -7.969
  275   1HD2  ASN  31          HD21      ASN  31   4.999   0.479 -10.340
  276   2HD2  ASN  31          HD22      ASN  31   4.599  -1.142 -10.805
  277    H    LEU  32           HN       LEU  32   3.384  -0.287  -6.624
  278    HA   LEU  32           HA       LEU  32   3.995  -1.747  -4.203
  279   1HB   LEU  32          HB1       LEU  32   1.386  -1.057  -5.559
  280   2HB   LEU  32          HB2       LEU  32   1.521  -1.863  -4.009
  281    HG   LEU  32           HG       LEU  32   2.411   0.966  -4.632
  282   1HD1  LEU  32          HD11      LEU  32  -0.058   0.542  -4.396
  283   2HD1  LEU  32          HD12      LEU  32   0.615   1.664  -3.214
  284   3HD1  LEU  32          HD13      LEU  32   0.260   0.002  -2.746
  285   1HD2  LEU  32          HD21      LEU  32   3.894  -0.102  -2.961
  286   2HD2  LEU  32          HD22      LEU  32   2.479  -0.489  -1.982
  287   3HD2  LEU  32          HD23      LEU  32   2.919   1.194  -2.268
  288    H    HIS  33           HN       HIS  33   3.642  -2.554  -7.481
  289    HA   HIS  33           HA       HIS  33   2.404  -5.047  -7.527
  290   1HB   HIS  33          HB1       HIS  33   2.988  -3.493  -9.453
  291   2HB   HIS  33          HB2       HIS  33   4.631  -4.119  -9.345
  292    HD2  HIS  33           HD2      HIS  33   1.502  -6.372  -8.989
  293    HE1  HIS  33           HE1      HIS  33   3.380  -7.393 -12.662
  294    HE2  HIS  33           HE2      HIS  33   1.567  -8.042 -11.002
  295    H    GLY  34           HN       GLY  34   3.153  -6.298  -5.794
  296   1HA   GLY  34          HA1       GLY  34   4.385  -8.330  -5.433
  297   2HA   GLY  34          HA2       GLY  34   5.787  -7.562  -6.148
  298    H    ILE  35           HN       ILE  35   3.686  -6.216  -3.523
  299    HA   ILE  35           HA       ILE  35   6.110  -5.909  -1.958
  300    HB   ILE  35           HB       ILE  35   4.762  -4.695  -0.303
  301   1HG1  ILE  35          HG11      ILE  35   2.490  -5.375  -2.112
  302   2HG1  ILE  35          HG12      ILE  35   2.511  -5.130  -0.367
  303   1HG2  ILE  35          HG21      ILE  35   4.620  -2.675  -1.680
  304   2HG2  ILE  35          HG22      ILE  35   4.751  -3.665  -3.132
  305   3HG2  ILE  35          HG23      ILE  35   6.088  -3.604  -1.985
  306   1HD1  ILE  35          HD11      ILE  35   2.574  -2.968  -2.480
  307   2HD1  ILE  35          HD12      ILE  35   2.687  -2.685  -0.742
  308   3HD1  ILE  35          HD13      ILE  35   1.217  -3.376  -1.427
  309    H    PHE  36           HN       PHE  36   3.302  -8.011  -1.856
  310    HA   PHE  36           HA       PHE  36   3.432  -8.866   0.786
  311   1HB   PHE  36          HB1       PHE  36   2.478 -10.319  -1.683
  312   2HB   PHE  36          HB2       PHE  36   2.267 -10.932  -0.043
  313    HD1  PHE  36           HD1      PHE  36   1.470  -8.753   1.572
  314    HD2  PHE  36           HD2      PHE  36   0.463  -9.526  -2.539
  315    HE1  PHE  36           HE1      PHE  36  -0.578  -7.363   1.820
  316    HE2  PHE  36           HE2      PHE  36  -1.587  -8.137  -2.294
  317    HZ   PHE  36           HZ       PHE  36  -2.102  -7.046  -0.119
  318    H    GLY  37           HN       GLY  37   5.031  -9.662   1.827
  319   1HA   GLY  37          HA1       GLY  37   6.422 -11.526   2.400
  320   2HA   GLY  37          HA2       GLY  37   6.800 -11.725   0.699
  321    H    ARG  38           HN       ARG  38   7.013  -8.505   0.976
  322    HA   ARG  38           HA       ARG  38   9.897  -8.506   1.539
  323   1HB   ARG  38          HB1       ARG  38   8.071  -6.798  -0.141
  324   2HB   ARG  38          HB2       ARG  38   9.609  -6.147   0.410
  325   1HG   ARG  38          HG1       ARG  38  10.842  -7.538  -0.938
  326   2HG   ARG  38          HG2       ARG  38   9.604  -8.796  -0.957
  327   1HD   ARG  38          HD1       ARG  38   9.480  -7.927  -3.120
  328   2HD   ARG  38          HD2       ARG  38   8.197  -7.055  -2.280
  329    HE   ARG  38           HE       ARG  38  10.511  -6.275  -2.031
  330   1HH1  ARG  38          HH21      ARG  38   7.841  -6.009  -4.194
  331   2HH1  ARG  38          HH22      ARG  38   8.034  -4.353  -4.459
  332   1HH2  ARG  38          HH11      ARG  38  11.026  -3.756  -3.255
  333   2HH2  ARG  38          HH12      ARG  38  10.029  -3.608  -4.638
  334    H    HIS  39           HN       HIS  39  10.711  -6.462   2.548
  335    HA   HIS  39           HA       HIS  39   9.087  -5.822   4.895
  336   1HB   HIS  39          HB1       HIS  39  12.006  -5.174   4.386
  337   2HB   HIS  39          HB2       HIS  39  11.157  -5.130   5.934
  338    HD2  HIS  39           HD2      HIS  39  10.364  -7.562   6.972
  339    HE1  HIS  39           HE1      HIS  39  12.954  -9.924   4.561
  340    HE2  HIS  39           HE2      HIS  39  11.367  -9.940   6.544
  341    H    SER  40           HN       SER  40   9.057  -3.537   5.660
  342    HA   SER  40           HA       SER  40   8.235  -1.743   3.687
  343   1HB   SER  40          HB1       SER  40   9.241  -0.658   6.285
  344   2HB   SER  40          HB2       SER  40   7.847  -0.165   5.335
  345    HG   SER  40           HG       SER  40   7.140  -2.468   5.986
  346    H    GLY  41           HN       GLY  41   9.220  -0.311   2.439
  347   1HA   GLY  41          HA1       GLY  41  10.830   1.238   1.778
  348   2HA   GLY  41          HA2       GLY  41  11.840   0.746   3.115
  349    H    GLN  42           HN       GLN  42  10.651  -1.411   0.454
  350    HA   GLN  42           HA       GLN  42  13.454  -1.647  -0.381
  351   1HB   GLN  42          HB1       GLN  42  11.516  -3.942  -0.233
  352   2HB   GLN  42          HB2       GLN  42  13.193  -4.032  -0.757
  353   1HG   GLN  42          HG1       GLN  42  13.975  -3.409   1.441
  354   2HG   GLN  42          HG2       GLN  42  12.327  -3.118   1.989
  355   1HE2  GLN  42          HE21      GLN  42  14.274  -4.957   3.153
  356   2HE2  GLN  42          HE22      GLN  42  13.590  -6.536   3.030
  357    H    ALA  43           HN       ALA  43  11.317  -0.026  -1.808
  358    HA   ALA  43           HA       ALA  43  10.595  -1.260  -4.210
  359   1HB   ALA  43          HB1       ALA  43  11.113   1.673  -3.783
  360   2HB   ALA  43          HB2       ALA  43   9.639   0.827  -3.315
  361   3HB   ALA  43          HB3       ALA  43  10.087   0.943  -5.016
  362    H    GLU  44           HN       GLU  44  11.508  -1.590  -6.152
  363    HA   GLU  44           HA       GLU  44  14.304  -1.539  -6.485
  364   1HB   GLU  44          HB1       GLU  44  12.431  -2.052  -8.785
  365   2HB   GLU  44          HB2       GLU  44  13.978  -2.809  -8.418
  366   1HG   GLU  44          HG1       GLU  44  12.536  -4.502  -7.833
  367   2HG   GLU  44          HG2       GLU  44  12.742  -3.698  -6.289
  368    H    GLY  45           HN       GLY  45  14.862   0.660  -6.176
  369   1HA   GLY  45          HA1       GLY  45  16.063   2.316  -7.432
  370   2HA   GLY  45          HA2       GLY  45  14.791   2.285  -8.632
  371    H    TYR  46           HN       TYR  46  13.694   2.411  -5.362
  372    HA   TYR  46           HA       TYR  46  13.365   5.316  -5.425
  373   1HB   TYR  46          HB1       TYR  46  11.341   4.341  -6.300
  374   2HB   TYR  46          HB2       TYR  46  11.186   3.310  -4.885
  375    HD1  TYR  46           HD1      TYR  46  10.524   6.582  -6.312
  376    HD2  TYR  46           HD2      TYR  46  10.758   4.364  -2.641
  377    HE1  TYR  46           HE1      TYR  46   9.079   8.284  -5.207
  378    HE2  TYR  46           HE2      TYR  46   9.223   5.994  -1.547
  379    HH   TYR  46           HH       TYR  46   7.541   8.446  -3.380
  380    H    SER  47           HN       SER  47  13.595   6.400  -3.559
  381    HA   SER  47           HA       SER  47  14.603   4.999  -1.233
  382   1HB   SER  47          HB1       SER  47  14.499   7.831  -0.830
  383   2HB   SER  47          HB2       SER  47  15.912   6.792  -1.029
  384    HG   SER  47           HG       SER  47  16.130   7.583  -2.952
  385    H    TYR  48           HN       TYR  48  13.883   5.209   0.826
  386    HA   TYR  48           HA       TYR  48  11.148   6.103   1.388
  387   1HB   TYR  48          HB1       TYR  48  12.756   3.725   2.312
  388   2HB   TYR  48          HB2       TYR  48  11.269   4.225   3.115
  389    HD1  TYR  48           HD1      TYR  48   9.135   3.808   2.179
  390    HD2  TYR  48           HD2      TYR  48  12.682   2.970  -0.102
  391    HE1  TYR  48           HE1      TYR  48   7.788   2.431   0.606
  392    HE2  TYR  48           HE2      TYR  48  11.347   1.591  -1.681
  393    HH   TYR  48           HH       TYR  48   8.360   0.359  -0.892
  394    H    THR  49           HN       THR  49  10.763   6.704   3.774
  395    HA   THR  49           HA       THR  49  12.644   8.668   4.669
  396    HB   THR  49           HB       THR  49  11.040   8.762   6.694
  397    HG1  THR  49           HG1      THR  49   9.256   7.518   4.919
  398   1HG2  THR  49          HG21      THR  49  10.010   9.451   3.953
  399   2HG2  THR  49          HG22      THR  49  11.121  10.430   4.911
  400   3HG2  THR  49          HG23      THR  49   9.474  10.151   5.481
  401    H    ASP  50           HN       ASP  50  13.339   8.883   6.944
  402    HA   ASP  50           HA       ASP  50  14.994   6.848   7.824
  403   1HB   ASP  50          HB1       ASP  50  15.558   8.991   8.518
  404   2HB   ASP  50          HB2       ASP  50  13.912   9.375   9.016
  405    H    ALA  51           HN       ALA  51  11.646   7.476   8.688
  406    HA   ALA  51           HA       ALA  51  11.604   5.650  10.913
  407   1HB   ALA  51          HB1       ALA  51   9.318   6.424  11.208
  408   2HB   ALA  51          HB2       ALA  51   9.382   7.255   9.653
  409   3HB   ALA  51          HB3       ALA  51  10.412   7.790  10.979
  410    H    ASN  52           HN       ASN  52  10.500   5.511   7.509
  411    HA   ASN  52           HA       ASN  52   8.913   3.153   7.936
  412   1HB   ASN  52          HB1       ASN  52   8.097   4.457   6.203
  413   2HB   ASN  52          HB2       ASN  52   9.698   4.804   5.564
  414   1HD2  ASN  52          HD21      ASN  52   6.942   2.778   5.256
  415   2HD2  ASN  52          HD22      ASN  52   7.602   1.840   3.965
  416    H    ILE  53           HN       ILE  53  12.193   3.766   6.761
  417    HA   ILE  53           HA       ILE  53  12.790   1.117   5.984
  418    HB   ILE  53           HB       ILE  53  14.627   3.352   6.800
  419   1HG1  ILE  53          HG11      ILE  53  13.749   2.468   4.028
  420   2HG1  ILE  53          HG12      ILE  53  13.107   3.870   4.880
  421   1HG2  ILE  53          HG21      ILE  53  16.323   2.140   5.384
  422   2HG2  ILE  53          HG22      ILE  53  15.218   0.765   5.345
  423   3HG2  ILE  53          HG23      ILE  53  15.894   1.308   6.880
  424   1HD1  ILE  53          HD11      ILE  53  16.017   3.536   4.140
  425   2HD1  ILE  53          HD12      ILE  53  15.239   4.980   4.790
  426   3HD1  ILE  53          HD13      ILE  53  14.838   4.417   3.168
  427    H    LYS  54           HN       LYS  54  14.228   2.767   8.855
  428    HA   LYS  54           HA       LYS  54  15.026   0.774  10.418
  429   1HB   LYS  54          HB1       LYS  54  13.576   3.299  11.063
  430   2HB   LYS  54          HB2       LYS  54  13.968   2.176  12.368
  431   1HG   LYS  54          HG1       LYS  54  16.351   2.199  11.193
  432   2HG   LYS  54          HG2       LYS  54  15.791   3.780  10.639
  433   1HD   LYS  54          HD1       LYS  54  15.166   3.533  13.415
  434   2HD   LYS  54          HD2       LYS  54  16.864   3.091  13.181
  435   1HE   LYS  54          HE1       LYS  54  16.732   5.483  13.539
  436   2HE   LYS  54          HE2       LYS  54  17.174   5.180  11.856
  437   1HZ   LYS  54          HZ1       LYS  54  14.795   5.458  11.297
  438   2HZ   LYS  54          HZ2       LYS  54  15.523   6.860  11.913
  439   3HZ   LYS  54          HZ3       LYS  54  14.509   5.930  12.900
  440    H    LYS  55           HN       LYS  55  11.753   1.043   9.446
  441    HA   LYS  55           HA       LYS  55  10.611  -0.470  11.639
  442   1HB   LYS  55          HB1       LYS  55   9.251   1.252  10.877
  443   2HB   LYS  55          HB2       LYS  55   9.555   0.891   9.194
  444   1HG   LYS  55          HG1       LYS  55   7.802  -0.472   9.048
  445   2HG   LYS  55          HG2       LYS  55   8.134  -1.234  10.593
  446   1HD   LYS  55          HD1       LYS  55   6.616   1.332  10.106
  447   2HD   LYS  55          HD2       LYS  55   5.959  -0.205  10.664
  448   1HE   LYS  55          HE1       LYS  55   7.521   0.060  12.682
  449   2HE   LYS  55          HE2       LYS  55   7.725   1.731  12.153
  450   1HZ   LYS  55          HZ1       LYS  55   5.939   1.338  13.855
  451   2HZ   LYS  55          HZ2       LYS  55   5.069   0.519  12.663
  452   3HZ   LYS  55          HZ3       LYS  55   5.434   2.156  12.458
  453    H    ASN  56           HN       ASN  56  11.365  -1.101   8.264
  454    HA   ASN  56           HA       ASN  56  11.098  -2.822   6.844
  455   1HB   ASN  56          HB1       ASN  56  13.016  -3.443   8.949
  456   2HB   ASN  56          HB2       ASN  56  12.454  -4.868   8.104
  457   1HD2  ASN  56          HD21      ASN  56  13.730  -1.571   7.271
  458   2HD2  ASN  56          HD22      ASN  56  14.358  -2.270   5.842
  459    H    VAL  57           HN       VAL  57   8.659  -2.725   8.152
  460    HA   VAL  57           HA       VAL  57   7.886  -5.201   9.297
  461    HB   VAL  57           HB       VAL  57   6.701  -2.729   9.003
  462   1HG1  VAL  57          HG11      VAL  57   4.994  -4.726   7.523
  463   2HG1  VAL  57          HG12      VAL  57   5.578  -3.176   6.919
  464   3HG1  VAL  57          HG13      VAL  57   4.397  -3.223   8.228
  465   1HG2  VAL  57          HG21      VAL  57   5.546  -5.318  10.011
  466   2HG2  VAL  57          HG22      VAL  57   5.013  -3.699  10.465
  467   3HG2  VAL  57          HG23      VAL  57   6.633  -4.246  10.895
  468    H    LEU  58           HN       LEU  58   7.275  -7.095   8.389
  469    HA   LEU  58           HA       LEU  58   7.627  -7.369   5.541
  470   1HB   LEU  58          HB1       LEU  58   8.512  -9.034   7.190
  471   2HB   LEU  58          HB2       LEU  58   6.854  -9.501   7.542
  472    HG   LEU  58           HG       LEU  58   7.781  -9.571   4.689
  473   1HD1  LEU  58          HD11      LEU  58   9.567 -10.721   5.867
  474   2HD1  LEU  58          HD12      LEU  58   8.556 -11.898   5.028
  475   3HD1  LEU  58          HD13      LEU  58   8.391 -11.679   6.770
  476   1HD2  LEU  58          HD21      LEU  58   6.019 -11.508   6.192
  477   2HD2  LEU  58          HD22      LEU  58   6.193 -11.330   4.446
  478   3HD2  LEU  58          HD23      LEU  58   5.392 -10.071   5.384
  479    H    TRP  59           HN       TRP  59   6.040  -6.515   4.384
  480    HA   TRP  59           HA       TRP  59   3.358  -6.235   5.034
  481   1HB   TRP  59          HB1       TRP  59   4.615  -6.503   2.303
  482   2HB   TRP  59          HB2       TRP  59   3.010  -5.872   2.620
  483    HD1  TRP  59           HD1      TRP  59   6.313  -4.720   1.846
  484    HE1  TRP  59           HE1      TRP  59   6.646  -2.253   2.520
  485    HE3  TRP  59           HE3      TRP  59   2.204  -4.059   4.819
  486    HZ2  TRP  59           HZ2      TRP  59   5.434  -0.306   4.229
  487    HZ3  TRP  59           HZ3      TRP  59   1.807  -1.891   5.923
  488    HH2  TRP  59           HH2      TRP  59   3.389  -0.016   5.643
  489    H    ASP  60           HN       ASP  60   2.078  -7.792   5.568
  490    HA   ASP  60           HA       ASP  60   1.865 -10.319   4.106
  491   1HB   ASP  60          HB1       ASP  60   2.339 -11.236   6.094
  492   2HB   ASP  60          HB2       ASP  60   2.237  -9.682   6.899
  493    H    GLU  61           HN       GLU  61  -0.523 -11.225   4.951
  494    HA   GLU  61           HA       GLU  61  -2.391  -9.761   3.394
  495   1HB   GLU  61          HB1       GLU  61  -2.285 -12.334   3.963
  496   2HB   GLU  61          HB2       GLU  61  -3.281 -11.869   5.339
  497   1HG   GLU  61          HG1       GLU  61  -4.983 -12.254   3.899
  498   2HG   GLU  61          HG2       GLU  61  -4.618 -10.616   3.350
  499    H    ASN  62           HN       ASN  62  -2.336 -10.425   6.920
  500    HA   ASN  62           HA       ASN  62  -4.364  -8.495   7.488
  501   1HB   ASN  62          HB1       ASN  62  -4.156 -10.504   8.806
  502   2HB   ASN  62          HB2       ASN  62  -2.507 -10.101   9.251
  503   1HD2  ASN  62          HD21      ASN  62  -2.166  -8.442  10.772
  504   2HD2  ASN  62          HD22      ASN  62  -3.438  -7.896  11.806
  505    H    ASN  63           HN       ASN  63  -0.791  -8.480   7.960
  506    HA   ASN  63           HA       ASN  63  -0.472  -6.061   9.206
  507   1HB   ASN  63          HB1       ASN  63   1.346  -7.566   8.923
  508   2HB   ASN  63          HB2       ASN  63   1.256  -7.463   7.176
  509   1HD2  ASN  63          HD21      ASN  63   2.355  -5.801  10.094
  510   2HD2  ASN  63          HD22      ASN  63   3.092  -4.555   9.148
  511    H    MET  64           HN       MET  64  -0.836  -6.390   5.609
  512    HA   MET  64           HA       MET  64  -0.328  -3.737   4.962
  513   1HB   MET  64          HB1       MET  64  -0.549  -5.487   3.298
  514   2HB   MET  64          HB2       MET  64  -2.262  -5.650   3.655
  515   1HG   MET  64          HG1       MET  64  -2.587  -3.309   2.904
  516   2HG   MET  64          HG2       MET  64  -0.897  -3.256   2.442
  517   1HE   MET  64          HE1       MET  64  -3.472  -6.184   2.057
  518   2HE   MET  64          HE2       MET  64  -4.051  -5.959   0.405
  519   3HE   MET  64          HE3       MET  64  -4.464  -4.781   1.651
  520    H    SER  65           HN       SER  65  -3.501  -5.097   5.946
  521    HA   SER  65           HA       SER  65  -4.967  -2.710   5.836
  522   1HB   SER  65          HB1       SER  65  -5.949  -4.361   7.960
  523   2HB   SER  65          HB2       SER  65  -6.643  -4.062   6.372
  524    HG   SER  65           HG       SER  65  -4.952  -6.132   7.224
  525    H    GLU  66           HN       GLU  66  -3.019  -4.029   8.491
  526    HA   GLU  66           HA       GLU  66  -3.699  -2.355  10.571
  527   1HB   GLU  66          HB1       GLU  66  -2.092  -4.361  10.490
  528   2HB   GLU  66          HB2       GLU  66  -0.860  -3.205   9.992
  529   1HG   GLU  66          HG1       GLU  66  -1.099  -1.971  12.048
  530   2HG   GLU  66          HG2       GLU  66  -2.466  -2.972  12.536
  531    H    TYR  67           HN       TYR  67  -1.281  -1.794   8.048
  532    HA   TYR  67           HA       TYR  67  -0.599   0.873   8.804
  533   1HB   TYR  67          HB1       TYR  67   1.090  -0.413   7.812
  534   2HB   TYR  67          HB2       TYR  67   0.047  -0.938   6.504
  535    HD1  TYR  67           HD1      TYR  67  -0.024   0.242   4.441
  536    HD2  TYR  67           HD2      TYR  67   1.895   1.975   7.872
  537    HE1  TYR  67           HE1      TYR  67   1.067   1.931   2.971
  538    HE2  TYR  67           HE2      TYR  67   3.036   3.636   6.416
  539    HH   TYR  67           HH       TYR  67   2.235   4.074   3.095
  540    H    LEU  68           HN       LEU  68  -2.672  -0.472   6.166
  541    HA   LEU  68           HA       LEU  68  -3.087   1.969   4.859
  542   1HB   LEU  68          HB1       LEU  68  -4.934  -0.403   5.042
  543   2HB   LEU  68          HB2       LEU  68  -5.099   0.916   3.897
  544    HG   LEU  68           HG       LEU  68  -2.917  -1.170   4.001
  545   1HD1  LEU  68          HD11      LEU  68  -3.791  -1.739   1.834
  546   2HD1  LEU  68          HD12      LEU  68  -4.822  -0.309   1.815
  547   3HD1  LEU  68          HD13      LEU  68  -5.155  -1.620   2.946
  548   1HD2  LEU  68          HD21      LEU  68  -1.883   1.048   3.482
  549   2HD2  LEU  68          HD22      LEU  68  -3.041   1.244   2.167
  550   3HD2  LEU  68          HD23      LEU  68  -1.854  -0.059   2.108
  551    H    THR  69           HN       THR  69  -4.916   0.650   7.637
  552    HA   THR  69           HA       THR  69  -7.052   2.442   7.618
  553    HB   THR  69           HB       THR  69  -5.875   1.505  10.204
  554    HG1  THR  69           HG1      THR  69  -5.840  -0.330   8.993
  555   1HG2  THR  69          HG21      THR  69  -8.698   1.823   9.161
  556   2HG2  THR  69          HG22      THR  69  -7.918   2.787  10.415
  557   3HG2  THR  69          HG23      THR  69  -8.286   1.088  10.710
  558    H    ASN  70           HN       ASN  70  -3.752   2.977   8.719
  559    HA   ASN  70           HA       ASN  70  -4.096   5.790   8.672
  560   1HB   ASN  70          HB1       ASN  70  -5.101   5.079  10.933
  561   2HB   ASN  70          HB2       ASN  70  -3.442   4.764  11.429
  562   1HD2  ASN  70          HD21      ASN  70  -5.094   6.682  12.670
  563   2HD2  ASN  70          HD22      ASN  70  -4.197   8.141  12.438
  564    HA   PRO  71           HA       PRO  71   0.204   4.399   7.693
  565   1HB   PRO  71          HB1       PRO  71   0.640   6.499   5.971
  566   2HB   PRO  71          HB2       PRO  71  -0.040   4.941   5.491
  567   1HG   PRO  71          HG1       PRO  71  -1.442   7.511   6.111
  568   2HG   PRO  71          HG2       PRO  71  -1.760   6.346   4.812
  569   1HD   PRO  71          HD1       PRO  71  -3.278   6.434   7.023
  570   2HD   PRO  71          HD2       PRO  71  -2.894   4.896   6.222
  571    H    LYS  72           HN       LYS  72  -0.915   7.729   8.289
  572    HA   LYS  72           HA       LYS  72   1.527   8.849   9.090
  573   1HB   LYS  72          HB1       LYS  72  -1.236   9.672   8.990
  574   2HB   LYS  72          HB2       LYS  72  -0.496  10.212  10.488
  575   1HG   LYS  72          HG1       LYS  72   0.323  11.948   9.381
  576   2HG   LYS  72          HG2       LYS  72   1.365  10.836   8.501
  577   1HD   LYS  72          HD1       LYS  72   0.224  12.170   6.886
  578   2HD   LYS  72          HD2       LYS  72  -0.498  10.562   6.829
  579   1HE   LYS  72          HE1       LYS  72  -2.445  11.268   7.922
  580   2HE   LYS  72          HE2       LYS  72  -1.682  12.724   8.541
  581   1HZ   LYS  72          HZ1       LYS  72  -3.256  13.195   6.767
  582   2HZ   LYS  72          HZ2       LYS  72  -2.375  12.226   5.700
  583   3HZ   LYS  72          HZ3       LYS  72  -1.680  13.635   6.316
  584    H    LYS  73           HN       LYS  73  -0.896   7.083  10.950
  585    HA   LYS  73           HA       LYS  73   0.434   7.652  13.452
  586   1HB   LYS  73          HB1       LYS  73  -2.007   7.425  13.381
  587   2HB   LYS  73          HB2       LYS  73  -1.841   5.747  12.886
  588   1HG   LYS  73          HG1       LYS  73  -2.370   5.899  15.258
  589   2HG   LYS  73          HG2       LYS  73  -0.772   5.204  15.020
  590   1HD   LYS  73          HD1       LYS  73  -0.152   7.844  15.312
  591   2HD   LYS  73          HD2       LYS  73  -1.572   7.718  16.346
  592   1HE   LYS  73          HE1       LYS  73   0.232   7.284  17.781
  593   2HE   LYS  73          HE2       LYS  73  -0.410   5.689  17.398
  594   1HZ   LYS  73          HZ1       LYS  73   1.356   5.668  15.584
  595   2HZ   LYS  73          HZ2       LYS  73   1.873   5.464  17.180
  596   3HZ   LYS  73          HZ3       LYS  73   2.063   6.961  16.422
  597    H    TYR  74           HN       TYR  74   0.277   4.886  11.246
  598    HA   TYR  74           HA       TYR  74   1.709   3.061  12.858
  599   1HB   TYR  74          HB1       TYR  74   0.244   2.654  10.784
  600   2HB   TYR  74          HB2       TYR  74   1.699   3.016   9.856
  601    HD1  TYR  74           HD1      TYR  74   2.881   1.109   9.125
  602    HD2  TYR  74           HD2      TYR  74   0.852   1.086  12.915
  603    HE1  TYR  74           HE1      TYR  74   3.602  -1.254   9.496
  604    HE2  TYR  74           HE2      TYR  74   1.553  -1.262  13.296
  605    HH   TYR  74           HH       TYR  74   2.204  -3.204  11.987
  606    H    ILE  75           HN       ILE  75   2.797   5.308  10.380
  607    HA   ILE  75           HA       ILE  75   5.581   5.003  11.249
  608    HB   ILE  75           HB       ILE  75   4.750   5.346   8.358
  609   1HG1  ILE  75          HG11      ILE  75   5.849   2.860   9.724
  610   2HG1  ILE  75          HG12      ILE  75   4.179   3.060   9.212
  611   1HG2  ILE  75          HG21      ILE  75   7.408   4.956   9.752
  612   2HG2  ILE  75          HG22      ILE  75   6.887   6.340   8.791
  613   3HG2  ILE  75          HG23      ILE  75   7.197   4.791   8.008
  614   1HD1  ILE  75          HD11      ILE  75   5.339   1.688   7.611
  615   2HD1  ILE  75          HD12      ILE  75   6.611   2.896   7.427
  616   3HD1  ILE  75          HD13      ILE  75   4.979   3.242   6.857
  617    HA   PRO  76           HA       PRO  76   4.223   9.374  11.751
  618   1HB   PRO  76          HB1       PRO  76   5.911   9.855  13.840
  619   2HB   PRO  76          HB2       PRO  76   4.299   9.159  14.029
  620   1HG   PRO  76          HG1       PRO  76   6.959   7.795  13.975
  621   2HG   PRO  76          HG2       PRO  76   5.563   7.487  15.024
  622   1HD   PRO  76          HD1       PRO  76   6.144   5.940  12.881
  623   2HD   PRO  76          HD2       PRO  76   4.479   6.233  13.423
  624    H    GLY  77           HN       GLY  77   5.107  10.383  10.007
  625   1HA   GLY  77          HA1       GLY  77   6.790  12.059   9.457
  626   2HA   GLY  77          HA2       GLY  77   8.005  10.940  10.044
  627    H    THR  78           HN       THR  78   5.810   9.119   8.323
  628    HA   THR  78           HA       THR  78   7.557   8.642   6.125
  629    HB   THR  78           HB       THR  78   5.732   7.158   7.397
  630    HG1  THR  78           HG1      THR  78   7.198   6.902   5.150
  631   1HG2  THR  78          HG21      THR  78   4.343   7.961   4.846
  632   2HG2  THR  78          HG22      THR  78   3.706   8.018   6.490
  633   3HG2  THR  78          HG23      THR  78   4.009   6.462   5.715
  634    H    LYS  79           HN       LYS  79   7.220   8.908   3.921
  635    HA   LYS  79           HA       LYS  79   6.115  11.371   3.076
  636   1HB   LYS  79          HB1       LYS  79   6.877   8.989   1.384
  637   2HB   LYS  79          HB2       LYS  79   6.709  10.647   0.832
  638   1HG   LYS  79          HG1       LYS  79   8.609  11.230   2.415
  639   2HG   LYS  79          HG2       LYS  79   8.858   9.485   2.591
  640   1HD   LYS  79          HD1       LYS  79   8.564  10.072  -0.194
  641   2HD   LYS  79          HD2       LYS  79   9.763  11.182   0.482
  642   1HE   LYS  79          HE1       LYS  79  11.094   9.363  -0.043
  643   2HE   LYS  79          HE2       LYS  79  10.686   9.014   1.637
  644   1HZ   LYS  79          HZ1       LYS  79  10.414   7.222  -0.243
  645   2HZ   LYS  79          HZ2       LYS  79   8.919   7.979  -0.451
  646   3HZ   LYS  79          HZ3       LYS  79   9.320   7.315   1.048
  647    H    MET  80           HN       MET  80   4.485   8.329   3.521
  648    HA   MET  80           HA       MET  80   2.469   8.880   1.538
  649   1HB   MET  80          HB1       MET  80   2.808   6.613   1.632
  650   2HB   MET  80          HB2       MET  80   3.013   6.603   3.387
  651   1HG   MET  80          HG1       MET  80   0.754   6.690   3.801
  652   2HG   MET  80          HG2       MET  80   0.385   7.405   2.243
  653   1HE   MET  80          HE1       MET  80  -1.768   4.191   2.170
  654   2HE   MET  80          HE2       MET  80  -1.730   5.945   1.988
  655   3HE   MET  80          HE3       MET  80  -1.430   5.216   3.565
  656    H    ALA  81           HN       ALA  81   1.795  10.885   2.229
  657    HA   ALA  81           HA       ALA  81   0.545  11.295   4.771
  658   1HB   ALA  81          HB1       ALA  81   1.997  12.972   3.811
  659   2HB   ALA  81          HB2       ALA  81   0.376  13.612   4.076
  660   3HB   ALA  81          HB3       ALA  81   0.892  13.170   2.449
  661    H    PHE  82           HN       PHE  82  -0.690   9.622   2.604
  662    HA   PHE  82           HA       PHE  82  -3.042  10.464   1.549
  663   1HB   PHE  82          HB1       PHE  82  -2.111   8.461   0.794
  664   2HB   PHE  82          HB2       PHE  82  -2.055   7.767   2.409
  665    HD1  PHE  82           HD1      PHE  82  -4.443   8.884  -0.253
  666    HD2  PHE  82           HD2      PHE  82  -3.763   6.357   3.163
  667    HE1  PHE  82           HE1      PHE  82  -6.683   7.846  -0.572
  668    HE2  PHE  82           HE2      PHE  82  -6.004   5.331   2.852
  669    HZ   PHE  82           HZ       PHE  82  -7.472   6.090   0.997
  670    H    GLY  83           HN       GLY  83  -2.607   9.573   4.952
  671   1HA   GLY  83          HA1       GLY  83  -4.140  10.407   6.596
  672   2HA   GLY  83          HA2       GLY  83  -5.409  10.365   5.393
  673    H    GLY  84           HN       GLY  84  -5.216   7.704   4.529
  674   1HA   GLY  84          HA1       GLY  84  -5.221   5.437   5.273
  675   2HA   GLY  84          HA2       GLY  84  -5.511   6.003   6.908
  676    H    LEU  85           HN       LEU  85  -6.909   4.206   4.754
  677    HA   LEU  85           HA       LEU  85  -9.572   5.287   4.555
  678   1HB   LEU  85          HB1       LEU  85  -8.248   2.752   3.654
  679   2HB   LEU  85          HB2       LEU  85  -9.994   2.881   3.653
  680    HG   LEU  85           HG       LEU  85  -8.036   4.504   2.017
  681   1HD1  LEU  85          HD11      LEU  85 -10.335   2.686   1.260
  682   2HD1  LEU  85          HD12      LEU  85  -8.630   2.237   1.220
  683   3HD1  LEU  85          HD13      LEU  85  -9.234   3.500   0.147
  684   1HD2  LEU  85          HD21      LEU  85  -9.924   5.956   2.818
  685   2HD2  LEU  85          HD22      LEU  85 -11.046   4.825   2.063
  686   3HD2  LEU  85          HD23      LEU  85  -9.894   5.718   1.071
  687    H    LYS  86           HN       LYS  86 -10.152   5.570   6.621
  688    HA   LYS  86           HA       LYS  86 -10.099   3.963   8.837
  689   1HB   LYS  86          HB1       LYS  86 -12.222   5.993   8.119
  690   2HB   LYS  86          HB2       LYS  86 -11.825   5.431   9.737
  691   1HG   LYS  86          HG1       LYS  86  -9.930   6.935   7.921
  692   2HG   LYS  86          HG2       LYS  86 -10.860   7.654   9.238
  693   1HD   LYS  86          HD1       LYS  86  -9.684   6.339  10.877
  694   2HD   LYS  86          HD2       LYS  86  -8.890   5.390   9.621
  695   1HE   LYS  86          HE1       LYS  86  -8.502   8.369   9.833
  696   2HE   LYS  86          HE2       LYS  86  -7.525   7.244  10.773
  697   1HZ   LYS  86          HZ1       LYS  86  -6.728   6.247   8.761
  698   2HZ   LYS  86          HZ2       LYS  86  -6.482   7.917   8.668
  699   3HZ   LYS  86          HZ3       LYS  86  -7.756   7.208   7.816
  700    H    LYS  87           HN       LYS  87 -12.383   3.765   6.192
  701    HA   LYS  87           HA       LYS  87 -14.385   2.187   7.478
  702   1HB   LYS  87          HB1       LYS  87 -13.862   2.119   4.543
  703   2HB   LYS  87          HB2       LYS  87 -15.384   2.027   5.388
  704   1HG   LYS  87          HG1       LYS  87 -15.492   4.416   5.625
  705   2HG   LYS  87          HG2       LYS  87 -13.797   4.597   5.077
  706   1HD   LYS  87          HD1       LYS  87 -14.489   3.161   3.102
  707   2HD   LYS  87          HD2       LYS  87 -16.130   3.451   3.568
  708   1HE   LYS  87          HE1       LYS  87 -16.083   5.620   2.693
  709   2HE   LYS  87          HE2       LYS  87 -14.305   5.649   2.647
  710   1HZ   LYS  87          HZ1       LYS  87 -15.957   3.681   1.150
  711   2HZ   LYS  87          HZ2       LYS  87 -14.290   3.902   1.025
  712   3HZ   LYS  87          HZ3       LYS  87 -15.344   5.103   0.456
  713    H    GLU  88           HN       GLU  88 -13.782   0.225   8.261
  714    HA   GLU  88           HA       GLU  88 -11.809  -1.500   7.475
  715   1HB   GLU  88          HB1       GLU  88 -13.146  -1.603   9.559
  716   2HB   GLU  88          HB2       GLU  88 -14.475  -2.295   8.634
  717   1HG   GLU  88          HG1       GLU  88 -13.512  -4.344   8.534
  718   2HG   GLU  88          HG2       GLU  88 -11.887  -3.679   8.315
  719    H    LYS  89           HN       LYS  89 -15.222  -1.785   6.377
  720    HA   LYS  89           HA       LYS  89 -14.931  -4.082   4.848
  721   1HB   LYS  89          HB1       LYS  89 -16.821  -1.925   3.990
  722   2HB   LYS  89          HB2       LYS  89 -17.071  -3.668   4.074
  723   1HG   LYS  89          HG1       LYS  89 -16.641  -2.017   6.549
  724   2HG   LYS  89          HG2       LYS  89 -18.236  -2.210   5.835
  725   1HD   LYS  89          HD1       LYS  89 -18.456  -4.329   6.615
  726   2HD   LYS  89          HD2       LYS  89 -16.758  -4.725   6.298
  727   1HE   LYS  89          HE1       LYS  89 -16.401  -2.948   8.269
  728   2HE   LYS  89          HE2       LYS  89 -18.009  -3.514   8.716
  729   1HZ   LYS  89          HZ1       LYS  89 -15.623  -5.237   8.320
  730   2HZ   LYS  89          HZ2       LYS  89 -17.163  -5.774   8.765
  731   3HZ   LYS  89          HZ3       LYS  89 -16.281  -4.786   9.815
  732    H    ASP  90           HN       ASP  90 -14.538  -0.765   3.926
  733    HA   ASP  90           HA       ASP  90 -14.010  -0.855   1.253
  734   1HB   ASP  90          HB1       ASP  90 -14.101   0.982   3.305
  735   2HB   ASP  90          HB2       ASP  90 -12.426   1.069   2.792
  736    H    ARG  91           HN       ARG  91 -11.564  -1.158   3.923
  737    HA   ARG  91           HA       ARG  91  -9.424  -1.690   2.092
  738   1HB   ARG  91          HB1       ARG  91  -9.031  -2.711   4.835
  739   2HB   ARG  91          HB2       ARG  91  -7.987  -1.700   3.843
  740   1HG   ARG  91          HG1       ARG  91  -9.073   0.264   4.478
  741   2HG   ARG  91          HG2       ARG  91 -10.498  -0.591   5.043
  742   1HD   ARG  91          HD1       ARG  91  -7.831  -0.268   6.390
  743   2HD   ARG  91          HD2       ARG  91  -9.421   0.187   6.982
  744    HE   ARG  91           HE       ARG  91  -8.513  -2.048   6.299
  745   1HH1  ARG  91          HH21      ARG  91  -9.898  -0.217   8.907
  746   2HH1  ARG  91          HH22      ARG  91 -10.328  -1.444  10.048
  747   1HH2  ARG  91          HH11      ARG  91  -9.180  -4.061   8.146
  748   2HH2  ARG  91          HH12      ARG  91  -9.969  -3.594   9.612
  749    H    ASN  92           HN       ASN  92 -11.619  -3.797   3.901
  750    HA   ASN  92           HA       ASN  92 -10.446  -6.245   3.623
  751   1HB   ASN  92          HB1       ASN  92 -13.367  -5.510   3.395
  752   2HB   ASN  92          HB2       ASN  92 -12.790  -7.164   3.527
  753   1HD2  ASN  92          HD21      ASN  92 -14.562  -6.130   5.333
  754   2HD2  ASN  92          HD22      ASN  92 -13.699  -6.173   6.832
  755    H    ASP  93           HN       ASP  93 -12.626  -4.831   1.132
  756    HA   ASP  93           HA       ASP  93 -12.174  -6.770  -0.842
  757   1HB   ASP  93          HB1       ASP  93 -13.833  -4.623  -0.615
  758   2HB   ASP  93          HB2       ASP  93 -12.693  -4.034  -1.815
  759    H    LEU  94           HN       LEU  94 -10.345  -3.732  -0.204
  760    HA   LEU  94           HA       LEU  94  -8.715  -3.659  -2.404
  761   1HB   LEU  94          HB1       LEU  94  -8.766  -2.532   0.298
  762   2HB   LEU  94          HB2       LEU  94  -7.181  -2.708  -0.358
  763    HG   LEU  94           HG       LEU  94  -9.342  -1.340  -1.927
  764   1HD1  LEU  94          HD11      LEU  94  -9.057  -0.316   0.345
  765   2HD1  LEU  94          HD12      LEU  94  -8.689   0.767  -1.000
  766   3HD1  LEU  94          HD13      LEU  94  -7.379   0.023  -0.084
  767   1HD2  LEU  94          HD21      LEU  94  -7.121  -1.939  -3.045
  768   2HD2  LEU  94          HD22      LEU  94  -6.388  -0.742  -1.978
  769   3HD2  LEU  94          HD23      LEU  94  -7.625  -0.250  -3.134
  770    H    ILE  95           HN       ILE  95  -8.318  -5.622   0.517
  771    HA   ILE  95           HA       ILE  95  -5.721  -6.584   0.068
  772    HB   ILE  95           HB       ILE  95  -8.010  -7.911   1.538
  773   1HG1  ILE  95          HG11      ILE  95  -5.768  -6.195   2.652
  774   2HG1  ILE  95          HG12      ILE  95  -7.376  -5.576   2.289
  775   1HG2  ILE  95          HG21      ILE  95  -6.165  -9.489   1.061
  776   2HG2  ILE  95          HG22      ILE  95  -6.301  -9.137   2.783
  777   3HG2  ILE  95          HG23      ILE  95  -5.030  -8.375   1.826
  778   1HD1  ILE  95          HD11      ILE  95  -6.845  -7.831   4.225
  779   2HD1  ILE  95          HD12      ILE  95  -8.369  -6.983   3.963
  780   3HD1  ILE  95          HD13      ILE  95  -7.006  -6.139   4.695
  781    H    THR  96           HN       THR  96  -8.854  -8.181  -0.691
  782    HA   THR  96           HA       THR  96  -7.913 -10.355  -2.117
  783    HB   THR  96           HB       THR  96 -10.363  -9.138  -3.232
  784    HG1  THR  96           HG1      THR  96 -10.856  -8.542  -1.198
  785   1HG2  THR  96          HG21      THR  96  -9.633 -11.503  -3.621
  786   2HG2  THR  96          HG22      THR  96 -11.240 -11.364  -2.905
  787   3HG2  THR  96          HG23      THR  96  -9.861 -11.804  -1.897
  788    H    TYR  97           HN       TYR  97  -8.575  -7.075  -3.414
  789    HA   TYR  97           HA       TYR  97  -7.944  -7.715  -6.092
  790   1HB   TYR  97          HB1       TYR  97  -9.220  -5.747  -5.653
  791   2HB   TYR  97          HB2       TYR  97  -7.947  -5.075  -4.643
  792    HD1  TYR  97           HD1      TYR  97  -6.577  -3.451  -5.538
  793    HD2  TYR  97           HD2      TYR  97  -8.432  -6.302  -8.168
  794    HE1  TYR  97           HE1      TYR  97  -5.597  -2.274  -7.497
  795    HE2  TYR  97           HE2      TYR  97  -7.559  -5.064 -10.141
  796    HH   TYR  97           HH       TYR  97  -5.101  -2.989 -10.076
  797    H    LEU  98           HN       LEU  98  -5.890  -6.045  -3.653
  798    HA   LEU  98           HA       LEU  98  -3.574  -5.877  -5.218
  799   1HB   LEU  98          HB1       LEU  98  -4.384  -5.234  -2.580
  800   2HB   LEU  98          HB2       LEU  98  -2.922  -6.203  -2.441
  801    HG   LEU  98           HG       LEU  98  -2.472  -3.731  -2.616
  802   1HD1  LEU  98          HD11      LEU  98  -0.718  -5.284  -3.250
  803   2HD1  LEU  98          HD12      LEU  98  -0.739  -3.939  -4.391
  804   3HD1  LEU  98          HD13      LEU  98  -1.438  -5.493  -4.847
  805   1HD2  LEU  98          HD21      LEU  98  -4.352  -3.320  -4.251
  806   2HD2  LEU  98          HD22      LEU  98  -3.340  -4.068  -5.487
  807   3HD2  LEU  98          HD23      LEU  98  -2.806  -2.590  -4.687
  808    H    LYS  99           HN       LYS  99  -4.574  -8.287  -2.865
  809    HA   LYS  99           HA       LYS  99  -2.423 -10.029  -2.939
  810   1HB   LYS  99          HB1       LYS  99  -3.717 -10.829  -1.303
  811   2HB   LYS  99          HB2       LYS  99  -5.151 -10.062  -1.960
  812   1HG   LYS  99          HG1       LYS  99  -5.499 -11.967  -3.455
  813   2HG   LYS  99          HG2       LYS  99  -4.042 -12.729  -2.847
  814   1HD   LYS  99          HD1       LYS  99  -5.955 -12.117  -0.725
  815   2HD   LYS  99          HD2       LYS  99  -6.627 -13.179  -1.966
  816   1HE   LYS  99          HE1       LYS  99  -5.415 -14.266   0.013
  817   2HE   LYS  99          HE2       LYS  99  -5.020 -14.825  -1.605
  818   1HZ   LYS  99          HZ1       LYS  99  -3.261 -14.020   0.293
  819   2HZ   LYS  99          HZ2       LYS  99  -3.332 -12.690  -0.751
  820   3HZ   LYS  99          HZ3       LYS  99  -2.940 -14.218  -1.367
  821    H    LYS 100           HN       LYS 100  -5.213  -9.869  -5.158
  822    HA   LYS 100           HA       LYS 100  -4.492 -12.164  -6.662
  823   1HB   LYS 100          HB1       LYS 100  -6.762 -10.757  -6.380
  824   2HB   LYS 100          HB2       LYS 100  -6.259 -10.228  -7.969
  825   1HG   LYS 100          HG1       LYS 100  -7.897 -12.233  -7.750
  826   2HG   LYS 100          HG2       LYS 100  -6.575 -12.342  -8.915
  827   1HD   LYS 100          HD1       LYS 100  -5.942 -13.262  -6.217
  828   2HD   LYS 100          HD2       LYS 100  -7.198 -14.181  -6.986
  829   1HE   LYS 100          HE1       LYS 100  -5.431 -15.499  -7.454
  830   2HE   LYS 100          HE2       LYS 100  -5.282 -14.416  -8.848
  831   1HZ   LYS 100          HZ1       LYS 100  -3.168 -14.719  -7.555
  832   2HZ   LYS 100          HZ2       LYS 100  -3.914 -13.963  -6.239
  833   3HZ   LYS 100          HZ3       LYS 100  -3.672 -13.103  -7.679
  834    H    ALA 101           HN       ALA 101  -3.632  -8.936  -6.973
  835    HA   ALA 101           HA       ALA 101  -2.488  -8.947  -9.588
  836   1HB   ALA 101          HB1       ALA 101  -2.315  -6.870  -7.403
  837   2HB   ALA 101          HB2       ALA 101  -3.645  -7.007  -8.553
  838   3HB   ALA 101          HB3       ALA 101  -2.019  -6.633  -9.126
  839    H    THR 102           HN       THR 102  -1.233  -9.235  -6.295
  840    HA   THR 102           HA       THR 102   1.553  -9.200  -7.014
  841    HB   THR 102           HB       THR 102   0.355 -10.048  -4.376
  842    HG1  THR 102           HG1      THR 102  -0.298  -7.921  -4.881
  843   1HG2  THR 102          HG21      THR 102   3.086  -9.011  -5.153
  844   2HG2  THR 102          HG22      THR 102   2.697 -10.615  -4.531
  845   3HG2  THR 102          HG23      THR 102   2.529  -9.202  -3.490
  846    H    GLU 103           HN       GLU 103  -0.843 -11.702  -6.169
  847    HA   GLU 103           HA       GLU 103   1.067 -13.736  -7.131
  848   1HB   GLU 103          HB1       GLU 103  -0.449 -15.251  -5.515
  849   2HB   GLU 103          HB2       GLU 103   1.023 -14.460  -4.975
  850   1HG   GLU 103          HG1       GLU 103  -0.172 -13.547  -3.355
  851   2HG   GLU 103          HG2       GLU 103  -0.959 -12.561  -4.582
  852    HHA  HEC 104           HA       HEC 104   5.236   3.189   1.297
  853    HHB  HEC 104           HB       HEC 104  -0.450   0.327   0.006
  854    HHC  HEC 104           HC       HEC 104  -2.983   6.115  -1.441
  855    HHD  HEC 104           HD       HEC 104   2.957   8.652  -1.347
  856   1HMA  HEC 104          HMA1      HEC 104   1.344  -1.120   1.788
  857   2HMA  HEC 104          HMA2      HEC 104   2.861  -1.472   0.957
  858   3HMA  HEC 104          HMA3      HEC 104   1.371  -1.282   0.031
  859   1HAA  HEC 104          HAA1      HEC 104   4.399  -0.488   1.891
  860   2HAA  HEC 104          HAA2      HEC 104   5.081   1.074   2.303
  861   1HBA  HEC 104          HBA1      HEC 104   5.944   1.278  -0.016
  862   2HBA  HEC 104          HBA2      HEC 104   5.320  -0.327  -0.365
  863   1HMB  HEC 104          HMB1      HEC 104  -2.330   0.030  -0.625
  864   2HMB  HEC 104          HMB2      HEC 104  -3.252   0.660  -1.990
  865   3HMB  HEC 104          HMB3      HEC 104  -3.913   0.761  -0.358
  866    HAB  HEC 104           HAB      HEC 104  -4.388   4.789  -1.518
  867   1HBB  HEC 104          HBB1      HEC 104  -4.719   3.516   0.742
  868   2HBB  HEC 104          HBB2      HEC 104  -5.717   2.469  -0.265
  869   3HBB  HEC 104          HBB3      HEC 104  -6.070   4.195  -0.166
  870   1HMC  HEC 104          HMC1      HEC 104  -3.036   8.686  -1.545
  871   2HMC  HEC 104          HMC2      HEC 104  -2.699   7.995  -3.132
  872   3HMC  HEC 104          HMC3      HEC 104  -2.089   9.597  -2.720
  873    HAC  HEC 104           HAC      HEC 104   1.759   9.732  -2.598
  874   1HBC  HEC 104          HBC1      HEC 104   0.969  11.083  -0.894
  875   2HBC  HEC 104          HBC2      HEC 104  -0.692  11.028  -1.484
  876   3HBC  HEC 104          HBC3      HEC 104   0.538  11.909  -2.392
  877   1HMD  HEC 104          HMD1      HEC 104   5.092   9.029  -0.429
  878   2HMD  HEC 104          HMD2      HEC 104   5.541   8.074  -1.842
  879   3HMD  HEC 104          HMD3      HEC 104   6.564   8.057  -0.405
  880   1HAD  HEC 104          HAD1      HEC 104   7.368   6.166   0.330
  881   2HAD  HEC 104          HAD2      HEC 104   6.915   4.608   1.012
  882   1HBD  HEC 104          HBD1      HEC 104   6.400   5.510   3.083
  883   2HBD  HEC 104          HBD2      HEC 104   6.080   7.102   2.429
  884    H2   4NL 105           H2       4NL 105   0.047 -13.473  -1.414
  885    H6   4NL 105           H6       4NL 105   2.229 -14.476   3.015
  886    H3   4NL 105           H3       4NL 105  -1.258 -10.724   1.686
  887    H5   4NL 105           H5       4NL 105  -2.257 -10.896  -0.319
  888    H4   4NL 105           H4       4NL 105   0.518 -11.610   3.220
  889    H1   4NL 105           H1       4NL 105   1.823 -14.359   0.120
  890    H7   4NL 105           H7       4NL 105   3.102 -12.931   2.873
  Start of MODEL   21
    1   1H    THR  -5          HT1       THR  -5 -11.093  -6.471  13.428
    2   2H    THR  -5          HT2       THR  -5 -10.629  -5.827  11.932
    3   3H    THR  -5          HT3       THR  -5  -9.523  -5.871  13.213
    4    HA   THR  -5           HA       THR  -5  -9.182  -7.611  11.482
    5    HB   THR  -5           HB       THR  -5  -9.834  -9.051  14.018
    6    HG1  THR  -5           HG1      THR  -5  -7.542  -7.743  14.365
    7   1HG2  THR  -5          HG21      THR  -5  -7.580  -9.902  13.718
    8   2HG2  THR  -5          HG22      THR  -5  -7.283  -8.741  12.424
    9   3HG2  THR  -5          HG23      THR  -5  -8.459 -10.036  12.194
   10    H    GLU  -4           HN       GLU  -4 -11.736  -7.003  10.762
   11    HA   GLU  -4           HA       GLU  -4 -13.192  -9.558  10.957
   12   1HB   GLU  -4          HB1       GLU  -4 -14.219  -7.281  11.926
   13   2HB   GLU  -4          HB2       GLU  -4 -14.621  -7.017  10.233
   14   1HG   GLU  -4          HG1       GLU  -4 -15.389  -9.510  11.746
   15   2HG   GLU  -4          HG2       GLU  -4 -16.423  -8.091  11.635
   16    H    PHE  -3           HN       PHE  -3 -11.294  -9.651   9.240
   17    HA   PHE  -3           HA       PHE  -3 -11.674  -8.434   6.726
   18   1HB   PHE  -3          HB1       PHE  -3  -9.468  -9.158   7.359
   19   2HB   PHE  -3          HB2       PHE  -3  -9.998 -10.832   7.465
   20    HD1  PHE  -3           HD1      PHE  -3  -9.629  -8.002   5.027
   21    HD2  PHE  -3           HD2      PHE  -3  -9.768 -12.259   5.617
   22    HE1  PHE  -3           HE1      PHE  -3  -9.117  -8.351   2.618
   23    HE2  PHE  -3           HE2      PHE  -3  -9.307 -12.610   3.199
   24    HZ   PHE  -3           HZ       PHE  -3  -9.012 -10.654   1.689
   25    H    LYS  -2           HN       LYS  -2 -12.137  -9.412   4.738
   26    HA   LYS  -2           HA       LYS  -2 -13.558 -11.860   4.434
   27   1HB   LYS  -2          HB1       LYS  -2 -15.136  -9.843   5.385
   28   2HB   LYS  -2          HB2       LYS  -2 -15.291  -9.588   3.647
   29   1HG   LYS  -2          HG1       LYS  -2 -16.244 -11.686   3.285
   30   2HG   LYS  -2          HG2       LYS  -2 -15.627 -12.336   4.802
   31   1HD   LYS  -2          HD1       LYS  -2 -17.952 -10.464   4.373
   32   2HD   LYS  -2          HD2       LYS  -2 -17.960 -12.061   5.119
   33   1HE   LYS  -2          HE1       LYS  -2 -16.834  -9.496   6.251
   34   2HE   LYS  -2          HE2       LYS  -2 -18.198 -10.426   6.859
   35   1HZ   LYS  -2          HZ1       LYS  -2 -16.348 -10.852   8.255
   36   2HZ   LYS  -2          HZ2       LYS  -2 -15.327 -11.165   6.946
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.572 -12.244   7.309
   38    H    ALA  -1           HN       ALA  -1 -13.083 -12.531   2.483
   39    HA   ALA  -1           HA       ALA  -1 -11.378 -11.248   0.726
   40   1HB   ALA  -1          HB1       ALA  -1 -11.587 -13.650   0.840
   41   2HB   ALA  -1          HB2       ALA  -1 -11.922 -13.116  -0.808
   42   3HB   ALA  -1          HB3       ALA  -1 -13.251 -13.569   0.259
   43    H    GLY   1           HN       GLY   1 -11.599 -10.194  -1.204
   44   1HA   GLY   1          HA1       GLY   1 -14.245  -9.103  -1.909
   45   2HA   GLY   1          HA2       GLY   1 -12.710  -8.298  -2.193
   46    H    SER   2           HN       SER   2 -12.854  -8.040  -4.335
   47    HA   SER   2           HA       SER   2 -12.328 -10.287  -6.067
   48   1HB   SER   2          HB1       SER   2 -14.616  -8.576  -6.958
   49   2HB   SER   2          HB2       SER   2 -14.215 -10.240  -7.404
   50    HG   SER   2           HG       SER   2 -14.670 -10.621  -5.018
   51    H    ALA   3           HN       ALA   3 -11.146  -9.668  -7.846
   52    HA   ALA   3           HA       ALA   3  -9.710  -7.354  -7.889
   53   1HB   ALA   3          HB1       ALA   3  -9.063  -7.946 -10.156
   54   2HB   ALA   3          HB2       ALA   3 -10.437  -9.045 -10.275
   55   3HB   ALA   3          HB3       ALA   3  -9.142  -9.376  -9.126
   56    H    LYS   4           HN       LYS   4 -12.892  -7.751  -9.505
   57    HA   LYS   4           HA       LYS   4 -12.725  -5.167 -10.724
   58   1HB   LYS   4          HB1       LYS   4 -13.876  -7.195 -11.705
   59   2HB   LYS   4          HB2       LYS   4 -15.220  -6.814 -10.628
   60   1HG   LYS   4          HG1       LYS   4 -14.467  -4.394 -11.891
   61   2HG   LYS   4          HG2       LYS   4 -14.545  -5.623 -13.147
   62   1HD   LYS   4          HD1       LYS   4 -16.805  -5.824 -12.986
   63   2HD   LYS   4          HD2       LYS   4 -16.808  -5.572 -11.236
   64   1HE   LYS   4          HE1       LYS   4 -16.215  -3.330 -13.167
   65   2HE   LYS   4          HE2       LYS   4 -17.865  -3.731 -12.689
   66   1HZ   LYS   4          HZ1       LYS   4 -17.434  -3.173 -10.485
   67   2HZ   LYS   4          HZ2       LYS   4 -16.672  -1.952 -11.369
   68   3HZ   LYS   4          HZ3       LYS   4 -15.753  -3.201 -10.696
   69    H    LYS   5           HN       LYS   5 -13.157  -5.725  -7.594
   70    HA   LYS   5           HA       LYS   5 -15.010  -3.452  -7.249
   71   1HB   LYS   5          HB1       LYS   5 -14.447  -5.678  -5.274
   72   2HB   LYS   5          HB2       LYS   5 -15.477  -4.286  -4.969
   73   1HG   LYS   5          HG1       LYS   5 -16.773  -5.117  -7.085
   74   2HG   LYS   5          HG2       LYS   5 -15.974  -6.652  -6.735
   75   1HD   LYS   5          HD1       LYS   5 -17.140  -5.437  -4.351
   76   2HD   LYS   5          HD2       LYS   5 -18.344  -5.738  -5.604
   77   1HE   LYS   5          HE1       LYS   5 -18.255  -7.688  -4.219
   78   2HE   LYS   5          HE2       LYS   5 -17.474  -8.096  -5.747
   79   1HZ   LYS   5          HZ1       LYS   5 -15.554  -8.479  -4.713
   80   2HZ   LYS   5          HZ2       LYS   5 -16.431  -8.450  -3.262
   81   3HZ   LYS   5          HZ3       LYS   5 -15.651  -7.049  -3.803
   82    H    GLY   6           HN       GLY   6 -12.234  -5.046  -5.629
   83   1HA   GLY   6          HA1       GLY   6 -11.386  -2.848  -4.119
   84   2HA   GLY   6          HA2       GLY   6 -10.347  -4.157  -4.661
   85    H    ALA   7           HN       ALA   7 -10.852  -3.543  -7.534
   86    HA   ALA   7           HA       ALA   7  -8.757  -1.772  -8.053
   87   1HB   ALA   7          HB1       ALA   7 -10.953  -2.494  -9.989
   88   2HB   ALA   7          HB2       ALA   7  -9.604  -3.559  -9.590
   89   3HB   ALA   7          HB3       ALA   7  -9.299  -2.005 -10.363
   90    H    THR   8           HN       THR   8 -12.325  -1.111  -8.352
   91    HA   THR   8           HA       THR   8 -12.133   1.500  -9.238
   92    HB   THR   8           HB       THR   8 -14.278   1.699  -7.542
   93    HG1  THR   8           HG1      THR   8 -13.945  -0.550  -7.000
   94   1HG2  THR   8          HG21      THR   8 -15.633   1.120  -9.525
   95   2HG2  THR   8          HG22      THR   8 -14.174   0.535 -10.327
   96   3HG2  THR   8          HG23      THR   8 -14.325   2.242  -9.908
   97    H    LEU   9           HN       LEU   9 -11.651   0.394  -5.929
   98    HA   LEU   9           HA       LEU   9 -11.663   2.915  -4.654
   99   1HB   LEU   9          HB1       LEU   9 -10.910   0.134  -3.936
  100   2HB   LEU   9          HB2       LEU   9 -10.110   1.407  -3.017
  101    HG   LEU   9           HG       LEU   9 -12.064   0.892  -1.783
  102   1HD1  LEU   9          HD11      LEU   9 -11.654   3.318  -2.149
  103   2HD1  LEU   9          HD12      LEU   9 -13.353   2.939  -1.865
  104   3HD1  LEU   9          HD13      LEU   9 -12.785   3.268  -3.502
  105   1HD2  LEU   9          HD21      LEU   9 -13.554   1.027  -4.410
  106   2HD2  LEU   9          HD22      LEU   9 -14.347   0.992  -2.836
  107   3HD2  LEU   9          HD23      LEU   9 -13.366  -0.378  -3.358
  108    H    PHE  10           HN       PHE  10  -8.796   0.850  -4.766
  109    HA   PHE  10           HA       PHE  10  -6.803   2.656  -4.483
  110   1HB   PHE  10          HB1       PHE  10  -6.545   0.199  -4.586
  111   2HB   PHE  10          HB2       PHE  10  -6.734   0.264  -6.332
  112    HD1  PHE  10           HD1      PHE  10  -4.988   1.783  -7.621
  113    HD2  PHE  10           HD2      PHE  10  -4.429   0.189  -3.665
  114    HE1  PHE  10           HE1      PHE  10  -2.519   2.019  -7.870
  115    HE2  PHE  10           HE2      PHE  10  -1.978   0.545  -3.868
  116    HZ   PHE  10           HZ       PHE  10  -1.015   1.435  -5.976
  117    H    LYS  11           HN       LYS  11  -8.451   1.948  -7.538
  118    HA   LYS  11           HA       LYS  11  -6.723   3.307  -9.272
  119   1HB   LYS  11          HB1       LYS  11  -8.830   1.650  -9.603
  120   2HB   LYS  11          HB2       LYS  11  -9.553   3.185 -10.087
  121   1HG   LYS  11          HG1       LYS  11  -8.311   3.339 -11.965
  122   2HG   LYS  11          HG2       LYS  11  -6.866   2.703 -11.183
  123   1HD   LYS  11          HD1       LYS  11  -9.212   1.015 -12.076
  124   2HD   LYS  11          HD2       LYS  11  -7.741   1.257 -13.020
  125   1HE   LYS  11          HE1       LYS  11  -6.422   0.261 -11.176
  126   2HE   LYS  11          HE2       LYS  11  -7.910  -0.017 -10.277
  127   1HZ   LYS  11          HZ1       LYS  11  -8.647  -1.535 -11.981
  128   2HZ   LYS  11          HZ2       LYS  11  -7.119  -2.008 -11.435
  129   3HZ   LYS  11          HZ3       LYS  11  -7.272  -1.215 -12.920
  130    H    THR  12           HN       THR  12  -8.881   4.715  -7.061
  131    HA   THR  12           HA       THR  12  -8.379   7.374  -8.092
  132    HB   THR  12           HB       THR  12 -10.494   6.583  -9.095
  133    HG1  THR  12           HG1      THR  12  -9.831   8.851  -8.440
  134   1HG2  THR  12          HG21      THR  12 -11.524   5.404  -7.207
  135   2HG2  THR  12          HG22      THR  12 -12.568   6.674  -7.845
  136   3HG2  THR  12          HG23      THR  12 -11.678   6.934  -6.344
  137    H    ARG  13           HN       ARG  13  -7.671   5.627  -5.781
  138    HA   ARG  13           HA       ARG  13  -7.975   7.591  -3.616
  139   1HB   ARG  13          HB1       ARG  13  -8.247   4.597  -3.305
  140   2HB   ARG  13          HB2       ARG  13  -8.205   5.747  -1.986
  141   1HG   ARG  13          HG1       ARG  13 -10.356   5.486  -4.077
  142   2HG   ARG  13          HG2       ARG  13 -10.458   4.985  -2.396
  143   1HD   ARG  13          HD1       ARG  13 -11.178   7.012  -1.804
  144   2HD   ARG  13          HD2       ARG  13  -9.755   7.769  -2.531
  145    HE   ARG  13           HE       ARG  13 -10.642   7.930  -4.392
  146   1HH1  ARG  13          HH11      ARG  13 -12.988   6.654  -2.134
  147   2HH1  ARG  13          HH12      ARG  13 -14.432   7.286  -2.839
  148   1HH2  ARG  13          HH21      ARG  13 -12.879   8.849  -5.455
  149   2HH2  ARG  13          HH22      ARG  13 -14.371   8.496  -4.655
  150    H    CYS  14           HN       CYS  14  -5.985   5.488  -5.385
  151    HA   CYS  14           HA       CYS  14  -3.662   6.112  -3.712
  152   1HB   CYS  14          HB1       CYS  14  -3.992   3.366  -4.858
  153   2HB   CYS  14          HB2       CYS  14  -2.908   3.901  -3.593
  154    H    LEU  15           HN       LEU  15  -4.955   5.175  -6.851
  155    HA   LEU  15           HA       LEU  15  -2.753   4.940  -8.437
  156   1HB   LEU  15          HB1       LEU  15  -5.352   4.916  -8.916
  157   2HB   LEU  15          HB2       LEU  15  -5.043   6.560  -9.458
  158    HG   LEU  15           HG       LEU  15  -3.237   5.633 -10.975
  159   1HD1  LEU  15          HD11      LEU  15  -2.748   3.514 -10.036
  160   2HD1  LEU  15          HD12      LEU  15  -3.552   3.195 -11.573
  161   3HD1  LEU  15          HD13      LEU  15  -4.445   3.030 -10.060
  162   1HD2  LEU  15          HD21      LEU  15  -4.873   4.636 -12.617
  163   2HD2  LEU  15          HD22      LEU  15  -5.301   6.231 -11.997
  164   3HD2  LEU  15          HD23      LEU  15  -6.106   4.794 -11.366
  165    H    GLN  16           HN       GLN  16  -4.128   8.003  -7.312
  166    HA   GLN  16           HA       GLN  16  -2.988   9.928  -8.771
  167   1HB   GLN  16          HB1       GLN  16  -2.787  11.195  -6.496
  168   2HB   GLN  16          HB2       GLN  16  -4.358  10.716  -7.117
  169   1HG   GLN  16          HG1       GLN  16  -3.541   8.539  -5.579
  170   2HG   GLN  16          HG2       GLN  16  -3.041   9.954  -4.650
  171   1HE2  GLN  16          HE21      GLN  16  -4.667  11.332  -3.805
  172   2HE2  GLN  16          HE22      GLN  16  -6.336  10.896  -3.830
  173    H    CYS  17           HN       CYS  17  -1.144   8.054  -6.378
  174    HA   CYS  17           HA       CYS  17   1.320   9.365  -7.304
  175   1HB   CYS  17          HB1       CYS  17   1.342   8.128  -4.622
  176   2HB   CYS  17          HB2       CYS  17   2.099   9.594  -5.220
  177    H    HIS  18           HN       HIS  18  -0.112   6.274  -6.357
  178    HA   HIS  18           HA       HIS  18   2.392   4.816  -6.632
  179   1HB   HIS  18          HB1       HIS  18  -0.336   4.206  -5.570
  180   2HB   HIS  18          HB2       HIS  18   0.766   2.894  -5.949
  181    HD1  HIS  18           HD1      HIS  18   3.254   3.204  -4.578
  182    HD2  HIS  18           HD2      HIS  18  -0.212   5.053  -3.129
  183    HE1  HIS  18           HE1      HIS  18   3.657   3.619  -2.109
  184    H    THR  19           HN       THR  19   2.083   2.572  -7.526
  185    HA   THR  19           HA       THR  19   0.600   2.434 -10.044
  186    HB   THR  19           HB       THR  19   2.958   1.103 -10.575
  187    HG1  THR  19           HG1      THR  19   4.531   2.769 -10.148
  188   1HG2  THR  19          HG21      THR  19   1.722   2.544 -12.143
  189   2HG2  THR  19          HG22      THR  19   3.445   2.922 -12.118
  190   3HG2  THR  19          HG23      THR  19   2.301   3.965 -11.276
  191    H    VAL  20           HN       VAL  20  -0.585   0.581 -10.154
  192    HA   VAL  20           HA       VAL  20  -0.425  -1.386  -8.074
  193    HB   VAL  20           HB       VAL  20  -2.423  -0.325  -9.481
  194   1HG1  VAL  20          HG11      VAL  20  -1.923  -1.555 -11.526
  195   2HG1  VAL  20          HG12      VAL  20  -3.520  -1.942 -10.881
  196   3HG1  VAL  20          HG13      VAL  20  -2.187  -3.078 -10.669
  197   1HG2  VAL  20          HG21      VAL  20  -2.616  -1.477  -7.320
  198   2HG2  VAL  20          HG22      VAL  20  -2.630  -3.025  -8.165
  199   3HG2  VAL  20          HG23      VAL  20  -3.932  -1.867  -8.428
  200    H    GLU  21           HN       GLU  21   0.661  -1.291 -11.335
  201    HA   GLU  21           HA       GLU  21   1.394  -4.142 -11.334
  202   1HB   GLU  21          HB1       GLU  21   1.720  -3.469 -13.912
  203   2HB   GLU  21          HB2       GLU  21   0.177  -4.012 -13.286
  204   1HG   GLU  21          HG1       GLU  21   0.141  -1.985 -14.817
  205   2HG   GLU  21          HG2       GLU  21  -0.723  -1.830 -13.291
  206    H    LYS  22           HN       LYS  22   3.554  -4.332 -12.940
  207    HA   LYS  22           HA       LYS  22   5.426  -2.416 -11.790
  208   1HB   LYS  22          HB1       LYS  22   5.535  -5.210 -12.234
  209   2HB   LYS  22          HB2       LYS  22   6.849  -4.454 -13.153
  210   1HG   LYS  22          HG1       LYS  22   7.763  -3.424 -11.265
  211   2HG   LYS  22          HG2       LYS  22   6.271  -3.584 -10.339
  212   1HD   LYS  22          HD1       LYS  22   6.628  -5.865  -9.947
  213   2HD   LYS  22          HD2       LYS  22   7.837  -5.983 -11.227
  214   1HE   LYS  22          HE1       LYS  22   9.068  -6.042  -9.213
  215   2HE   LYS  22          HE2       LYS  22   9.277  -4.415  -9.836
  216   1HZ   LYS  22          HZ1       LYS  22   8.942  -4.331  -7.471
  217   2HZ   LYS  22          HZ2       LYS  22   7.518  -5.231  -7.576
  218   3HZ   LYS  22          HZ3       LYS  22   7.572  -3.671  -8.214
  219    H    GLY  23           HN       GLY  23   3.799  -1.820 -14.331
  220   1HA   GLY  23          HA1       GLY  23   6.016  -1.385 -16.222
  221   2HA   GLY  23          HA2       GLY  23   4.307  -1.260 -16.602
  222    H    GLY  24           HN       GLY  24   3.944   0.390 -14.069
  223   1HA   GLY  24          HA1       GLY  24   4.374   2.998 -15.212
  224   2HA   GLY  24          HA2       GLY  24   3.536   2.622 -13.716
  225    HA   PRO  25           HA       PRO  25   8.267   3.717 -13.098
  226   1HB   PRO  25          HB1       PRO  25   8.210   6.467 -13.252
  227   2HB   PRO  25          HB2       PRO  25   8.777   5.407 -14.547
  228   1HG   PRO  25          HG1       PRO  25   6.122   6.740 -14.212
  229   2HG   PRO  25          HG2       PRO  25   7.088   6.516 -15.683
  230   1HD   PRO  25          HD1       PRO  25   4.955   4.969 -15.134
  231   2HD   PRO  25          HD2       PRO  25   6.393   4.324 -15.955
  232    H    HIS  26           HN       HIS  26   8.992   4.677 -11.104
  233    HA   HIS  26           HA       HIS  26   7.020   4.731  -9.042
  234   1HB   HIS  26          HB1       HIS  26   9.974   5.396  -9.032
  235   2HB   HIS  26          HB2       HIS  26   8.986   5.228  -7.592
  236    HD2  HIS  26           HD2      HIS  26  10.945   3.207 -10.150
  237    HE1  HIS  26           HE1      HIS  26   9.351   0.392  -7.399
  238    HE2  HIS  26           HE2      HIS  26  10.982   0.733  -9.315
  239    H    LYS  27           HN       LYS  27   5.638   6.522  -9.441
  240    HA   LYS  27           HA       LYS  27   6.667   9.178  -9.800
  241   1HB   LYS  27          HB1       LYS  27   3.782   8.723  -9.243
  242   2HB   LYS  27          HB2       LYS  27   4.557   9.713 -10.469
  243   1HG   LYS  27          HG1       LYS  27   4.138   8.126 -11.978
  244   2HG   LYS  27          HG2       LYS  27   5.206   7.035 -11.087
  245   1HD   LYS  27          HD1       LYS  27   2.961   6.047 -11.386
  246   2HD   LYS  27          HD2       LYS  27   3.317   6.327  -9.677
  247   1HE   LYS  27          HE1       LYS  27   1.963   8.309  -9.642
  248   2HE   LYS  27          HE2       LYS  27   1.775   8.279 -11.396
  249   1HZ   LYS  27          HZ1       LYS  27   0.356   6.453 -11.285
  250   2HZ   LYS  27          HZ2       LYS  27  -0.142   7.421  -9.993
  251   3HZ   LYS  27          HZ3       LYS  27   0.814   6.057  -9.701
  252    H    VAL  28           HN       VAL  28   4.340  10.159  -7.965
  253    HA   VAL  28           HA       VAL  28   5.855  11.026  -5.802
  254    HB   VAL  28           HB       VAL  28   2.861  10.653  -5.742
  255   1HG1  VAL  28          HG11      VAL  28   4.622  12.743  -4.446
  256   2HG1  VAL  28          HG12      VAL  28   3.946  11.337  -3.623
  257   3HG1  VAL  28          HG13      VAL  28   2.874  12.581  -4.267
  258   1HG2  VAL  28          HG21      VAL  28   2.669  12.945  -6.648
  259   2HG2  VAL  28          HG22      VAL  28   3.379  11.830  -7.815
  260   3HG2  VAL  28          HG23      VAL  28   4.409  12.964  -6.942
  261    H    GLY  29           HN       GLY  29   4.117   8.062  -6.288
  262   1HA   GLY  29          HA1       GLY  29   4.878   7.039  -3.627
  263   2HA   GLY  29          HA2       GLY  29   3.383   6.594  -4.435
  264    HA   PRO  30           HA       PRO  30   7.262   3.972  -5.798
  265   1HB   PRO  30          HB1       PRO  30   7.424   2.094  -3.849
  266   2HB   PRO  30          HB2       PRO  30   8.337   3.607  -3.812
  267   1HG   PRO  30          HG1       PRO  30   5.770   2.912  -2.427
  268   2HG   PRO  30          HG2       PRO  30   7.201   3.738  -1.779
  269   1HD   PRO  30          HD1       PRO  30   5.005   5.087  -2.560
  270   2HD   PRO  30          HD2       PRO  30   6.640   5.751  -2.765
  271    H    ASN  31           HN       ASN  31   7.134   1.876  -6.737
  272    HA   ASN  31           HA       ASN  31   4.550   0.990  -7.431
  273   1HB   ASN  31          HB1       ASN  31   6.143   0.587  -9.066
  274   2HB   ASN  31          HB2       ASN  31   7.367   0.088  -7.907
  275   1HD2  ASN  31          HD21      ASN  31   4.681  -0.992  -9.864
  276   2HD2  ASN  31          HD22      ASN  31   4.970  -2.681  -9.609
  277    H    LEU  32           HN       LEU  32   3.193  -0.347  -6.372
  278    HA   LEU  32           HA       LEU  32   3.930  -1.660  -3.891
  279   1HB   LEU  32          HB1       LEU  32   1.259  -1.057  -5.164
  280   2HB   LEU  32          HB2       LEU  32   1.460  -1.832  -3.605
  281    HG   LEU  32           HG       LEU  32   2.278   1.000  -4.311
  282   1HD1  LEU  32          HD11      LEU  32   0.110  -0.111  -2.521
  283   2HD1  LEU  32          HD12      LEU  32  -0.114   0.788  -4.021
  284   3HD1  LEU  32          HD13      LEU  32   0.569   1.591  -2.609
  285   1HD2  LEU  32          HD21      LEU  32   2.427  -0.342  -1.609
  286   2HD2  LEU  32          HD22      LEU  32   2.933   1.297  -2.021
  287   3HD2  LEU  32          HD23      LEU  32   3.820  -0.087  -2.660
  288    H    HIS  33           HN       HIS  33   3.635  -2.618  -7.090
  289    HA   HIS  33           HA       HIS  33   2.426  -5.159  -6.979
  290   1HB   HIS  33          HB1       HIS  33   2.737  -3.731  -9.012
  291   2HB   HIS  33          HB2       HIS  33   4.458  -4.100  -8.955
  292    HD2  HIS  33           HD2      HIS  33   1.652  -6.723  -8.393
  293    HE1  HIS  33           HE1      HIS  33   3.626  -7.724 -12.021
  294    HE2  HIS  33           HE2      HIS  33   1.915  -8.491 -10.304
  295    H    GLY  34           HN       GLY  34   3.321  -6.346  -5.291
  296   1HA   GLY  34          HA1       GLY  34   4.789  -8.330  -5.159
  297   2HA   GLY  34          HA2       GLY  34   6.108  -7.269  -5.604
  298    H    ILE  35           HN       ILE  35   4.029  -5.676  -3.371
  299    HA   ILE  35           HA       ILE  35   6.064  -5.780  -1.391
  300    HB   ILE  35           HB       ILE  35   4.673  -4.483   0.070
  301   1HG1  ILE  35          HG11      ILE  35   2.448  -5.150  -1.811
  302   2HG1  ILE  35          HG12      ILE  35   2.422  -4.944  -0.061
  303   1HG2  ILE  35          HG21      ILE  35   4.643  -2.483  -1.286
  304   2HG2  ILE  35          HG22      ILE  35   4.671  -3.451  -2.759
  305   3HG2  ILE  35          HG23      ILE  35   6.053  -3.472  -1.664
  306   1HD1  ILE  35          HD11      ILE  35   2.657  -2.686  -2.059
  307   2HD1  ILE  35          HD12      ILE  35   2.510  -2.527  -0.308
  308   3HD1  ILE  35          HD13      ILE  35   1.168  -3.176  -1.248
  309    H    PHE  36           HN       PHE  36   2.959  -7.513  -1.599
  310    HA   PHE  36           HA       PHE  36   2.785  -8.515   0.953
  311   1HB   PHE  36          HB1       PHE  36   1.902  -9.664  -1.684
  312   2HB   PHE  36          HB2       PHE  36   1.583 -10.488  -0.158
  313    HD1  PHE  36           HD1      PHE  36   0.810  -8.551   1.727
  314    HD2  PHE  36           HD2      PHE  36   0.000  -8.600  -2.498
  315    HE1  PHE  36           HE1      PHE  36  -1.168  -7.088   2.097
  316    HE2  PHE  36           HE2      PHE  36  -1.979  -7.137  -2.132
  317    HZ   PHE  36           HZ       PHE  36  -2.557  -6.371   0.163
  318    H    GLY  37           HN       GLY  37   4.134  -9.550   2.125
  319   1HA   GLY  37          HA1       GLY  37   5.280 -11.499   2.810
  320   2HA   GLY  37          HA2       GLY  37   5.710 -11.816   1.140
  321    H    ARG  38           HN       ARG  38   6.361  -8.634   1.390
  322    HA   ARG  38           HA       ARG  38   9.167  -9.030   2.207
  323   1HB   ARG  38          HB1       ARG  38   7.892  -7.163   0.187
  324   2HB   ARG  38          HB2       ARG  38   9.552  -6.978   0.735
  325   1HG   ARG  38          HG1       ARG  38  10.237  -8.978  -0.291
  326   2HG   ARG  38          HG2       ARG  38   8.577  -9.550  -0.476
  327   1HD   ARG  38          HD1       ARG  38   9.095  -8.853  -2.636
  328   2HD   ARG  38          HD2       ARG  38   8.288  -7.431  -1.972
  329    HE   ARG  38           HE       ARG  38  10.418  -7.379  -1.218
  330   1HH1  ARG  38          HH21      ARG  38   9.292  -7.562  -4.469
  331   2HH1  ARG  38          HH22      ARG  38  10.275  -6.314  -5.042
  332   1HH2  ARG  38          HH11      ARG  38  12.390  -5.847  -2.586
  333   2HH2  ARG  38          HH12      ARG  38  12.244  -6.149  -4.263
  334    H    HIS  39           HN       HIS  39  10.198  -7.123   3.165
  335    HA   HIS  39           HA       HIS  39   8.552  -6.035   5.266
  336   1HB   HIS  39          HB1       HIS  39  11.465  -5.407   4.736
  337   2HB   HIS  39          HB2       HIS  39  10.602  -5.343   6.275
  338    HD2  HIS  39           HD2      HIS  39  10.376  -7.562   7.676
  339    HE1  HIS  39           HE1      HIS  39  12.211 -10.243   4.928
  340    HE2  HIS  39           HE2      HIS  39  11.208 -10.006   7.249
  341    H    SER  40           HN       SER  40   8.731  -3.637   5.805
  342    HA   SER  40           HA       SER  40   7.828  -2.034   3.723
  343   1HB   SER  40          HB1       SER  40   9.201  -0.760   6.062
  344   2HB   SER  40          HB2       SER  40   7.784  -0.215   5.177
  345    HG   SER  40           HG       SER  40   6.845  -2.276   6.133
  346    H    GLY  41           HN       GLY  41   8.727  -0.418   2.482
  347   1HA   GLY  41          HA1       GLY  41  10.370   0.764   1.381
  348   2HA   GLY  41          HA2       GLY  41  11.522   0.228   2.580
  349    H    GLN  42           HN       GLN  42   9.665  -1.684   0.087
  350    HA   GLN  42           HA       GLN  42  12.278  -2.680  -0.802
  351   1HB   GLN  42          HB1       GLN  42   9.670  -4.136  -0.593
  352   2HB   GLN  42          HB2       GLN  42  11.018  -4.762  -1.536
  353   1HG   GLN  42          HG1       GLN  42  11.518  -3.927   1.288
  354   2HG   GLN  42          HG2       GLN  42  10.682  -5.448   0.990
  355   1HE2  GLN  42          HE21      GLN  42  13.400  -4.917   2.116
  356   2HE2  GLN  42          HE22      GLN  42  14.492  -5.779   1.095
  357    H    ALA  43           HN       ALA  43  10.356  -0.466  -2.116
  358    HA   ALA  43           HA       ALA  43   9.823  -1.400  -4.720
  359   1HB   ALA  43          HB1       ALA  43   9.351   0.866  -5.273
  360   2HB   ALA  43          HB2       ALA  43  10.310   1.456  -3.917
  361   3HB   ALA  43          HB3       ALA  43   8.808   0.584  -3.620
  362    H    GLU  44           HN       GLU  44  11.145  -1.972  -6.292
  363    HA   GLU  44           HA       GLU  44  13.922  -1.397  -6.341
  364   1HB   GLU  44          HB1       GLU  44  12.458  -2.732  -8.616
  365   2HB   GLU  44          HB2       GLU  44  14.105  -2.998  -8.054
  366   1HG   GLU  44          HG1       GLU  44  13.125  -4.861  -7.169
  367   2HG   GLU  44          HG2       GLU  44  12.881  -3.753  -5.833
  368    H    GLY  45           HN       GLY  45  14.015   0.875  -6.440
  369   1HA   GLY  45          HA1       GLY  45  14.996   2.316  -8.281
  370   2HA   GLY  45          HA2       GLY  45  13.429   2.144  -9.040
  371    H    TYR  46           HN       TYR  46  12.922   2.421  -5.740
  372    HA   TYR  46           HA       TYR  46  12.790   5.338  -5.734
  373   1HB   TYR  46          HB1       TYR  46  10.627   4.532  -6.452
  374   2HB   TYR  46          HB2       TYR  46  10.508   3.502  -5.032
  375    HD1  TYR  46           HD1      TYR  46  10.068   6.863  -6.372
  376    HD2  TYR  46           HD2      TYR  46  10.291   4.534  -2.770
  377    HE1  TYR  46           HE1      TYR  46   8.865   8.668  -5.147
  378    HE2  TYR  46           HE2      TYR  46   8.989   6.275  -1.552
  379    HH   TYR  46           HH       TYR  46   7.337   8.794  -3.170
  380    H    SER  47           HN       SER  47  13.210   6.360  -3.856
  381    HA   SER  47           HA       SER  47  14.275   4.821  -1.637
  382   1HB   SER  47          HB1       SER  47  14.379   7.726  -1.362
  383   2HB   SER  47          HB2       SER  47  15.683   6.538  -1.311
  384    HG   SER  47           HG       SER  47  15.831   6.601  -3.511
  385    H    TYR  48           HN       TYR  48  13.581   4.827   0.385
  386    HA   TYR  48           HA       TYR  48  11.022   5.997   1.175
  387   1HB   TYR  48          HB1       TYR  48  12.563   3.547   2.024
  388   2HB   TYR  48          HB2       TYR  48  11.132   4.113   2.879
  389    HD1  TYR  48           HD1      TYR  48   8.931   3.997   1.880
  390    HD2  TYR  48           HD2      TYR  48  12.388   2.568  -0.239
  391    HE1  TYR  48           HE1      TYR  48   7.454   2.681   0.374
  392    HE2  TYR  48           HE2      TYR  48  10.922   1.248  -1.751
  393    HH   TYR  48           HH       TYR  48   7.962   0.314  -0.981
  394    H    THR  49           HN       THR  49  10.815   6.708   3.514
  395    HA   THR  49           HA       THR  49  12.866   8.505   4.336
  396    HB   THR  49           HB       THR  49  11.382   8.570   6.497
  397    HG1  THR  49           HG1      THR  49   9.358   7.779   4.757
  398   1HG2  THR  49          HG21      THR  49   9.813  10.121   5.343
  399   2HG2  THR  49          HG22      THR  49  10.536   9.623   3.813
  400   3HG2  THR  49          HG23      THR  49  11.522  10.433   5.032
  401    H    ASP  50           HN       ASP  50  13.775   8.639   6.522
  402    HA   ASP  50           HA       ASP  50  15.352   6.530   7.301
  403   1HB   ASP  50          HB1       ASP  50  15.735   8.877   7.885
  404   2HB   ASP  50          HB2       ASP  50  14.337   8.854   8.956
  405    H    ALA  51           HN       ALA  51  12.078   7.259   8.366
  406    HA   ALA  51           HA       ALA  51  12.078   5.359  10.526
  407   1HB   ALA  51          HB1       ALA  51   9.841   6.206  10.963
  408   2HB   ALA  51          HB2       ALA  51   9.856   7.083   9.433
  409   3HB   ALA  51          HB3       ALA  51  10.973   7.538  10.719
  410    H    ASN  52           HN       ASN  52  10.778   5.375   7.187
  411    HA   ASN  52           HA       ASN  52   9.046   3.143   7.609
  412   1HB   ASN  52          HB1       ASN  52   8.320   4.462   5.868
  413   2HB   ASN  52          HB2       ASN  52   9.944   4.753   5.261
  414   1HD2  ASN  52          HD21      ASN  52   7.123   2.796   4.922
  415   2HD2  ASN  52          HD22      ASN  52   7.757   1.860   3.618
  416    H    ILE  53           HN       ILE  53  12.355   3.444   6.379
  417    HA   ILE  53           HA       ILE  53  12.732   0.727   5.715
  418    HB   ILE  53           HB       ILE  53  14.693   2.894   6.406
  419   1HG1  ILE  53          HG11      ILE  53  13.991   1.714   3.699
  420   2HG1  ILE  53          HG12      ILE  53  13.238   3.169   4.345
  421   1HG2  ILE  53          HG21      ILE  53  15.315   0.233   5.102
  422   2HG2  ILE  53          HG22      ILE  53  15.690   0.642   6.776
  423   3HG2  ILE  53          HG23      ILE  53  16.461   1.527   5.461
  424   1HD1  ILE  53          HD11      ILE  53  15.041   3.690   2.760
  425   2HD1  ILE  53          HD12      ILE  53  16.190   2.835   3.788
  426   3HD1  ILE  53          HD13      ILE  53  15.402   4.298   4.376
  427    H    LYS  54           HN       LYS  54  14.286   2.363   8.534
  428    HA   LYS  54           HA       LYS  54  14.872   0.330  10.168
  429   1HB   LYS  54          HB1       LYS  54  13.568   2.942  10.921
  430   2HB   LYS  54          HB2       LYS  54  14.337   1.853  12.078
  431   1HG   LYS  54          HG1       LYS  54  16.468   2.063  10.946
  432   2HG   LYS  54          HG2       LYS  54  15.731   3.038   9.671
  433   1HD   LYS  54          HD1       LYS  54  15.185   4.782  11.322
  434   2HD   LYS  54          HD2       LYS  54  15.941   3.806  12.592
  435   1HE   LYS  54          HE1       LYS  54  18.093   4.036  11.644
  436   2HE   LYS  54          HE2       LYS  54  17.441   4.602  10.103
  437   1HZ   LYS  54          HZ1       LYS  54  16.611   6.583  11.360
  438   2HZ   LYS  54          HZ2       LYS  54  18.294   6.467  11.205
  439   3HZ   LYS  54          HZ3       LYS  54  17.553   6.058  12.670
  440    H    LYS  55           HN       LYS  55  11.670   0.933   9.163
  441    HA   LYS  55           HA       LYS  55  10.315  -0.203  11.449
  442   1HB   LYS  55          HB1       LYS  55   9.417   1.679  10.153
  443   2HB   LYS  55          HB2       LYS  55   9.270   0.647   8.749
  444   1HG   LYS  55          HG1       LYS  55   7.116   0.949   9.661
  445   2HG   LYS  55          HG2       LYS  55   7.599  -0.706   9.986
  446   1HD   LYS  55          HD1       LYS  55   8.358   0.695  12.271
  447   2HD   LYS  55          HD2       LYS  55   6.810   1.404  11.817
  448   1HE   LYS  55          HE1       LYS  55   6.308  -0.389  13.291
  449   2HE   LYS  55          HE2       LYS  55   5.913  -0.967  11.671
  450   1HZ   LYS  55          HZ1       LYS  55   8.143  -2.038  11.632
  451   2HZ   LYS  55          HZ2       LYS  55   7.103  -2.671  12.801
  452   3HZ   LYS  55          HZ3       LYS  55   8.335  -1.612  13.262
  453    H    ASN  56           HN       ASN  56  11.238  -1.356   8.282
  454    HA   ASN  56           HA       ASN  56  10.828  -3.193   7.044
  455   1HB   ASN  56          HB1       ASN  56  12.417  -3.848   9.437
  456   2HB   ASN  56          HB2       ASN  56  11.846  -5.225   8.520
  457   1HD2  ASN  56          HD21      ASN  56  13.801  -2.213   8.183
  458   2HD2  ASN  56          HD22      ASN  56  14.423  -2.844   6.721
  459    H    VAL  57           HN       VAL  57   8.324  -2.664   8.053
  460    HA   VAL  57           HA       VAL  57   7.194  -4.922   9.387
  461    HB   VAL  57           HB       VAL  57   6.355  -2.334   8.850
  462   1HG1  VAL  57          HG11      VAL  57   4.259  -4.174   7.712
  463   2HG1  VAL  57          HG12      VAL  57   5.254  -3.098   6.731
  464   3HG1  VAL  57          HG13      VAL  57   4.154  -2.428   7.937
  465   1HG2  VAL  57          HG21      VAL  57   6.091  -3.736  10.854
  466   2HG2  VAL  57          HG22      VAL  57   4.796  -4.613  10.040
  467   3HG2  VAL  57          HG23      VAL  57   4.609  -2.897  10.397
  468    H    LEU  58           HN       LEU  58   6.412  -6.785   8.561
  469    HA   LEU  58           HA       LEU  58   6.828  -7.241   5.736
  470   1HB   LEU  58          HB1       LEU  58   7.567  -8.865   7.512
  471   2HB   LEU  58          HB2       LEU  58   5.870  -9.223   7.808
  472    HG   LEU  58           HG       LEU  58   6.704  -9.438   4.973
  473   1HD1  LEU  58          HD11      LEU  58   8.698 -10.335   6.078
  474   2HD1  LEU  58          HD12      LEU  58   7.780 -11.620   5.294
  475   3HD1  LEU  58          HD13      LEU  58   7.687 -11.413   7.043
  476   1HD2  LEU  58          HD21      LEU  58   4.457 -10.137   5.808
  477   2HD2  LEU  58          HD22      LEU  58   5.245 -11.386   6.770
  478   3HD2  LEU  58          HD23      LEU  58   5.344 -11.437   5.011
  479    H    TRP  59           HN       TRP  59   5.316  -6.340   4.514
  480    HA   TRP  59           HA       TRP  59   2.640  -5.876   5.157
  481   1HB   TRP  59          HB1       TRP  59   3.881  -6.196   2.425
  482   2HB   TRP  59          HB2       TRP  59   2.346  -5.423   2.769
  483    HD1  TRP  59           HD1      TRP  59   5.754  -4.585   2.006
  484    HE1  TRP  59           HE1      TRP  59   6.315  -2.167   2.706
  485    HE3  TRP  59           HE3      TRP  59   1.709  -3.564   4.965
  486    HZ2  TRP  59           HZ2      TRP  59   5.283  -0.129   4.426
  487    HZ3  TRP  59           HZ3      TRP  59   1.512  -1.377   6.087
  488    HH2  TRP  59           HH2      TRP  59   3.266   0.341   5.833
  489    H    ASP  60           HN       ASP  60   1.140  -7.265   5.506
  490    HA   ASP  60           HA       ASP  60   0.750  -9.710   3.955
  491   1HB   ASP  60          HB1       ASP  60   1.184 -10.918   5.784
  492   2HB   ASP  60          HB2       ASP  60   1.497  -9.450   6.693
  493    H    GLU  61           HN       GLU  61  -1.637 -10.511   5.027
  494    HA   GLU  61           HA       GLU  61  -3.511  -8.876   3.687
  495   1HB   GLU  61          HB1       GLU  61  -3.483 -11.491   4.763
  496   2HB   GLU  61          HB2       GLU  61  -4.807 -10.651   5.564
  497   1HG   GLU  61          HG1       GLU  61  -5.862 -11.527   3.698
  498   2HG   GLU  61          HG2       GLU  61  -5.448  -9.902   3.145
  499    H    ASN  62           HN       ASN  62  -3.113  -9.520   7.190
  500    HA   ASN  62           HA       ASN  62  -4.958  -7.449   7.926
  501   1HB   ASN  62          HB1       ASN  62  -4.871  -9.443   9.240
  502   2HB   ASN  62          HB2       ASN  62  -3.142  -9.282   9.495
  503   1HD2  ASN  62          HD21      ASN  62  -2.401  -7.732  10.987
  504   2HD2  ASN  62          HD22      ASN  62  -3.459  -7.038  12.161
  505    H    ASN  63           HN       ASN  63  -1.371  -7.760   8.239
  506    HA   ASN  63           HA       ASN  63  -0.775  -5.379   9.433
  507   1HB   ASN  63          HB1       ASN  63   0.905  -7.000   9.092
  508   2HB   ASN  63          HB2       ASN  63   0.701  -6.971   7.351
  509   1HD2  ASN  63          HD21      ASN  63   1.906  -5.011  10.090
  510   2HD2  ASN  63          HD22      ASN  63   2.801  -4.025   8.989
  511    H    MET  64           HN       MET  64  -1.269  -5.667   5.842
  512    HA   MET  64           HA       MET  64  -0.648  -3.015   5.238
  513   1HB   MET  64          HB1       MET  64  -0.957  -4.832   3.591
  514   2HB   MET  64          HB2       MET  64  -2.693  -4.750   3.854
  515   1HG   MET  64          HG1       MET  64  -2.802  -2.546   2.953
  516   2HG   MET  64          HG2       MET  64  -1.054  -2.419   2.895
  517   1HE   MET  64          HE1       MET  64  -4.298  -3.357   1.107
  518   2HE   MET  64          HE2       MET  64  -3.835  -4.975   1.638
  519   3HE   MET  64          HE3       MET  64  -3.822  -4.574  -0.080
  520    H    SER  65           HN       SER  65  -3.748  -4.304   6.426
  521    HA   SER  65           HA       SER  65  -5.227  -1.908   6.226
  522   1HB   SER  65          HB1       SER  65  -5.640  -4.225   8.117
  523   2HB   SER  65          HB2       SER  65  -6.811  -2.958   7.778
  524    HG   SER  65           HG       SER  65  -6.121  -5.175   6.312
  525    H    GLU  66           HN       GLU  66  -3.175  -3.139   8.836
  526    HA   GLU  66           HA       GLU  66  -3.805  -1.368  10.875
  527   1HB   GLU  66          HB1       GLU  66  -1.057  -2.473  10.232
  528   2HB   GLU  66          HB2       GLU  66  -1.652  -1.974  11.812
  529   1HG   GLU  66          HG1       GLU  66  -3.271  -3.791  11.812
  530   2HG   GLU  66          HG2       GLU  66  -2.756  -4.273  10.195
  531    H    TYR  67           HN       TYR  67  -1.436  -1.010   8.275
  532    HA   TYR  67           HA       TYR  67  -0.604   1.645   8.911
  533   1HB   TYR  67          HB1       TYR  67   0.970   0.213   7.903
  534   2HB   TYR  67          HB2       TYR  67  -0.141  -0.247   6.627
  535    HD1  TYR  67           HD1      TYR  67  -0.176   0.916   4.556
  536    HD2  TYR  67           HD2      TYR  67   1.923   2.551   7.928
  537    HE1  TYR  67           HE1      TYR  67   0.986   2.521   3.046
  538    HE2  TYR  67           HE2      TYR  67   3.134   4.126   6.433
  539    HH   TYR  67           HH       TYR  67   2.366   4.383   2.995
  540    H    LEU  68           HN       LEU  68  -2.808   0.318   6.364
  541    HA   LEU  68           HA       LEU  68  -3.265   2.724   5.040
  542   1HB   LEU  68          HB1       LEU  68  -5.065   0.355   5.461
  543   2HB   LEU  68          HB2       LEU  68  -5.491   1.705   4.424
  544    HG   LEU  68           HG       LEU  68  -3.197  -0.230   4.044
  545   1HD1  LEU  68          HD11      LEU  68  -5.427  -1.017   3.429
  546   2HD1  LEU  68          HD12      LEU  68  -4.468  -0.722   1.978
  547   3HD1  LEU  68          HD13      LEU  68  -5.698   0.440   2.473
  548   1HD2  LEU  68          HD21      LEU  68  -2.537   2.112   3.369
  549   2HD2  LEU  68          HD22      LEU  68  -3.914   2.121   2.268
  550   3HD2  LEU  68          HD23      LEU  68  -2.602   0.967   2.029
  551    H    THR  69           HN       THR  69  -4.883   1.594   8.023
  552    HA   THR  69           HA       THR  69  -6.885   3.585   8.071
  553    HB   THR  69           HB       THR  69  -5.810   2.458  10.615
  554    HG1  THR  69           HG1      THR  69  -5.880   0.651   9.365
  555   1HG2  THR  69          HG21      THR  69  -7.784   3.908  10.746
  556   2HG2  THR  69          HG22      THR  69  -8.211   2.242  11.138
  557   3HG2  THR  69          HG23      THR  69  -8.610   2.905   9.553
  558    H    ASN  70           HN       ASN  70  -3.542   3.649   9.218
  559    HA   ASN  70           HA       ASN  70  -3.581   6.504   9.328
  560   1HB   ASN  70          HB1       ASN  70  -4.556   5.827  11.559
  561   2HB   ASN  70          HB2       ASN  70  -2.994   5.115  11.948
  562   1HD2  ASN  70          HD21      ASN  70  -4.391   7.343  13.255
  563   2HD2  ASN  70          HD22      ASN  70  -3.128   8.522  13.253
  564    HA   PRO  71           HA       PRO  71   0.460   4.759   7.926
  565   1HB   PRO  71          HB1       PRO  71   1.057   7.018   6.457
  566   2HB   PRO  71          HB2       PRO  71   0.198   5.607   5.832
  567   1HG   PRO  71          HG1       PRO  71  -0.895   8.208   6.821
  568   2HG   PRO  71          HG2       PRO  71  -1.404   7.233   5.430
  569   1HD   PRO  71          HD1       PRO  71  -2.786   7.228   7.730
  570   2HD   PRO  71          HD2       PRO  71  -2.613   5.757   6.749
  571    H    LYS  72           HN       LYS  72  -0.315   7.886   9.336
  572    HA   LYS  72           HA       LYS  72   2.355   8.651   9.985
  573   1HB   LYS  72          HB1       LYS  72  -0.358   9.723  10.522
  574   2HB   LYS  72          HB2       LYS  72   0.908  10.187  11.646
  575   1HG   LYS  72          HG1       LYS  72   0.900  11.911  10.095
  576   2HG   LYS  72          HG2       LYS  72   2.235  10.895   9.563
  577   1HD   LYS  72          HD1       LYS  72   0.445   9.811   8.007
  578   2HD   LYS  72          HD2       LYS  72  -0.464  11.291   8.318
  579   1HE   LYS  72          HE1       LYS  72   0.691  11.874   6.414
  580   2HE   LYS  72          HE2       LYS  72   1.771  12.472   7.664
  581   1HZ   LYS  72          HZ1       LYS  72   2.087  10.124   5.914
  582   2HZ   LYS  72          HZ2       LYS  72   2.908  10.205   7.389
  583   3HZ   LYS  72          HZ3       LYS  72   3.173  11.394   6.221
  584    H    LYS  73           HN       LYS  73  -0.195   6.960  11.745
  585    HA   LYS  73           HA       LYS  73   1.267   6.994  14.221
  586   1HB   LYS  73          HB1       LYS  73  -1.127   6.964  14.352
  587   2HB   LYS  73          HB2       LYS  73  -1.216   5.491  13.397
  588   1HG   LYS  73          HG1       LYS  73  -1.617   4.999  15.739
  589   2HG   LYS  73          HG2       LYS  73  -0.120   4.244  15.209
  590   1HD   LYS  73          HD1       LYS  73   0.923   6.495  16.184
  591   2HD   LYS  73          HD2       LYS  73  -0.553   6.473  17.145
  592   1HE   LYS  73          HE1       LYS  73   1.221   5.393  18.382
  593   2HE   LYS  73          HE2       LYS  73   0.024   4.188  17.918
  594   1HZ   LYS  73          HZ1       LYS  73   1.578   3.048  16.868
  595   2HZ   LYS  73          HZ2       LYS  73   2.743   4.130  17.438
  596   3HZ   LYS  73          HZ3       LYS  73   2.021   4.390  15.933
  597    H    TYR  74           HN       TYR  74   0.858   4.628  11.623
  598    HA   TYR  74           HA       TYR  74   2.267   2.526  12.948
  599   1HB   TYR  74          HB1       TYR  74   0.538   2.535  10.945
  600   2HB   TYR  74          HB2       TYR  74   2.014   2.607   9.982
  601    HD1  TYR  74           HD1      TYR  74   2.957   0.544   9.315
  602    HD2  TYR  74           HD2      TYR  74   0.677   0.819  12.950
  603    HE1  TYR  74           HE1      TYR  74   3.189  -1.921   9.646
  604    HE2  TYR  74           HE2      TYR  74   0.892  -1.628  13.289
  605    HH   TYR  74           HH       TYR  74   1.233  -3.665  11.723
  606    H    ILE  75           HN       ILE  75   3.199   4.927  10.557
  607    HA   ILE  75           HA       ILE  75   6.038   4.380  11.029
  608    HB   ILE  75           HB       ILE  75   4.813   4.894   8.306
  609   1HG1  ILE  75          HG11      ILE  75   6.221   2.412   9.358
  610   2HG1  ILE  75          HG12      ILE  75   4.483   2.550   9.139
  611   1HG2  ILE  75          HG21      ILE  75   7.048   4.802   7.443
  612   2HG2  ILE  75          HG22      ILE  75   7.696   4.290   9.000
  613   3HG2  ILE  75          HG23      ILE  75   7.073   5.926   8.802
  614   1HD1  ILE  75          HD11      ILE  75   5.633   1.288   7.332
  615   2HD1  ILE  75          HD12      ILE  75   6.498   2.762   6.897
  616   3HD1  ILE  75          HD13      ILE  75   4.743   2.693   6.744
  617    HA   PRO  76           HA       PRO  76   5.049   8.771  11.989
  618   1HB   PRO  76          HB1       PRO  76   7.010   8.999  13.871
  619   2HB   PRO  76          HB2       PRO  76   5.394   8.375  14.217
  620   1HG   PRO  76          HG1       PRO  76   7.937   6.881  13.722
  621   2HG   PRO  76          HG2       PRO  76   6.669   6.568  14.921
  622   1HD   PRO  76          HD1       PRO  76   6.874   5.161  12.620
  623   2HD   PRO  76          HD2       PRO  76   5.314   5.500  13.394
  624    H    GLY  77           HN       GLY  77   5.772   9.884  10.234
  625   1HA   GLY  77          HA1       GLY  77   7.498  11.509   9.632
  626   2HA   GLY  77          HA2       GLY  77   8.683  10.249   9.915
  627    H    THR  78           HN       THR  78   6.209   8.705   8.376
  628    HA   THR  78           HA       THR  78   7.538   8.401   5.896
  629    HB   THR  78           HB       THR  78   5.740   6.948   7.272
  630    HG1  THR  78           HG1      THR  78   7.103   6.674   5.087
  631   1HG2  THR  78          HG21      THR  78   4.177   8.008   4.918
  632   2HG2  THR  78          HG22      THR  78   3.743   8.146   6.622
  633   3HG2  THR  78          HG23      THR  78   3.767   6.564   5.844
  634    H    LYS  79           HN       LYS  79   7.002   9.014   3.828
  635    HA   LYS  79           HA       LYS  79   5.903  11.616   3.471
  636   1HB   LYS  79          HB1       LYS  79   6.407   9.592   1.299
  637   2HB   LYS  79          HB2       LYS  79   6.433  11.343   1.168
  638   1HG   LYS  79          HG1       LYS  79   8.468  11.381   2.592
  639   2HG   LYS  79          HG2       LYS  79   8.459   9.610   2.586
  640   1HD   LYS  79          HD1       LYS  79   8.197  10.211  -0.092
  641   2HD   LYS  79          HD2       LYS  79   9.283  11.485   0.477
  642   1HE   LYS  79          HE1       LYS  79  10.854   9.878   0.068
  643   2HE   LYS  79          HE2       LYS  79  10.419   9.401   1.709
  644   1HZ   LYS  79          HZ1       LYS  79   9.340   7.563   0.988
  645   2HZ   LYS  79          HZ2       LYS  79  10.437   7.701  -0.289
  646   3HZ   LYS  79          HZ3       LYS  79   8.859   8.267  -0.478
  647    H    MET  80           HN       MET  80   4.371   8.433   3.281
  648    HA   MET  80           HA       MET  80   2.247   9.186   1.583
  649   1HB   MET  80          HB1       MET  80   2.471   6.916   1.596
  650   2HB   MET  80          HB2       MET  80   2.817   6.845   3.327
  651   1HG   MET  80          HG1       MET  80   0.620   6.898   3.926
  652   2HG   MET  80          HG2       MET  80   0.134   7.792   2.499
  653   1HE   MET  80          HE1       MET  80  -1.490   5.229   3.897
  654   2HE   MET  80          HE2       MET  80  -2.151   4.672   2.360
  655   3HE   MET  80          HE3       MET  80  -2.013   6.399   2.686
  656    H    ALA  81           HN       ALA  81   1.049  10.834   1.986
  657    HA   ALA  81           HA       ALA  81  -0.154  11.245   4.620
  658   1HB   ALA  81          HB1       ALA  81   0.529  13.318   2.554
  659   2HB   ALA  81          HB2       ALA  81   1.473  12.933   3.992
  660   3HB   ALA  81          HB3       ALA  81  -0.143  13.616   4.158
  661    H    PHE  82           HN       PHE  82  -1.307   9.644   2.590
  662    HA   PHE  82           HA       PHE  82  -3.422  10.615   1.142
  663   1HB   PHE  82          HB1       PHE  82  -2.753   8.530   0.514
  664   2HB   PHE  82          HB2       PHE  82  -2.583   7.956   2.168
  665    HD1  PHE  82           HD1      PHE  82  -5.154   8.893  -0.392
  666    HD2  PHE  82           HD2      PHE  82  -4.235   6.617   3.142
  667    HE1  PHE  82           HE1      PHE  82  -7.412   7.851  -0.474
  668    HE2  PHE  82           HE2      PHE  82  -6.495   5.586   3.068
  669    HZ   PHE  82           HZ       PHE  82  -8.090   6.219   1.271
  670    H    GLY  83           HN       GLY  83  -3.424  10.045   4.620
  671   1HA   GLY  83          HA1       GLY  83  -5.192  11.211   5.863
  672   2HA   GLY  83          HA2       GLY  83  -6.312  10.695   4.622
  673    H    GLY  84           HN       GLY  84  -5.468   7.929   4.547
  674   1HA   GLY  84          HA1       GLY  84  -5.374   5.946   5.796
  675   2HA   GLY  84          HA2       GLY  84  -5.828   6.843   7.233
  676    H    LEU  85           HN       LEU  85  -6.872   4.626   5.025
  677    HA   LEU  85           HA       LEU  85  -9.669   5.259   4.862
  678   1HB   LEU  85          HB1       LEU  85  -7.954   2.974   3.960
  679   2HB   LEU  85          HB2       LEU  85  -9.695   2.791   3.995
  680    HG   LEU  85           HG       LEU  85  -8.169   4.845   2.372
  681   1HD1  LEU  85          HD11      LEU  85  -7.877   2.700   1.390
  682   2HD1  LEU  85          HD12      LEU  85  -9.180   3.472   0.485
  683   3HD1  LEU  85          HD13      LEU  85  -9.554   2.249   1.700
  684   1HD2  LEU  85          HD21      LEU  85 -10.317   5.310   1.278
  685   2HD2  LEU  85          HD22      LEU  85 -10.398   5.703   2.995
  686   3HD2  LEU  85          HD23      LEU  85 -11.134   4.218   2.396
  687    H    LYS  86           HN       LYS  86 -10.418   5.418   6.847
  688    HA   LYS  86           HA       LYS  86 -10.084   3.802   9.086
  689   1HB   LYS  86          HB1       LYS  86 -12.451   5.575   8.474
  690   2HB   LYS  86          HB2       LYS  86 -11.864   5.097  10.061
  691   1HG   LYS  86          HG1       LYS  86 -10.212   6.725   8.127
  692   2HG   LYS  86          HG2       LYS  86 -11.275   7.448   9.337
  693   1HD   LYS  86          HD1       LYS  86 -10.021   6.331  11.125
  694   2HD   LYS  86          HD2       LYS  86  -8.978   5.562   9.930
  695   1HE   LYS  86          HE1       LYS  86  -9.231   8.558  10.203
  696   2HE   LYS  86          HE2       LYS  86  -8.030   7.617  11.084
  697   1HZ   LYS  86          HZ1       LYS  86  -8.282   7.639   8.128
  698   2HZ   LYS  86          HZ2       LYS  86  -7.048   6.929   9.039
  699   3HZ   LYS  86          HZ3       LYS  86  -7.201   8.612   8.999
  700    H    LYS  87           HN       LYS  87 -12.370   3.455   6.454
  701    HA   LYS  87           HA       LYS  87 -14.191   1.669   7.770
  702   1HB   LYS  87          HB1       LYS  87 -13.754   2.148   4.832
  703   2HB   LYS  87          HB2       LYS  87 -15.133   1.360   5.550
  704   1HG   LYS  87          HG1       LYS  87 -15.633   3.686   6.626
  705   2HG   LYS  87          HG2       LYS  87 -14.522   4.296   5.361
  706   1HD   LYS  87          HD1       LYS  87 -15.871   2.352   4.050
  707   2HD   LYS  87          HD2       LYS  87 -17.117   2.911   5.114
  708   1HE   LYS  87          HE1       LYS  87 -17.484   4.790   3.862
  709   2HE   LYS  87          HE2       LYS  87 -15.821   4.830   3.234
  710   1HZ   LYS  87          HZ1       LYS  87 -17.730   2.630   2.647
  711   2HZ   LYS  87          HZ2       LYS  87 -16.222   2.884   1.934
  712   3HZ   LYS  87          HZ3       LYS  87 -17.499   3.953   1.609
  713    H    GLU  88           HN       GLU  88 -13.297  -0.250   8.409
  714    HA   GLU  88           HA       GLU  88 -11.325  -1.772   7.205
  715   1HB   GLU  88          HB1       GLU  88 -12.350  -1.939   9.531
  716   2HB   GLU  88          HB2       GLU  88 -13.589  -2.948   8.789
  717   1HG   GLU  88          HG1       GLU  88 -11.576  -4.324   7.867
  718   2HG   GLU  88          HG2       GLU  88 -10.666  -3.516   9.152
  719    H    LYS  89           HN       LYS  89 -14.853  -2.127   6.689
  720    HA   LYS  89           HA       LYS  89 -14.790  -4.434   5.133
  721   1HB   LYS  89          HB1       LYS  89 -16.806  -2.272   4.633
  722   2HB   LYS  89          HB2       LYS  89 -17.029  -4.019   4.684
  723   1HG   LYS  89          HG1       LYS  89 -16.166  -2.570   7.152
  724   2HG   LYS  89          HG2       LYS  89 -17.856  -2.534   6.670
  725   1HD   LYS  89          HD1       LYS  89 -17.760  -4.336   8.161
  726   2HD   LYS  89          HD2       LYS  89 -17.630  -5.129   6.582
  727   1HE   LYS  89          HE1       LYS  89 -15.444  -5.696   6.889
  728   2HE   LYS  89          HE2       LYS  89 -15.081  -4.226   7.792
  729   1HZ   LYS  89          HZ1       LYS  89 -16.063  -6.807   8.751
  730   2HZ   LYS  89          HZ2       LYS  89 -16.593  -5.421   9.559
  731   3HZ   LYS  89          HZ3       LYS  89 -14.938  -5.743   9.448
  732    H    ASP  90           HN       ASP  90 -14.472  -1.116   4.226
  733    HA   ASP  90           HA       ASP  90 -14.318  -1.255   1.466
  734   1HB   ASP  90          HB1       ASP  90 -13.659   0.628   3.653
  735   2HB   ASP  90          HB2       ASP  90 -12.877   0.939   2.114
  736    H    ARG  91           HN       ARG  91 -11.654  -1.468   3.910
  737    HA   ARG  91           HA       ARG  91  -9.621  -1.755   1.914
  738   1HB   ARG  91          HB1       ARG  91  -9.355  -2.587   4.812
  739   2HB   ARG  91          HB2       ARG  91  -8.049  -2.302   3.666
  740   1HG   ARG  91          HG1       ARG  91  -8.616   0.055   3.559
  741   2HG   ARG  91          HG2       ARG  91  -9.991  -0.201   4.621
  742   1HD   ARG  91          HD1       ARG  91  -7.059  -0.360   5.307
  743   2HD   ARG  91          HD2       ARG  91  -8.240   0.795   5.901
  744    HE   ARG  91           HE       ARG  91  -7.866  -1.667   6.099
  745   1HH1  ARG  91          HH21      ARG  91  -9.217   1.138   7.641
  746   2HH1  ARG  91          HH22      ARG  91  -9.833   0.497   9.126
  747   1HH2  ARG  91          HH11      ARG  91  -8.846  -2.733   8.510
  748   2HH2  ARG  91          HH12      ARG  91  -9.664  -1.669   9.597
  749    H    ASN  92           HN       ASN  92 -11.541  -4.101   3.741
  750    HA   ASN  92           HA       ASN  92 -10.268  -6.449   3.331
  751   1HB   ASN  92          HB1       ASN  92 -13.193  -5.772   3.233
  752   2HB   ASN  92          HB2       ASN  92 -12.648  -7.428   3.017
  753   1HD2  ASN  92          HD21      ASN  92 -14.329  -6.603   5.076
  754   2HD2  ASN  92          HD22      ASN  92 -13.429  -7.027   6.491
  755    H    ASP  93           HN       ASP  93 -12.481  -5.060   0.859
  756    HA   ASP  93           HA       ASP  93 -11.825  -6.902  -1.176
  757   1HB   ASP  93          HB1       ASP  93 -13.754  -5.023  -0.892
  758   2HB   ASP  93          HB2       ASP  93 -12.685  -4.201  -2.019
  759    H    LEU  94           HN       LEU  94 -10.373  -3.703  -0.392
  760    HA   LEU  94           HA       LEU  94  -8.782  -3.335  -2.598
  761   1HB   LEU  94          HB1       LEU  94  -8.969  -2.317   0.141
  762   2HB   LEU  94          HB2       LEU  94  -7.378  -2.259  -0.522
  763    HG   LEU  94           HG       LEU  94  -9.707  -1.139  -2.048
  764   1HD1  LEU  94          HD11      LEU  94  -9.587  -0.160   0.248
  765   2HD1  LEU  94          HD12      LEU  94  -9.325   1.010  -1.048
  766   3HD1  LEU  94          HD13      LEU  94  -7.954   0.395  -0.127
  767   1HD2  LEU  94          HD21      LEU  94  -6.855  -0.156  -2.058
  768   2HD2  LEU  94          HD22      LEU  94  -8.147   0.229  -3.192
  769   3HD2  LEU  94          HD23      LEU  94  -7.436  -1.384  -3.184
  770    H    ILE  95           HN       ILE  95  -8.071  -5.262   0.300
  771    HA   ILE  95           HA       ILE  95  -5.392  -5.907  -0.295
  772    HB   ILE  95           HB       ILE  95  -7.284  -7.629   1.308
  773   1HG1  ILE  95          HG11      ILE  95  -5.765  -5.193   2.299
  774   2HG1  ILE  95          HG12      ILE  95  -7.490  -5.203   1.945
  775   1HG2  ILE  95          HG21      ILE  95  -5.291  -8.138   2.646
  776   2HG2  ILE  95          HG22      ILE  95  -4.320  -7.090   1.614
  777   3HG2  ILE  95          HG23      ILE  95  -5.032  -8.561   0.952
  778   1HD1  ILE  95          HD11      ILE  95  -6.069  -6.794   4.082
  779   2HD1  ILE  95          HD12      ILE  95  -7.775  -6.982   3.671
  780   3HD1  ILE  95          HD13      ILE  95  -7.189  -5.450   4.317
  781    H    THR  96           HN       THR  96  -8.431  -7.689  -0.953
  782    HA   THR  96           HA       THR  96  -7.368  -9.938  -2.191
  783    HB   THR  96           HB       THR  96  -9.982  -8.641  -2.983
  784    HG1  THR  96           HG1      THR  96  -9.378  -9.338  -0.600
  785   1HG2  THR  96          HG21      THR  96  -8.936 -11.474  -3.088
  786   2HG2  THR  96          HG22      THR  96  -9.461 -10.472  -4.441
  787   3HG2  THR  96          HG23      THR  96 -10.641 -11.060  -3.270
  788    H    TYR  97           HN       TYR  97  -8.218  -6.808  -3.733
  789    HA   TYR  97           HA       TYR  97  -7.577  -7.567  -6.359
  790   1HB   TYR  97          HB1       TYR  97  -8.853  -5.568  -5.945
  791   2HB   TYR  97          HB2       TYR  97  -7.510  -4.842  -5.071
  792    HD1  TYR  97           HD1      TYR  97  -6.394  -3.171  -6.181
  793    HD2  TYR  97           HD2      TYR  97  -8.032  -6.439  -8.446
  794    HE1  TYR  97           HE1      TYR  97  -5.536  -2.143  -8.275
  795    HE2  TYR  97           HE2      TYR  97  -7.285  -5.360 -10.559
  796    HH   TYR  97           HH       TYR  97  -5.020  -3.192 -10.824
  797    H    LEU  98           HN       LEU  98  -5.492  -5.743  -4.061
  798    HA   LEU  98           HA       LEU  98  -3.174  -5.720  -5.629
  799   1HB   LEU  98          HB1       LEU  98  -3.966  -4.884  -3.051
  800   2HB   LEU  98          HB2       LEU  98  -2.548  -5.904  -2.821
  801    HG   LEU  98           HG       LEU  98  -1.825  -3.589  -3.121
  802   1HD1  LEU  98          HD11      LEU  98  -1.287  -5.203  -5.624
  803   2HD1  LEU  98          HD12      LEU  98  -0.414  -5.372  -4.101
  804   3HD1  LEU  98          HD13      LEU  98  -0.310  -3.866  -5.015
  805   1HD2  LEU  98          HD21      LEU  98  -3.746  -2.746  -4.376
  806   2HD2  LEU  98          HD22      LEU  98  -3.294  -3.740  -5.760
  807   3HD2  LEU  98          HD23      LEU  98  -2.247  -2.417  -5.247
  808    H    LYS  99           HN       LYS  99  -4.227  -7.977  -3.148
  809    HA   LYS  99           HA       LYS  99  -2.092  -9.749  -3.121
  810   1HB   LYS  99          HB1       LYS  99  -3.381 -10.397  -1.411
  811   2HB   LYS  99          HB2       LYS  99  -4.819  -9.684  -2.122
  812   1HG   LYS  99          HG1       LYS  99  -5.105 -11.719  -3.505
  813   2HG   LYS  99          HG2       LYS  99  -3.709 -12.430  -2.720
  814   1HD   LYS  99          HD1       LYS  99  -5.821 -11.549  -0.867
  815   2HD   LYS  99          HD2       LYS  99  -6.311 -12.829  -1.982
  816   1HE   LYS  99          HE1       LYS  99  -5.331 -13.594   0.215
  817   2HE   LYS  99          HE2       LYS  99  -4.607 -14.276  -1.233
  818   1HZ   LYS  99          HZ1       LYS  99  -3.331 -11.895  -0.223
  819   2HZ   LYS  99          HZ2       LYS  99  -2.650 -13.339  -0.792
  820   3HZ   LYS  99          HZ3       LYS  99  -3.248 -13.255   0.791
  821    H    LYS 100           HN       LYS 100  -4.880  -9.649  -5.336
  822    HA   LYS 100           HA       LYS 100  -4.251 -12.024  -6.734
  823   1HB   LYS 100          HB1       LYS 100  -6.408 -10.367  -6.614
  824   2HB   LYS 100          HB2       LYS 100  -5.829 -10.103  -8.242
  825   1HG   LYS 100          HG1       LYS 100  -7.614 -11.809  -8.124
  826   2HG   LYS 100          HG2       LYS 100  -6.109 -12.472  -8.768
  827   1HD   LYS 100          HD1       LYS 100  -6.504 -12.629  -5.858
  828   2HD   LYS 100          HD2       LYS 100  -7.590 -13.595  -6.806
  829   1HE   LYS 100          HE1       LYS 100  -6.003 -15.108  -6.154
  830   2HE   LYS 100          HE2       LYS 100  -5.366 -14.630  -7.736
  831   1HZ   LYS 100          HZ1       LYS 100  -4.446 -12.809  -5.777
  832   2HZ   LYS 100          HZ2       LYS 100  -3.543 -13.836  -6.771
  833   3HZ   LYS 100          HZ3       LYS 100  -4.092 -14.387  -5.265
  834    H    ALA 101           HN       ALA 101  -3.248  -8.837  -7.216
  835    HA   ALA 101           HA       ALA 101  -1.960  -9.063  -9.742
  836   1HB   ALA 101          HB1       ALA 101  -1.855  -6.924  -7.612
  837   2HB   ALA 101          HB2       ALA 101  -2.985  -6.992  -8.964
  838   3HB   ALA 101          HB3       ALA 101  -1.262  -6.763  -9.266
  839    H    THR 102           HN       THR 102  -0.854  -9.229  -6.380
  840    HA   THR 102           HA       THR 102   1.948  -9.470  -6.995
  841    HB   THR 102           HB       THR 102   0.626 -10.029  -4.342
  842    HG1  THR 102           HG1      THR 102   0.170  -7.880  -5.215
  843   1HG2  THR 102          HG21      THR 102   3.420  -9.143  -5.087
  844   2HG2  THR 102          HG22      THR 102   2.958 -10.719  -4.442
  845   3HG2  THR 102          HG23      THR 102   2.804  -9.276  -3.439
  846    H    GLU 103           HN       GLU 103  -0.683 -11.717  -6.093
  847    HA   GLU 103           HA       GLU 103   1.137 -13.936  -6.789
  848   1HB   GLU 103          HB1       GLU 103  -0.729 -15.145  -5.170
  849   2HB   GLU 103          HB2       GLU 103   0.893 -14.681  -4.687
  850   1HG   GLU 103          HG1       GLU 103   0.124 -13.190  -3.245
  851   2HG   GLU 103          HG2       GLU 103  -0.932 -12.464  -4.453
  852    HHA  HEC 104           HA       HEC 104   5.099   3.469   1.374
  853    HHB  HEC 104           HB       HEC 104  -0.675   0.718   0.238
  854    HHC  HEC 104           HC       HEC 104  -3.060   6.514  -1.414
  855    HHD  HEC 104           HD       HEC 104   2.948   8.887  -1.463
  856   1HMA  HEC 104          HMA1      HEC 104   1.094  -0.708   2.061
  857   2HMA  HEC 104          HMA2      HEC 104   2.593  -1.134   1.233
  858   3HMA  HEC 104          HMA3      HEC 104   1.102  -0.939   0.312
  859   1HAA  HEC 104          HAA1      HEC 104   4.166  -0.158   2.116
  860   2HAA  HEC 104          HAA2      HEC 104   4.895   1.400   2.463
  861   1HBA  HEC 104          HBA1      HEC 104   5.742   1.490   0.131
  862   2HBA  HEC 104          HBA2      HEC 104   5.072  -0.109  -0.150
  863   1HMB  HEC 104          HMB1      HEC 104  -2.568   0.449  -0.367
  864   2HMB  HEC 104          HMB2      HEC 104  -3.484   1.051  -1.749
  865   3HMB  HEC 104          HMB3      HEC 104  -4.128   1.234  -0.117
  866    HAB  HEC 104           HAB      HEC 104  -4.502   5.226  -1.429
  867   1HBB  HEC 104          HBB1      HEC 104  -4.848   4.051   0.881
  868   2HBB  HEC 104          HBB2      HEC 104  -5.883   2.993  -0.077
  869   3HBB  HEC 104          HBB3      HEC 104  -6.188   4.731  -0.043
  870   1HMC  HEC 104          HMC1      HEC 104  -3.043   9.079  -1.617
  871   2HMC  HEC 104          HMC2      HEC 104  -2.739   8.319  -3.179
  872   3HMC  HEC 104          HMC3      HEC 104  -2.082   9.918  -2.834
  873    HAC  HEC 104           HAC      HEC 104   1.769   9.950  -2.748
  874   1HBC  HEC 104          HBC1      HEC 104   1.031  11.388  -1.090
  875   2HBC  HEC 104          HBC2      HEC 104  -0.635  11.356  -1.665
  876   3HBC  HEC 104          HBC3      HEC 104   0.611  12.167  -2.615
  877   1HMD  HEC 104          HMD1      HEC 104   5.101   9.239  -0.576
  878   2HMD  HEC 104          HMD2      HEC 104   5.511   8.219  -1.955
  879   3HMD  HEC 104          HMD3      HEC 104   6.545   8.229  -0.526
  880   1HAD  HEC 104          HAD1      HEC 104   7.303   6.346   0.277
  881   2HAD  HEC 104          HAD2      HEC 104   6.813   4.829   1.021
  882   1HBD  HEC 104          HBD1      HEC 104   6.341   5.824   3.060
  883   2HBD  HEC 104          HBD2      HEC 104   6.059   7.398   2.346
  884    H2   4NL 105           H2       4NL 105   0.732 -13.364  -0.673
  885    H6   4NL 105           H6       4NL 105   2.183 -13.784   3.878
  886    H3   4NL 105           H3       4NL 105  -1.664 -10.555   1.616
  887    H5   4NL 105           H5       4NL 105  -0.663 -11.862  -1.610
  888    H4   4NL 105           H4       4NL 105  -0.594 -11.371   3.735
  889    H1   4NL 105           H1       4NL 105   1.802 -14.178   1.445
  890    H7   4NL 105           H7       4NL 105   0.843 -13.096   4.827
  Start of MODEL   22
    1   1H    THR  -5          HT1       THR  -5 -12.155  -6.075  14.022
    2   2H    THR  -5          HT2       THR  -5 -11.712  -5.077  12.728
    3   3H    THR  -5          HT3       THR  -5 -10.632  -5.329  14.006
    4    HA   THR  -5           HA       THR  -5 -10.263  -6.607  11.837
    5    HB   THR  -5           HB       THR  -5 -10.393  -8.450  14.204
    6    HG1  THR  -5           HG1      THR  -5  -8.282  -7.251  14.712
    7   1HG2  THR  -5          HG21      THR  -5  -8.381  -7.772  12.059
    8   2HG2  THR  -5          HG22      THR  -5  -9.236  -9.296  12.301
    9   3HG2  THR  -5          HG23      THR  -5  -7.993  -8.791  13.446
   10    H    GLU  -4           HN       GLU  -4 -11.888  -7.166  10.424
   11    HA   GLU  -4           HA       GLU  -4 -13.345  -9.590  10.846
   12   1HB   GLU  -4          HB1       GLU  -4 -14.817  -7.842  11.982
   13   2HB   GLU  -4          HB2       GLU  -4 -14.991  -7.070  10.410
   14   1HG   GLU  -4          HG1       GLU  -4 -15.671  -9.969  10.739
   15   2HG   GLU  -4          HG2       GLU  -4 -16.813  -8.733  11.252
   16    H    PHE  -3           HN       PHE  -3 -11.867  -9.973   9.104
   17    HA   PHE  -3           HA       PHE  -3 -12.165  -8.550   6.625
   18   1HB   PHE  -3          HB1       PHE  -3  -9.939  -9.214   7.140
   19   2HB   PHE  -3          HB2       PHE  -3 -10.420 -10.891   7.370
   20    HD1  PHE  -3           HD1      PHE  -3  -9.771  -8.244   4.857
   21    HD2  PHE  -3           HD2      PHE  -3 -10.676 -12.399   5.499
   22    HE1  PHE  -3           HE1      PHE  -3  -9.343  -8.708   2.451
   23    HE2  PHE  -3           HE2      PHE  -3 -10.297 -12.855   3.084
   24    HZ   PHE  -3           HZ       PHE  -3  -9.660 -11.002   1.551
   25    H    LYS  -2           HN       LYS  -2 -13.266  -9.018   4.937
   26    HA   LYS  -2           HA       LYS  -2 -14.573 -11.608   4.551
   27   1HB   LYS  -2          HB1       LYS  -2 -15.897  -9.257   5.341
   28   2HB   LYS  -2          HB2       LYS  -2 -16.203  -9.390   3.609
   29   1HG   LYS  -2          HG1       LYS  -2 -16.882 -11.792   4.024
   30   2HG   LYS  -2          HG2       LYS  -2 -16.824 -11.427   5.746
   31   1HD   LYS  -2          HD1       LYS  -2 -18.601 -10.085   3.695
   32   2HD   LYS  -2          HD2       LYS  -2 -19.114 -11.271   4.894
   33   1HE   LYS  -2          HE1       LYS  -2 -17.937  -8.560   5.544
   34   2HE   LYS  -2          HE2       LYS  -2 -19.661  -8.914   5.504
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.895  -8.989   7.753
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.647 -10.057   7.364
   37   3HZ   LYS  -2          HZ3       LYS  -2 -19.251 -10.576   7.268
   38    H    ALA  -1           HN       ALA  -1 -14.154 -12.372   2.624
   39    HA   ALA  -1           HA       ALA  -1 -12.359 -11.374   0.820
   40   1HB   ALA  -1          HB1       ALA  -1 -13.006 -13.711   0.955
   41   2HB   ALA  -1          HB2       ALA  -1 -13.190 -13.123  -0.699
   42   3HB   ALA  -1          HB3       ALA  -1 -14.610 -13.326   0.328
   43    H    GLY   1           HN       GLY   1 -12.424 -10.293  -1.111
   44   1HA   GLY   1          HA1       GLY   1 -14.855  -8.763  -1.771
   45   2HA   GLY   1          HA2       GLY   1 -13.209  -8.215  -2.054
   46    H    SER   2           HN       SER   2 -13.265  -7.921  -4.186
   47    HA   SER   2           HA       SER   2 -13.212 -10.203  -5.958
   48   1HB   SER   2          HB1       SER   2 -15.077  -8.024  -6.812
   49   2HB   SER   2          HB2       SER   2 -15.041  -9.725  -7.292
   50    HG   SER   2           HG       SER   2 -15.605 -10.096  -4.960
   51    H    ALA   3           HN       ALA   3 -11.907  -9.824  -7.715
   52    HA   ALA   3           HA       ALA   3 -10.031  -7.845  -7.735
   53   1HB   ALA   3          HB1       ALA   3 -11.003  -9.177 -10.249
   54   2HB   ALA   3          HB2       ALA   3 -10.070 -10.019  -9.011
   55   3HB   ALA   3          HB3       ALA   3  -9.370  -8.637  -9.852
   56    H    LYS   4           HN       LYS   4 -13.134  -7.656  -9.577
   57    HA   LYS   4           HA       LYS   4 -12.450  -5.102 -10.659
   58   1HB   LYS   4          HB1       LYS   4 -13.881  -6.929 -11.745
   59   2HB   LYS   4          HB2       LYS   4 -15.208  -6.226 -10.820
   60   1HG   LYS   4          HG1       LYS   4 -14.131  -3.981 -11.871
   61   2HG   LYS   4          HG2       LYS   4 -13.729  -5.133 -13.138
   62   1HD   LYS   4          HD1       LYS   4 -15.811  -4.213 -13.769
   63   2HD   LYS   4          HD2       LYS   4 -16.203  -5.795 -13.086
   64   1HE   LYS   4          HE1       LYS   4 -17.700  -3.928 -12.303
   65   2HE   LYS   4          HE2       LYS   4 -16.893  -4.809 -11.005
   66   1HZ   LYS   4          HZ1       LYS   4 -16.913  -2.273 -10.920
   67   2HZ   LYS   4          HZ2       LYS   4 -15.726  -2.345 -12.119
   68   3HZ   LYS   4          HZ3       LYS   4 -15.445  -3.065 -10.616
   69    H    LYS   5           HN       LYS   5 -13.207  -5.645  -7.592
   70    HA   LYS   5           HA       LYS   5 -14.790  -3.173  -7.295
   71   1HB   LYS   5          HB1       LYS   5 -14.462  -5.474  -5.354
   72   2HB   LYS   5          HB2       LYS   5 -15.278  -3.963  -4.969
   73   1HG   LYS   5          HG1       LYS   5 -16.646  -4.622  -7.184
   74   2HG   LYS   5          HG2       LYS   5 -16.190  -6.238  -6.639
   75   1HD   LYS   5          HD1       LYS   5 -17.166  -4.550  -4.462
   76   2HD   LYS   5          HD2       LYS   5 -18.363  -4.767  -5.739
   77   1HE   LYS   5          HE1       LYS   5 -18.603  -6.493  -4.021
   78   2HE   LYS   5          HE2       LYS   5 -18.111  -7.207  -5.557
   79   1HZ   LYS   5          HZ1       LYS   5 -16.049  -7.714  -4.761
   80   2HZ   LYS   5          HZ2       LYS   5 -16.946  -7.850  -3.329
   81   3HZ   LYS   5          HZ3       LYS   5 -16.041  -6.450  -3.628
   82    H    GLY   6           HN       GLY   6 -12.223  -4.975  -5.547
   83   1HA   GLY   6          HA1       GLY   6 -11.219  -2.883  -4.027
   84   2HA   GLY   6          HA2       GLY   6 -10.261  -4.240  -4.594
   85    H    ALA   7           HN       ALA   7 -10.621  -3.561  -7.447
   86    HA   ALA   7           HA       ALA   7  -8.447  -1.875  -7.888
   87   1HB   ALA   7          HB1       ALA   7  -9.048  -1.959 -10.240
   88   2HB   ALA   7          HB2       ALA   7 -10.652  -2.566  -9.829
   89   3HB   ALA   7          HB3       ALA   7  -9.228  -3.552  -9.503
   90    H    THR   8           HN       THR   8 -11.962  -1.034  -8.362
   91    HA   THR   8           HA       THR   8 -11.643   1.564  -9.178
   92    HB   THR   8           HB       THR   8 -13.791   1.846  -7.483
   93    HG1  THR   8           HG1      THR   8 -13.500  -0.476  -7.054
   94   1HG2  THR   8          HG21      THR   8 -13.761   0.718 -10.286
   95   2HG2  THR   8          HG22      THR   8 -13.747   2.430  -9.858
   96   3HG2  THR   8          HG23      THR   8 -15.155   1.437  -9.478
   97    H    LEU   9           HN       LEU   9 -11.217   0.425  -5.879
   98    HA   LEU   9           HA       LEU   9 -11.126   2.959  -4.607
   99   1HB   LEU   9          HB1       LEU   9 -10.501   0.143  -3.850
  100   2HB   LEU   9          HB2       LEU   9  -9.748   1.415  -2.892
  101    HG   LEU   9           HG       LEU   9 -11.760   0.984  -1.759
  102   1HD1  LEU   9          HD11      LEU   9 -11.391   3.391  -2.226
  103   2HD1  LEU   9          HD12      LEU   9 -13.099   2.988  -2.052
  104   3HD1  LEU   9          HD13      LEU   9 -12.413   3.242  -3.656
  105   1HD2  LEU   9          HD21      LEU   9 -12.879  -0.401  -3.449
  106   2HD2  LEU   9          HD22      LEU   9 -13.187   1.033  -4.427
  107   3HD2  LEU   9          HD23      LEU   9 -13.965   0.856  -2.854
  108    H    PHE  10           HN       PHE  10  -8.394   0.715  -4.631
  109    HA   PHE  10           HA       PHE  10  -6.315   2.457  -4.351
  110   1HB   PHE  10          HB1       PHE  10  -6.190  -0.014  -4.255
  111   2HB   PHE  10          HB2       PHE  10  -6.296  -0.073  -6.007
  112    HD1  PHE  10           HD1      PHE  10  -4.410   1.136  -7.351
  113    HD2  PHE  10           HD2      PHE  10  -4.127   0.061  -3.197
  114    HE1  PHE  10           HE1      PHE  10  -1.924   1.231  -7.492
  115    HE2  PHE  10           HE2      PHE  10  -1.654   0.283  -3.308
  116    HZ   PHE  10           HZ       PHE  10  -0.546   0.842  -5.457
  117    H    LYS  11           HN       LYS  11  -7.803   1.509  -7.440
  118    HA   LYS  11           HA       LYS  11  -5.921   2.962  -9.040
  119   1HB   LYS  11          HB1       LYS  11  -7.642   0.846  -9.479
  120   2HB   LYS  11          HB2       LYS  11  -8.341   2.152 -10.433
  121   1HG   LYS  11          HG1       LYS  11  -6.233   2.516 -11.574
  122   2HG   LYS  11          HG2       LYS  11  -5.440   1.318 -10.556
  123   1HD   LYS  11          HD1       LYS  11  -7.430  -0.192 -11.583
  124   2HD   LYS  11          HD2       LYS  11  -7.205   0.953 -12.907
  125   1HE   LYS  11          HE1       LYS  11  -5.065  -0.796 -11.668
  126   2HE   LYS  11          HE2       LYS  11  -5.823  -1.041 -13.238
  127   1HZ   LYS  11          HZ1       LYS  11  -4.726   0.783 -14.137
  128   2HZ   LYS  11          HZ2       LYS  11  -3.543   0.077 -13.158
  129   3HZ   LYS  11          HZ3       LYS  11  -4.364   1.453 -12.623
  130    H    THR  12           HN       THR  12  -8.177   4.284  -7.185
  131    HA   THR  12           HA       THR  12  -8.537   6.615  -8.897
  132    HB   THR  12           HB       THR  12 -10.596   4.853  -8.273
  133    HG1  THR  12           HG1      THR  12 -10.265   6.238 -10.110
  134   1HG2  THR  12          HG21      THR  12 -11.163   7.519  -6.983
  135   2HG2  THR  12          HG22      THR  12 -10.962   5.993  -6.121
  136   3HG2  THR  12          HG23      THR  12 -12.309   6.202  -7.240
  137    H    ARG  13           HN       ARG  13  -8.060   5.312  -5.776
  138    HA   ARG  13           HA       ARG  13  -7.953   7.918  -4.424
  139   1HB   ARG  13          HB1       ARG  13  -8.415   5.116  -3.507
  140   2HB   ARG  13          HB2       ARG  13  -7.689   6.245  -2.384
  141   1HG   ARG  13          HG1       ARG  13 -10.356   6.616  -3.733
  142   2HG   ARG  13          HG2       ARG  13 -10.121   5.994  -2.106
  143   1HD   ARG  13          HD1       ARG  13 -10.733   8.290  -1.908
  144   2HD   ARG  13          HD2       ARG  13  -9.005   8.189  -1.544
  145    HE   ARG  13           HE       ARG  13 -10.259   8.794  -3.989
  146   1HH1  ARG  13          HH11      ARG  13  -7.817   9.556  -1.610
  147   2HH1  ARG  13          HH12      ARG  13  -6.775  10.537  -2.576
  148   1HH2  ARG  13          HH21      ARG  13  -8.619  10.271  -5.444
  149   2HH2  ARG  13          HH22      ARG  13  -7.230  10.952  -4.670
  150    H    CYS  14           HN       CYS  14  -6.017   5.103  -5.191
  151    HA   CYS  14           HA       CYS  14  -3.692   6.202  -3.763
  152   1HB   CYS  14          HB1       CYS  14  -3.863   3.439  -4.907
  153   2HB   CYS  14          HB2       CYS  14  -2.845   4.024  -3.609
  154    H    LEU  15           HN       LEU  15  -4.936   5.478  -6.924
  155    HA   LEU  15           HA       LEU  15  -2.694   5.162  -8.477
  156   1HB   LEU  15          HB1       LEU  15  -5.156   5.028  -9.119
  157   2HB   LEU  15          HB2       LEU  15  -5.092   6.772  -9.337
  158    HG   LEU  15           HG       LEU  15  -3.219   6.434 -10.987
  159   1HD1  LEU  15          HD11      LEU  15  -2.952   4.203 -11.982
  160   2HD1  LEU  15          HD12      LEU  15  -4.012   3.532 -10.742
  161   3HD1  LEU  15          HD13      LEU  15  -2.456   4.229 -10.290
  162   1HD2  LEU  15          HD21      LEU  15  -4.821   5.205 -12.699
  163   2HD2  LEU  15          HD22      LEU  15  -5.162   6.840 -12.132
  164   3HD2  LEU  15          HD23      LEU  15  -6.001   5.464 -11.414
  165    H    GLN  16           HN       GLN  16  -3.999   8.218  -7.273
  166    HA   GLN  16           HA       GLN  16  -2.801  10.125  -8.759
  167   1HB   GLN  16          HB1       GLN  16  -2.814  11.521  -6.643
  168   2HB   GLN  16          HB2       GLN  16  -4.338  10.790  -7.122
  169   1HG   GLN  16          HG1       GLN  16  -4.109   9.075  -5.428
  170   2HG   GLN  16          HG2       GLN  16  -2.496   9.656  -5.009
  171   1HE2  GLN  16          HE21      GLN  16  -2.327  11.664  -3.849
  172   2HE2  GLN  16          HE22      GLN  16  -3.692  12.327  -3.031
  173    H    CYS  17           HN       CYS  17  -1.083   8.172  -6.360
  174    HA   CYS  17           HA       CYS  17   1.422   9.522  -7.100
  175   1HB   CYS  17          HB1       CYS  17   1.250   8.209  -4.447
  176   2HB   CYS  17          HB2       CYS  17   2.126   9.638  -4.967
  177    H    HIS  18           HN       HIS  18  -0.045   6.411  -6.252
  178    HA   HIS  18           HA       HIS  18   2.450   4.951  -6.623
  179   1HB   HIS  18          HB1       HIS  18  -0.263   4.271  -5.543
  180   2HB   HIS  18          HB2       HIS  18   0.898   3.016  -5.918
  181    HD1  HIS  18           HD1      HIS  18   3.368   3.451  -4.532
  182    HD2  HIS  18           HD2      HIS  18  -0.206   5.089  -3.091
  183    HE1  HIS  18           HE1      HIS  18   3.731   3.864  -2.056
  184    H    THR  19           HN       THR  19   1.927   2.659  -7.497
  185    HA   THR  19           HA       THR  19   0.322   2.565  -9.914
  186    HB   THR  19           HB       THR  19   2.627   1.407 -10.806
  187    HG1  THR  19           HG1      THR  19   4.287   2.860 -10.361
  188   1HG2  THR  19          HG21      THR  19   2.973   3.532 -12.101
  189   2HG2  THR  19          HG22      THR  19   1.663   4.242 -11.157
  190   3HG2  THR  19          HG23      THR  19   1.347   2.858 -12.203
  191    H    VAL  20           HN       VAL  20  -0.788   0.671  -9.892
  192    HA   VAL  20           HA       VAL  20  -0.214  -1.412  -8.014
  193    HB   VAL  20           HB       VAL  20  -2.447  -0.437  -9.082
  194   1HG1  VAL  20          HG11      VAL  20  -2.180  -1.428 -11.265
  195   2HG1  VAL  20          HG12      VAL  20  -3.584  -2.107 -10.437
  196   3HG1  VAL  20          HG13      VAL  20  -2.090  -3.040 -10.547
  197   1HG2  VAL  20          HG21      VAL  20  -2.104  -3.153  -7.839
  198   2HG2  VAL  20          HG22      VAL  20  -3.664  -2.377  -8.106
  199   3HG2  VAL  20          HG23      VAL  20  -2.481  -1.630  -7.035
  200    H    GLU  21           HN       GLU  21   0.432  -1.028 -11.373
  201    HA   GLU  21           HA       GLU  21   1.060  -3.818 -11.881
  202   1HB   GLU  21          HB1       GLU  21   1.603  -1.531 -13.776
  203   2HB   GLU  21          HB2       GLU  21   1.272  -3.209 -14.162
  204   1HG   GLU  21          HG1       GLU  21  -0.649  -2.044 -14.841
  205   2HG   GLU  21          HG2       GLU  21  -1.099  -2.783 -13.307
  206    H    LYS  22           HN       LYS  22   3.372  -4.285 -12.857
  207    HA   LYS  22           HA       LYS  22   5.289  -3.074 -11.116
  208   1HB   LYS  22          HB1       LYS  22   5.094  -5.508 -12.574
  209   2HB   LYS  22          HB2       LYS  22   6.648  -4.742 -12.935
  210   1HG   LYS  22          HG1       LYS  22   5.520  -5.174 -10.164
  211   2HG   LYS  22          HG2       LYS  22   6.793  -6.140 -10.910
  212   1HD   LYS  22          HD1       LYS  22   7.959  -3.813 -11.199
  213   2HD   LYS  22          HD2       LYS  22   6.879  -3.342  -9.886
  214   1HE   LYS  22          HE1       LYS  22   8.462  -5.856  -9.580
  215   2HE   LYS  22          HE2       LYS  22   9.318  -4.332  -9.436
  216   1HZ   LYS  22          HZ1       LYS  22   7.634  -3.749  -7.657
  217   2HZ   LYS  22          HZ2       LYS  22   8.717  -4.981  -7.261
  218   3HZ   LYS  22          HZ3       LYS  22   7.133  -5.365  -7.704
  219    H    GLY  23           HN       GLY  23   4.971  -2.942 -14.691
  220   1HA   GLY  23          HA1       GLY  23   7.300  -1.230 -14.911
  221   2HA   GLY  23          HA2       GLY  23   6.236  -1.716 -16.219
  222    H    GLY  24           HN       GLY  24   5.334  -0.054 -13.216
  223   1HA   GLY  24          HA1       GLY  24   4.092   2.119 -14.723
  224   2HA   GLY  24          HA2       GLY  24   3.776   1.695 -13.049
  225    HA   PRO  25           HA       PRO  25   7.434   4.907 -13.653
  226   1HB   PRO  25          HB1       PRO  25   6.003   7.255 -13.888
  227   2HB   PRO  25          HB2       PRO  25   6.758   6.400 -15.237
  228   1HG   PRO  25          HG1       PRO  25   3.911   6.368 -14.325
  229   2HG   PRO  25          HG2       PRO  25   4.561   6.392 -15.975
  230   1HD   PRO  25          HD1       PRO  25   3.610   4.137 -14.858
  231   2HD   PRO  25          HD2       PRO  25   4.996   4.117 -15.970
  232    H    HIS  26           HN       HIS  26   8.115   5.271 -11.625
  233    HA   HIS  26           HA       HIS  26   6.419   5.334  -9.361
  234   1HB   HIS  26          HB1       HIS  26   9.328   6.095  -9.714
  235   2HB   HIS  26          HB2       HIS  26   8.533   5.913  -8.160
  236    HD2  HIS  26           HD2      HIS  26  10.039   3.875 -11.041
  237    HE1  HIS  26           HE1      HIS  26   9.180   1.123  -7.924
  238    HE2  HIS  26           HE2      HIS  26  10.335   1.434 -10.163
  239    H    LYS  27           HN       LYS  27   5.016   7.052  -9.142
  240    HA   LYS  27           HA       LYS  27   5.813   9.752  -9.809
  241   1HB   LYS  27          HB1       LYS  27   3.221   8.401  -9.130
  242   2HB   LYS  27          HB2       LYS  27   3.339  10.151  -9.106
  243   1HG   LYS  27          HG1       LYS  27   3.621  10.313 -11.389
  244   2HG   LYS  27          HG2       LYS  27   4.327   8.698 -11.519
  245   1HD   LYS  27          HD1       LYS  27   1.409   9.386 -11.076
  246   2HD   LYS  27          HD2       LYS  27   2.122   8.628 -12.506
  247   1HE   LYS  27          HE1       LYS  27   2.515   6.604 -11.389
  248   2HE   LYS  27          HE2       LYS  27   2.390   7.352  -9.797
  249   1HZ   LYS  27          HZ1       LYS  27   0.439   6.036 -10.270
  250   2HZ   LYS  27          HZ2       LYS  27   0.154   6.900 -11.694
  251   3HZ   LYS  27          HZ3       LYS  27   0.015   7.677 -10.199
  252    H    VAL  28           HN       VAL  28   3.778  10.329  -7.359
  253    HA   VAL  28           HA       VAL  28   5.765  11.227  -5.532
  254    HB   VAL  28           HB       VAL  28   2.843  10.906  -4.882
  255   1HG1  VAL  28          HG11      VAL  28   4.198  11.585  -3.008
  256   2HG1  VAL  28          HG12      VAL  28   3.265  12.977  -3.557
  257   3HG1  VAL  28          HG13      VAL  28   4.975  12.843  -3.969
  258   1HG2  VAL  28          HG21      VAL  28   2.860  12.071  -7.009
  259   2HG2  VAL  28          HG22      VAL  28   4.118  13.167  -6.439
  260   3HG2  VAL  28          HG23      VAL  28   2.508  13.226  -5.722
  261    H    GLY  29           HN       GLY  29   4.081   8.274  -5.965
  262   1HA   GLY  29          HA1       GLY  29   5.198   7.114  -3.495
  263   2HA   GLY  29          HA2       GLY  29   3.593   6.703  -4.076
  264    HA   PRO  30           HA       PRO  30   7.212   4.251  -6.234
  265   1HB   PRO  30          HB1       PRO  30   7.796   2.295  -4.460
  266   2HB   PRO  30          HB2       PRO  30   8.641   3.847  -4.493
  267   1HG   PRO  30          HG1       PRO  30   6.398   2.950  -2.718
  268   2HG   PRO  30          HG2       PRO  30   7.886   3.815  -2.287
  269   1HD   PRO  30          HD1       PRO  30   5.519   5.078  -2.590
  270   2HD   PRO  30          HD2       PRO  30   7.064   5.846  -3.011
  271    H    ASN  31           HN       ASN  31   7.173   1.907  -6.891
  272    HA   ASN  31           HA       ASN  31   4.511   1.073  -7.437
  273   1HB   ASN  31          HB1       ASN  31   5.907   0.492  -9.162
  274   2HB   ASN  31          HB2       ASN  31   7.278   0.202  -8.101
  275   1HD2  ASN  31          HD21      ASN  31   4.496  -1.253  -9.631
  276   2HD2  ASN  31          HD22      ASN  31   4.930  -2.882  -9.231
  277    H    LEU  32           HN       LEU  32   3.293  -0.537  -6.479
  278    HA   LEU  32           HA       LEU  32   4.132  -1.616  -3.890
  279   1HB   LEU  32          HB1       LEU  32   1.406  -0.989  -5.027
  280   2HB   LEU  32          HB2       LEU  32   1.664  -1.766  -3.477
  281    HG   LEU  32           HG       LEU  32   2.423   1.061  -4.248
  282   1HD1  LEU  32          HD11      LEU  32   0.907   1.667  -2.423
  283   2HD1  LEU  32          HD12      LEU  32   0.570  -0.038  -2.125
  284   3HD1  LEU  32          HD13      LEU  32   0.069   0.706  -3.643
  285   1HD2  LEU  32          HD21      LEU  32   4.211   0.153  -2.843
  286   2HD2  LEU  32          HD22      LEU  32   3.019  -0.395  -1.664
  287   3HD2  LEU  32          HD23      LEU  32   3.248   1.330  -1.949
  288    H    HIS  33           HN       HIS  33   3.586  -2.669  -7.039
  289    HA   HIS  33           HA       HIS  33   2.321  -5.155  -6.800
  290   1HB   HIS  33          HB1       HIS  33   2.710  -3.735  -8.875
  291   2HB   HIS  33          HB2       HIS  33   4.358  -4.355  -8.882
  292    HD2  HIS  33           HD2      HIS  33   1.370  -6.639  -8.017
  293    HE1  HIS  33           HE1      HIS  33   2.755  -7.808 -11.861
  294    HE2  HIS  33           HE2      HIS  33   1.215  -8.415  -9.933
  295    H    GLY  34           HN       GLY  34   3.211  -6.340  -5.112
  296   1HA   GLY  34          HA1       GLY  34   4.627  -8.378  -4.985
  297   2HA   GLY  34          HA2       GLY  34   5.968  -7.345  -5.436
  298    H    ILE  35           HN       ILE  35   3.897  -5.720  -3.208
  299    HA   ILE  35           HA       ILE  35   5.922  -5.763  -1.239
  300    HB   ILE  35           HB       ILE  35   4.405  -4.615   0.277
  301   1HG1  ILE  35          HG11      ILE  35   2.318  -5.230  -1.779
  302   2HG1  ILE  35          HG12      ILE  35   2.182  -5.157  -0.024
  303   1HG2  ILE  35          HG21      ILE  35   4.235  -2.564  -1.152
  304   2HG2  ILE  35          HG22      ILE  35   4.737  -3.560  -2.517
  305   3HG2  ILE  35          HG23      ILE  35   5.810  -3.357  -1.132
  306   1HD1  ILE  35          HD11      ILE  35   2.359  -2.669  -0.171
  307   2HD1  ILE  35          HD12      ILE  35   0.930  -3.333  -0.964
  308   3HD1  ILE  35          HD13      ILE  35   2.312  -2.817  -1.929
  309    H    PHE  36           HN       PHE  36   3.007  -7.756  -1.514
  310    HA   PHE  36           HA       PHE  36   2.909  -8.822   1.034
  311   1HB   PHE  36          HB1       PHE  36   2.158 -10.060  -1.614
  312   2HB   PHE  36          HB2       PHE  36   1.807 -10.809  -0.057
  313    HD1  PHE  36           HD1      PHE  36   1.181  -8.303   1.506
  314    HD2  PHE  36           HD2      PHE  36  -0.056  -9.628  -2.395
  315    HE1  PHE  36           HE1      PHE  36  -0.868  -6.905   1.690
  316    HE2  PHE  36           HE2      PHE  36  -2.107  -8.231  -2.215
  317    HZ   PHE  36           HZ       PHE  36  -2.509  -6.861  -0.179
  318    H    GLY  37           HN       GLY  37   4.452  -9.651   2.141
  319   1HA   GLY  37          HA1       GLY  37   5.791 -11.482   2.804
  320   2HA   GLY  37          HA2       GLY  37   6.155 -11.807   1.120
  321    H    ARG  38           HN       ARG  38   6.554  -8.585   1.231
  322    HA   ARG  38           HA       ARG  38   9.440  -8.733   1.756
  323   1HB   ARG  38          HB1       ARG  38   7.702  -7.235  -0.115
  324   2HB   ARG  38          HB2       ARG  38   9.004  -6.289   0.590
  325   1HG   ARG  38          HG1       ARG  38  10.629  -7.425  -0.531
  326   2HG   ARG  38          HG2       ARG  38   9.726  -8.942  -0.524
  327   1HD   ARG  38          HD1       ARG  38   9.955  -7.947  -2.799
  328   2HD   ARG  38          HD2       ARG  38   8.276  -8.142  -2.293
  329    HE   ARG  38           HE       ARG  38   8.360  -6.358  -1.593
  330   1HH1  ARG  38          HH21      ARG  38  10.723  -6.771  -4.067
  331   2HH1  ARG  38          HH22      ARG  38  10.343  -5.340  -4.876
  332   1HH2  ARG  38          HH11      ARG  38   8.475  -3.741  -2.709
  333   2HH2  ARG  38          HH12      ARG  38   9.869  -3.629  -3.692
  334    H    HIS  39           HN       HIS  39  10.290  -6.473   2.486
  335    HA   HIS  39           HA       HIS  39   8.824  -5.765   4.929
  336   1HB   HIS  39          HB1       HIS  39  11.719  -5.160   4.262
  337   2HB   HIS  39          HB2       HIS  39  10.943  -5.088   5.847
  338    HD2  HIS  39           HD2      HIS  39  10.020  -7.572   6.817
  339    HE1  HIS  39           HE1      HIS  39  12.796  -9.863   4.547
  340    HE2  HIS  39           HE2      HIS  39  11.091  -9.927   6.428
  341    H    SER  40           HN       SER  40   8.785  -3.465   5.572
  342    HA   SER  40           HA       SER  40   7.993  -1.730   3.529
  343   1HB   SER  40          HB1       SER  40   8.987  -0.474   6.030
  344   2HB   SER  40          HB2       SER  40   7.514  -0.164   5.123
  345    HG   SER  40           HG       SER  40   6.817  -2.280   5.962
  346    H    GLY  41           HN       GLY  41   8.975  -0.214   2.340
  347   1HA   GLY  41          HA1       GLY  41  10.644   1.255   1.650
  348   2HA   GLY  41          HA2       GLY  41  11.666   0.687   2.947
  349    H    GLN  42           HN       GLN  42  10.300  -1.414   0.339
  350    HA   GLN  42           HA       GLN  42  13.048  -1.709  -0.647
  351   1HB   GLN  42          HB1       GLN  42  11.091  -3.980  -0.401
  352   2HB   GLN  42          HB2       GLN  42  12.754  -4.086  -0.967
  353   1HG   GLN  42          HG1       GLN  42  13.591  -3.437   1.211
  354   2HG   GLN  42          HG2       GLN  42  11.953  -3.162   1.797
  355   1HE2  GLN  42          HE21      GLN  42  14.028  -5.013   2.824
  356   2HE2  GLN  42          HE22      GLN  42  13.309  -6.580   2.772
  357    H    ALA  43           HN       ALA  43  10.950  -0.024  -1.982
  358    HA   ALA  43           HA       ALA  43  10.107  -1.274  -4.361
  359   1HB   ALA  43          HB1       ALA  43   9.587   0.946  -5.144
  360   2HB   ALA  43          HB2       ALA  43  10.612   1.657  -3.898
  361   3HB   ALA  43          HB3       ALA  43   9.147   0.788  -3.444
  362    H    GLU  44           HN       GLU  44  11.176  -1.960  -6.075
  363    HA   GLU  44           HA       GLU  44  13.910  -1.631  -6.532
  364   1HB   GLU  44          HB1       GLU  44  11.949  -2.633  -8.608
  365   2HB   GLU  44          HB2       GLU  44  13.644  -3.068  -8.414
  366   1HG   GLU  44          HG1       GLU  44  12.702  -4.910  -7.452
  367   2HG   GLU  44          HG2       GLU  44  12.823  -3.888  -6.034
  368    H    GLY  45           HN       GLY  45  14.271   0.626  -6.510
  369   1HA   GLY  45          HA1       GLY  45  15.326   2.102  -8.165
  370   2HA   GLY  45          HA2       GLY  45  13.856   1.979  -9.105
  371    H    TYR  46           HN       TYR  46  13.272   2.344  -5.746
  372    HA   TYR  46           HA       TYR  46  13.100   5.245  -5.842
  373   1HB   TYR  46          HB1       TYR  46  10.960   4.023  -6.638
  374   2HB   TYR  46          HB2       TYR  46  10.693   3.732  -4.924
  375    HD1  TYR  46           HD1      TYR  46  11.099   6.396  -7.496
  376    HD2  TYR  46           HD2      TYR  46   9.934   5.441  -3.473
  377    HE1  TYR  46           HE1      TYR  46   9.991   8.618  -7.305
  378    HE2  TYR  46           HE2      TYR  46   8.724   7.612  -3.299
  379    HH   TYR  46           HH       TYR  46   8.020   9.540  -6.006
  380    H    SER  47           HN       SER  47  13.284   6.311  -3.925
  381    HA   SER  47           HA       SER  47  14.342   4.834  -1.672
  382   1HB   SER  47          HB1       SER  47  14.084   7.799  -1.588
  383   2HB   SER  47          HB2       SER  47  15.404   6.763  -1.043
  384    HG   SER  47           HG       SER  47  15.478   6.342  -3.516
  385    H    TYR  48           HN       TYR  48  13.836   5.542   0.520
  386    HA   TYR  48           HA       TYR  48  11.056   6.208   1.140
  387   1HB   TYR  48          HB1       TYR  48  12.692   3.830   2.008
  388   2HB   TYR  48          HB2       TYR  48  11.255   4.346   2.887
  389    HD1  TYR  48           HD1      TYR  48   9.047   4.100   1.962
  390    HD2  TYR  48           HD2      TYR  48  12.508   2.896  -0.286
  391    HE1  TYR  48           HE1      TYR  48   7.597   2.728   0.480
  392    HE2  TYR  48           HE2      TYR  48  11.069   1.521  -1.775
  393    HH   TYR  48           HH       TYR  48   8.131   0.452  -0.915
  394    H    THR  49           HN       THR  49  10.829   6.645   3.654
  395    HA   THR  49           HA       THR  49  12.722   8.653   4.473
  396    HB   THR  49           HB       THR  49  11.235   8.538   6.632
  397    HG1  THR  49           HG1      THR  49   9.272   7.673   4.861
  398   1HG2  THR  49          HG21      THR  49  11.314  10.406   5.063
  399   2HG2  THR  49          HG22      THR  49   9.677  10.105   5.647
  400   3HG2  THR  49          HG23      THR  49  10.146   9.581   4.029
  401    H    ASP  50           HN       ASP  50  13.714   8.782   6.584
  402    HA   ASP  50           HA       ASP  50  15.380   6.716   7.303
  403   1HB   ASP  50          HB1       ASP  50  15.806   9.024   7.875
  404   2HB   ASP  50          HB2       ASP  50  14.378   9.078   8.907
  405    H    ALA  51           HN       ALA  51  12.160   7.422   8.565
  406    HA   ALA  51           HA       ALA  51  12.277   5.462  10.665
  407   1HB   ALA  51          HB1       ALA  51  10.054   7.267   9.716
  408   2HB   ALA  51          HB2       ALA  51  11.168   7.572  11.049
  409   3HB   ALA  51          HB3       ALA  51   9.997   6.259  11.164
  410    H    ASN  52           HN       ASN  52  10.808   5.555   7.397
  411    HA   ASN  52           HA       ASN  52   9.173   3.252   7.817
  412   1HB   ASN  52          HB1       ASN  52   8.317   4.551   6.135
  413   2HB   ASN  52          HB2       ASN  52   9.902   4.989   5.511
  414   1HD2  ASN  52          HD21      ASN  52   7.209   2.895   5.090
  415   2HD2  ASN  52          HD22      ASN  52   7.887   2.060   3.741
  416    H    ILE  53           HN       ILE  53  12.432   3.708   6.523
  417    HA   ILE  53           HA       ILE  53  12.866   1.037   5.707
  418    HB   ILE  53           HB       ILE  53  14.786   3.226   6.440
  419   1HG1  ILE  53          HG11      ILE  53  13.984   2.169   3.708
  420   2HG1  ILE  53          HG12      ILE  53  13.266   3.592   4.458
  421   1HG2  ILE  53          HG21      ILE  53  16.500   1.914   5.186
  422   2HG2  ILE  53          HG22      ILE  53  15.368   0.564   5.119
  423   3HG2  ILE  53          HG23      ILE  53  15.976   1.124   6.675
  424   1HD1  ILE  53          HD11      ILE  53  15.406   4.738   4.418
  425   2HD1  ILE  53          HD12      ILE  53  15.009   4.159   2.801
  426   3HD1  ILE  53          HD13      ILE  53  16.196   3.297   3.778
  427    H    LYS  54           HN       LYS  54  14.450   2.591   8.558
  428    HA   LYS  54           HA       LYS  54  15.147   0.508  10.084
  429   1HB   LYS  54          HB1       LYS  54  13.822   3.078  10.916
  430   2HB   LYS  54          HB2       LYS  54  14.508   1.940  12.078
  431   1HG   LYS  54          HG1       LYS  54  16.697   2.136  11.070
  432   2HG   LYS  54          HG2       LYS  54  16.050   3.148   9.776
  433   1HD   LYS  54          HD1       LYS  54  15.315   4.758  11.633
  434   2HD   LYS  54          HD2       LYS  54  16.385   3.827  12.693
  435   1HE   LYS  54          HE1       LYS  54  18.304   4.391  11.442
  436   2HE   LYS  54          HE2       LYS  54  17.346   4.922  10.057
  437   1HZ   LYS  54          HZ1       LYS  54  16.461   6.588  11.909
  438   2HZ   LYS  54          HZ2       LYS  54  17.789   6.925  10.912
  439   3HZ   LYS  54          HZ3       LYS  54  18.039   6.342  12.483
  440    H    LYS  55           HN       LYS  55  11.900   1.049   9.184
  441    HA   LYS  55           HA       LYS  55  10.667  -0.323  11.418
  442   1HB   LYS  55          HB1       LYS  55   9.546   1.573  10.524
  443   2HB   LYS  55          HB2       LYS  55   9.607   0.932   8.898
  444   1HG   LYS  55          HG1       LYS  55   7.423   0.604   9.394
  445   2HG   LYS  55          HG2       LYS  55   8.086  -0.943   9.890
  446   1HD   LYS  55          HD1       LYS  55   7.442   1.355  11.747
  447   2HD   LYS  55          HD2       LYS  55   6.412  -0.048  11.471
  448   1HE   LYS  55          HE1       LYS  55   9.212  -0.124  12.616
  449   2HE   LYS  55          HE2       LYS  55   7.722  -0.252  13.551
  450   1HZ   LYS  55          HZ1       LYS  55   8.528  -2.441  13.185
  451   2HZ   LYS  55          HZ2       LYS  55   8.749  -2.168  11.534
  452   3HZ   LYS  55          HZ3       LYS  55   7.185  -2.244  12.168
  453    H    ASN  56           HN       ASN  56  11.451  -1.111   8.101
  454    HA   ASN  56           HA       ASN  56  10.960  -2.840   6.710
  455   1HB   ASN  56          HB1       ASN  56  12.969  -3.426   8.715
  456   2HB   ASN  56          HB2       ASN  56  12.289  -4.891   8.043
  457   1HD2  ASN  56          HD21      ASN  56  12.719  -1.950   6.069
  458   2HD2  ASN  56          HD22      ASN  56  13.745  -2.895   5.081
  459    H    VAL  57           HN       VAL  57   8.558  -2.633   7.935
  460    HA   VAL  57           HA       VAL  57   7.742  -5.001   9.293
  461    HB   VAL  57           HB       VAL  57   6.629  -2.505   8.861
  462   1HG1  VAL  57          HG11      VAL  57   4.297  -2.953   8.198
  463   2HG1  VAL  57          HG12      VAL  57   4.781  -4.554   7.640
  464   3HG1  VAL  57          HG13      VAL  57   5.423  -3.114   6.849
  465   1HG2  VAL  57          HG21      VAL  57   6.576  -3.805  10.878
  466   2HG2  VAL  57          HG22      VAL  57   5.511  -4.994  10.127
  467   3HG2  VAL  57          HG23      VAL  57   4.931  -3.356  10.427
  468    H    LEU  58           HN       LEU  58   6.918  -6.894   8.515
  469    HA   LEU  58           HA       LEU  58   7.281  -7.365   5.687
  470   1HB   LEU  58          HB1       LEU  58   8.083  -8.954   7.476
  471   2HB   LEU  58          HB2       LEU  58   6.398  -9.354   7.784
  472    HG   LEU  58           HG       LEU  58   7.347  -9.575   4.960
  473   1HD1  LEU  58          HD11      LEU  58   8.116 -11.930   5.488
  474   2HD1  LEU  58          HD12      LEU  58   8.150 -11.448   7.184
  475   3HD1  LEU  58          HD13      LEU  58   9.195 -10.638   6.017
  476   1HD2  LEU  58          HD21      LEU  58   5.905 -11.576   4.980
  477   2HD2  LEU  58          HD22      LEU  58   5.023 -10.131   5.474
  478   3HD2  LEU  58          HD23      LEU  58   5.553 -11.296   6.686
  479    H    TRP  59           HN       TRP  59   5.724  -6.480   4.503
  480    HA   TRP  59           HA       TRP  59   3.049  -6.091   5.169
  481   1HB   TRP  59          HB1       TRP  59   4.291  -6.417   2.438
  482   2HB   TRP  59          HB2       TRP  59   2.710  -5.730   2.756
  483    HD1  TRP  59           HD1      TRP  59   6.089  -4.719   2.025
  484    HE1  TRP  59           HE1      TRP  59   6.491  -2.252   2.658
  485    HE3  TRP  59           HE3      TRP  59   1.920  -3.846   4.856
  486    HZ2  TRP  59           HZ2      TRP  59   5.301  -0.225   4.288
  487    HZ3  TRP  59           HZ3      TRP  59   1.569  -1.641   5.901
  488    HH2  TRP  59           HH2      TRP  59   3.226   0.169   5.632
  489    H    ASP  60           HN       ASP  60   1.611  -7.526   5.592
  490    HA   ASP  60           HA       ASP  60   1.327 -10.056   4.147
  491   1HB   ASP  60          HB1       ASP  60   1.699 -10.999   6.145
  492   2HB   ASP  60          HB2       ASP  60   1.633  -9.448   6.962
  493    H    GLU  61           HN       GLU  61  -1.139 -10.817   4.921
  494    HA   GLU  61           HA       GLU  61  -2.863  -9.246   3.307
  495   1HB   GLU  61          HB1       GLU  61  -3.981 -11.260   5.225
  496   2HB   GLU  61          HB2       GLU  61  -4.430 -10.937   3.553
  497   1HG   GLU  61          HG1       GLU  61  -1.720 -11.869   3.618
  498   2HG   GLU  61          HG2       GLU  61  -2.740 -12.980   4.535
  499    H    ASN  62           HN       ASN  62  -2.846  -9.828   6.840
  500    HA   ASN  62           HA       ASN  62  -4.791  -7.776   7.341
  501   1HB   ASN  62          HB1       ASN  62  -4.751  -9.781   8.684
  502   2HB   ASN  62          HB2       ASN  62  -3.091  -9.484   9.167
  503   1HD2  ASN  62          HD21      ASN  62  -2.678  -7.775  10.643
  504   2HD2  ASN  62          HD22      ASN  62  -3.936  -7.153  11.648
  505    H    ASN  63           HN       ASN  63  -1.236  -8.008   7.886
  506    HA   ASN  63           HA       ASN  63  -0.758  -5.618   9.125
  507   1HB   ASN  63          HB1       ASN  63   0.966  -7.217   8.865
  508   2HB   ASN  63          HB2       ASN  63   0.870  -7.157   7.115
  509   1HD2  ASN  63          HD21      ASN  63   1.892  -5.263   9.967
  510   2HD2  ASN  63          HD22      ASN  63   2.816  -4.219   8.945
  511    H    MET  64           HN       MET  64  -1.113  -5.911   5.522
  512    HA   MET  64           HA       MET  64  -0.504  -3.276   4.891
  513   1HB   MET  64          HB1       MET  64  -0.894  -5.141   3.287
  514   2HB   MET  64          HB2       MET  64  -2.622  -4.954   3.549
  515   1HG   MET  64          HG1       MET  64  -1.381  -2.438   2.868
  516   2HG   MET  64          HG2       MET  64  -1.037  -3.661   1.659
  517   1HE   MET  64          HE1       MET  64  -3.005  -4.923   0.225
  518   2HE   MET  64          HE2       MET  64  -4.712  -4.693   0.606
  519   3HE   MET  64          HE3       MET  64  -3.636  -5.425   1.795
  520    H    SER  65           HN       SER  65  -3.625  -4.511   6.100
  521    HA   SER  65           HA       SER  65  -5.052  -2.083   5.919
  522   1HB   SER  65          HB1       SER  65  -5.840  -3.856   8.122
  523   2HB   SER  65          HB2       SER  65  -6.784  -3.230   6.778
  524    HG   SER  65           HG       SER  65  -5.328  -5.582   7.002
  525    H    GLU  66           HN       GLU  66  -3.053  -3.389   8.543
  526    HA   GLU  66           HA       GLU  66  -3.572  -1.660  10.608
  527   1HB   GLU  66          HB1       GLU  66  -0.851  -2.692   9.753
  528   2HB   GLU  66          HB2       GLU  66  -1.297  -2.158  11.370
  529   1HG   GLU  66          HG1       GLU  66  -2.798  -4.000  11.653
  530   2HG   GLU  66          HG2       GLU  66  -2.628  -4.468   9.961
  531    H    TYR  67           HN       TYR  67  -1.137  -1.170   8.070
  532    HA   TYR  67           HA       TYR  67  -0.408   1.476   8.682
  533   1HB   TYR  67          HB1       TYR  67   1.047  -0.014   7.490
  534   2HB   TYR  67          HB2       TYR  67  -0.123  -0.201   6.197
  535    HD1  TYR  67           HD1      TYR  67  -0.032   1.181   4.289
  536    HD2  TYR  67           HD2      TYR  67   2.078   2.300   7.859
  537    HE1  TYR  67           HE1      TYR  67   1.213   2.912   3.002
  538    HE2  TYR  67           HE2      TYR  67   3.371   3.998   6.583
  539    HH   TYR  67           HH       TYR  67   2.659   4.721   3.204
  540    H    LEU  68           HN       LEU  68  -2.735   0.252   6.188
  541    HA   LEU  68           HA       LEU  68  -3.265   2.727   5.023
  542   1HB   LEU  68          HB1       LEU  68  -4.972   0.279   5.336
  543   2HB   LEU  68          HB2       LEU  68  -5.518   1.692   4.450
  544    HG   LEU  68           HG       LEU  68  -3.315  -0.229   3.744
  545   1HD1  LEU  68          HD11      LEU  68  -5.743   0.960   2.386
  546   2HD1  LEU  68          HD12      LEU  68  -5.533  -0.703   2.936
  547   3HD1  LEU  68          HD13      LEU  68  -4.584  -0.096   1.579
  548   1HD2  LEU  68          HD21      LEU  68  -2.520   1.231   2.000
  549   2HD2  LEU  68          HD22      LEU  68  -2.403   2.125   3.515
  550   3HD2  LEU  68          HD23      LEU  68  -3.726   2.456   2.398
  551    H    THR  69           HN       THR  69  -4.822   1.365   7.949
  552    HA   THR  69           HA       THR  69  -6.843   3.290   8.214
  553    HB   THR  69           HB       THR  69  -5.565   2.107  10.639
  554    HG1  THR  69           HG1      THR  69  -5.681   0.341   9.352
  555   1HG2  THR  69          HG21      THR  69  -7.594   3.535  10.874
  556   2HG2  THR  69          HG22      THR  69  -7.863   1.870  11.387
  557   3HG2  THR  69          HG23      THR  69  -8.462   2.417   9.822
  558    H    ASN  70           HN       ASN  70  -3.461   3.419   9.287
  559    HA   ASN  70           HA       ASN  70  -3.541   6.270   9.369
  560   1HB   ASN  70          HB1       ASN  70  -4.521   5.609  11.607
  561   2HB   ASN  70          HB2       ASN  70  -2.948   4.935  12.016
  562   1HD2  ASN  70          HD21      ASN  70  -4.422   7.176  13.247
  563   2HD2  ASN  70          HD22      ASN  70  -3.185   8.383  13.236
  564    HA   PRO  71           HA       PRO  71   0.549   4.609   8.042
  565   1HB   PRO  71          HB1       PRO  71   1.124   6.855   6.554
  566   2HB   PRO  71          HB2       PRO  71   0.281   5.432   5.935
  567   1HG   PRO  71          HG1       PRO  71  -0.841   8.032   6.896
  568   2HG   PRO  71          HG2       PRO  71  -1.330   7.044   5.507
  569   1HD   PRO  71          HD1       PRO  71  -2.726   7.044   7.804
  570   2HD   PRO  71          HD2       PRO  71  -2.546   5.575   6.823
  571    H    LYS  72           HN       LYS  72  -0.293   7.787   9.320
  572    HA   LYS  72           HA       LYS  72   2.328   8.608  10.038
  573   1HB   LYS  72          HB1       LYS  72  -0.416   9.619  10.475
  574   2HB   LYS  72          HB2       LYS  72   0.776  10.101  11.671
  575   1HG   LYS  72          HG1       LYS  72   0.722  11.828  10.076
  576   2HG   LYS  72          HG2       LYS  72   2.199  10.927   9.754
  577   1HD   LYS  72          HD1       LYS  72  -0.032   9.898   8.209
  578   2HD   LYS  72          HD2       LYS  72   0.217  11.620   7.918
  579   1HE   LYS  72          HE1       LYS  72   2.593   9.824   7.917
  580   2HE   LYS  72          HE2       LYS  72   1.509   9.757   6.536
  581   1HZ   LYS  72          HZ1       LYS  72   1.922  12.031   6.067
  582   2HZ   LYS  72          HZ2       LYS  72   3.425  11.296   6.304
  583   3HZ   LYS  72          HZ3       LYS  72   2.761  12.253   7.526
  584    H    LYS  73           HN       LYS  73  -0.212   6.896  11.797
  585    HA   LYS  73           HA       LYS  73   1.223   6.981  14.284
  586   1HB   LYS  73          HB1       LYS  73  -1.221   6.882  14.261
  587   2HB   LYS  73          HB2       LYS  73  -1.161   5.297  13.505
  588   1HG   LYS  73          HG1       LYS  73  -1.630   5.142  15.906
  589   2HG   LYS  73          HG2       LYS  73  -0.117   4.349  15.487
  590   1HD   LYS  73          HD1       LYS  73   0.830   6.784  16.154
  591   2HD   LYS  73          HD2       LYS  73  -0.613   6.750  17.165
  592   1HE   LYS  73          HE1       LYS  73   1.368   5.927  18.367
  593   2HE   LYS  73          HE2       LYS  73   0.136   4.679  18.209
  594   1HZ   LYS  73          HZ1       LYS  73   2.550   4.060  17.752
  595   2HZ   LYS  73          HZ2       LYS  73   2.359   4.872  16.283
  596   3HZ   LYS  73          HZ3       LYS  73   1.381   3.543  16.640
  597    H    TYR  74           HN       TYR  74   0.886   4.567  11.715
  598    HA   TYR  74           HA       TYR  74   2.291   2.491  13.047
  599   1HB   TYR  74          HB1       TYR  74   0.677   2.464  10.988
  600   2HB   TYR  74          HB2       TYR  74   2.166   2.692  10.069
  601    HD1  TYR  74           HD1      TYR  74   3.427   0.777   9.437
  602    HD2  TYR  74           HD2      TYR  74   0.730   0.614  12.781
  603    HE1  TYR  74           HE1      TYR  74   3.820  -1.682   9.634
  604    HE2  TYR  74           HE2      TYR  74   1.104  -1.828  12.985
  605    HH   TYR  74           HH       TYR  74   1.782  -3.708  11.396
  606    H    ILE  75           HN       ILE  75   3.323   4.903  10.696
  607    HA   ILE  75           HA       ILE  75   6.142   4.395  11.329
  608    HB   ILE  75           HB       ILE  75   5.090   4.985   8.550
  609   1HG1  ILE  75          HG11      ILE  75   6.189   2.404   9.725
  610   2HG1  ILE  75          HG12      ILE  75   4.544   2.666   9.166
  611   1HG2  ILE  75          HG21      ILE  75   7.462   4.523   7.908
  612   2HG2  ILE  75          HG22      ILE  75   7.868   4.417   9.621
  613   3HG2  ILE  75          HG23      ILE  75   7.285   5.938   8.946
  614   1HD1  ILE  75          HD11      ILE  75   5.416   2.949   6.857
  615   2HD1  ILE  75          HD12      ILE  75   5.763   1.360   7.539
  616   3HD1  ILE  75          HD13      ILE  75   7.034   2.579   7.455
  617    HA   PRO  76           HA       PRO  76   5.178   8.754  12.324
  618   1HB   PRO  76          HB1       PRO  76   7.191   8.995  14.142
  619   2HB   PRO  76          HB2       PRO  76   5.606   8.319  14.530
  620   1HG   PRO  76          HG1       PRO  76   8.171   6.907  13.921
  621   2HG   PRO  76          HG2       PRO  76   6.953   6.536  15.156
  622   1HD   PRO  76          HD1       PRO  76   7.121   5.184  12.814
  623   2HD   PRO  76          HD2       PRO  76   5.582   5.451  13.658
  624    H    GLY  77           HN       GLY  77   5.815   9.884  10.542
  625   1HA   GLY  77          HA1       GLY  77   7.458  11.577   9.913
  626   2HA   GLY  77          HA2       GLY  77   8.702  10.368  10.165
  627    H    THR  78           HN       THR  78   6.206   8.786   8.646
  628    HA   THR  78           HA       THR  78   7.511   8.478   6.161
  629    HB   THR  78           HB       THR  78   5.622   7.102   7.549
  630    HG1  THR  78           HG1      THR  78   7.082   6.736   5.423
  631   1HG2  THR  78          HG21      THR  78   4.219   8.038   5.045
  632   2HG2  THR  78          HG22      THR  78   3.721   8.387   6.701
  633   3HG2  THR  78          HG23      THR  78   3.698   6.727   6.104
  634    H    LYS  79           HN       LYS  79   6.889   9.036   4.071
  635    HA   LYS  79           HA       LYS  79   5.818  11.706   3.807
  636   1HB   LYS  79          HB1       LYS  79   6.632   9.845   1.583
  637   2HB   LYS  79          HB2       LYS  79   6.562  11.599   1.547
  638   1HG   LYS  79          HG1       LYS  79   8.452  11.664   3.164
  639   2HG   LYS  79          HG2       LYS  79   8.556   9.899   3.048
  640   1HD   LYS  79          HD1       LYS  79   8.454  10.874   0.391
  641   2HD   LYS  79          HD2       LYS  79   9.622  11.884   1.252
  642   1HE   LYS  79          HE1       LYS  79  10.946  10.112   0.524
  643   2HE   LYS  79          HE2       LYS  79  10.528   9.623   2.166
  644   1HZ   LYS  79          HZ1       LYS  79   9.280   7.922   1.432
  645   2HZ   LYS  79          HZ2       LYS  79  10.227   8.059   0.041
  646   3HZ   LYS  79          HZ3       LYS  79   8.699   8.771   0.085
  647    H    MET  80           HN       MET  80   4.301   8.616   3.695
  648    HA   MET  80           HA       MET  80   2.461   9.091   1.610
  649   1HB   MET  80          HB1       MET  80   2.622   6.853   2.010
  650   2HB   MET  80          HB2       MET  80   2.724   7.057   3.763
  651   1HG   MET  80          HG1       MET  80   0.502   7.023   4.042
  652   2HG   MET  80          HG2       MET  80   0.200   7.961   2.591
  653   1HE   MET  80          HE1       MET  80  -1.772   5.566   3.628
  654   2HE   MET  80          HE2       MET  80  -2.191   5.025   2.002
  655   3HE   MET  80          HE3       MET  80  -1.981   6.744   2.331
  656    H    ALA  81           HN       ALA  81   1.248  10.774   1.567
  657    HA   ALA  81           HA       ALA  81  -0.328  11.587   3.892
  658   1HB   ALA  81          HB1       ALA  81  -0.219  13.844   3.093
  659   2HB   ALA  81          HB2       ALA  81   0.602  13.323   1.623
  660   3HB   ALA  81          HB3       ALA  81   1.406  13.163   3.184
  661    H    PHE  82           HN       PHE  82  -1.768   9.892   3.077
  662    HA   PHE  82           HA       PHE  82  -3.774  10.711   1.140
  663   1HB   PHE  82          HB1       PHE  82  -2.889   8.693   0.419
  664   2HB   PHE  82          HB2       PHE  82  -2.804   8.029   2.046
  665    HD1  PHE  82           HD1      PHE  82  -5.116   8.889  -0.741
  666    HD2  PHE  82           HD2      PHE  82  -4.614   6.810   2.992
  667    HE1  PHE  82           HE1      PHE  82  -7.355   7.839  -1.023
  668    HE2  PHE  82           HE2      PHE  82  -6.854   5.772   2.718
  669    HZ   PHE  82           HZ       PHE  82  -8.233   6.303   0.720
  670    H    GLY  83           HN       GLY  83  -3.424  10.259   4.567
  671   1HA   GLY  83          HA1       GLY  83  -5.091  11.076   6.070
  672   2HA   GLY  83          HA2       GLY  83  -6.311  10.738   4.862
  673    H    GLY  84           HN       GLY  84  -5.642   8.005   4.363
  674   1HA   GLY  84          HA1       GLY  84  -5.496   5.868   5.327
  675   2HA   GLY  84          HA2       GLY  84  -5.764   6.576   6.908
  676    H    LEU  85           HN       LEU  85  -7.122   4.716   4.543
  677    HA   LEU  85           HA       LEU  85  -9.882   5.432   4.706
  678   1HB   LEU  85          HB1       LEU  85  -8.352   3.144   3.524
  679   2HB   LEU  85          HB2       LEU  85 -10.091   3.032   3.688
  680    HG   LEU  85           HG       LEU  85  -8.566   5.067   2.044
  681   1HD1  LEU  85          HD11      LEU  85  -8.728   2.781   1.110
  682   2HD1  LEU  85          HD12      LEU  85  -9.651   3.952   0.167
  683   3HD1  LEU  85          HD13      LEU  85 -10.484   2.857   1.270
  684   1HD2  LEU  85          HD21      LEU  85 -11.563   4.761   2.373
  685   2HD2  LEU  85          HD22      LEU  85 -10.750   5.836   1.236
  686   3HD2  LEU  85          HD23      LEU  85 -10.602   6.115   2.971
  687    H    LYS  86           HN       LYS  86 -10.408   5.503   6.781
  688    HA   LYS  86           HA       LYS  86 -10.027   3.689   8.850
  689   1HB   LYS  86          HB1       LYS  86 -12.320   5.635   8.590
  690   2HB   LYS  86          HB2       LYS  86 -11.602   5.019  10.072
  691   1HG   LYS  86          HG1       LYS  86  -9.980   6.622   8.109
  692   2HG   LYS  86          HG2       LYS  86 -10.983   7.405   9.332
  693   1HD   LYS  86          HD1       LYS  86  -9.768   6.215  11.103
  694   2HD   LYS  86          HD2       LYS  86  -8.782   5.398   9.892
  695   1HE   LYS  86          HE1       LYS  86  -8.878   8.403  10.176
  696   2HE   LYS  86          HE2       LYS  86  -7.717   7.398  11.040
  697   1HZ   LYS  86          HZ1       LYS  86  -6.712   6.740   9.046
  698   2HZ   LYS  86          HZ2       LYS  86  -6.957   8.404   8.873
  699   3HZ   LYS  86          HZ3       LYS  86  -7.993   7.318   8.097
  700    H    LYS  87           HN       LYS  87 -12.334   3.531   6.280
  701    HA   LYS  87           HA       LYS  87 -14.340   1.931   7.526
  702   1HB   LYS  87          HB1       LYS  87 -13.901   1.723   4.620
  703   2HB   LYS  87          HB2       LYS  87 -15.381   1.957   5.510
  704   1HG   LYS  87          HG1       LYS  87 -15.174   4.313   5.450
  705   2HG   LYS  87          HG2       LYS  87 -13.433   4.229   5.038
  706   1HD   LYS  87          HD1       LYS  87 -14.101   2.791   3.097
  707   2HD   LYS  87          HD2       LYS  87 -15.752   3.196   3.422
  708   1HE   LYS  87          HE1       LYS  87 -15.541   5.273   2.403
  709   2HE   LYS  87          HE2       LYS  87 -13.769   5.268   2.554
  710   1HZ   LYS  87          HZ1       LYS  87 -13.622   3.426   1.050
  711   2HZ   LYS  87          HZ2       LYS  87 -14.535   4.630   0.298
  712   3HZ   LYS  87          HZ3       LYS  87 -15.310   3.277   0.963
  713    H    GLU  88           HN       GLU  88 -13.377   0.091   8.428
  714    HA   GLU  88           HA       GLU  88 -11.502  -1.632   7.465
  715   1HB   GLU  88          HB1       GLU  88 -12.629  -1.624   9.707
  716   2HB   GLU  88          HB2       GLU  88 -13.957  -2.512   8.969
  717   1HG   GLU  88          HG1       GLU  88 -12.284  -4.270   8.278
  718   2HG   GLU  88          HG2       GLU  88 -11.093  -3.423   9.275
  719    H    LYS  89           HN       LYS  89 -15.002  -1.946   6.742
  720    HA   LYS  89           HA       LYS  89 -14.878  -4.358   5.354
  721   1HB   LYS  89          HB1       LYS  89 -16.852  -2.237   4.594
  722   2HB   LYS  89          HB2       LYS  89 -17.089  -3.973   4.775
  723   1HG   LYS  89          HG1       LYS  89 -16.344  -2.323   7.156
  724   2HG   LYS  89          HG2       LYS  89 -18.010  -2.341   6.593
  725   1HD   LYS  89          HD1       LYS  89 -17.968  -4.009   8.238
  726   2HD   LYS  89          HD2       LYS  89 -17.778  -4.928   6.735
  727   1HE   LYS  89          HE1       LYS  89 -15.577  -5.418   7.144
  728   2HE   LYS  89          HE2       LYS  89 -15.295  -3.914   8.020
  729   1HZ   LYS  89          HZ1       LYS  89 -16.529  -6.410   9.017
  730   2HZ   LYS  89          HZ2       LYS  89 -16.708  -4.940   9.831
  731   3HZ   LYS  89          HZ3       LYS  89 -15.166  -5.593   9.613
  732    H    ASP  90           HN       ASP  90 -14.500  -1.108   4.237
  733    HA   ASP  90           HA       ASP  90 -14.291  -1.417   1.501
  734   1HB   ASP  90          HB1       ASP  90 -14.569   0.622   3.101
  735   2HB   ASP  90          HB2       ASP  90 -12.816   0.660   3.085
  736    H    ARG  91           HN       ARG  91 -11.635  -1.432   3.974
  737    HA   ARG  91           HA       ARG  91  -9.561  -1.864   2.087
  738   1HB   ARG  91          HB1       ARG  91  -9.442  -2.722   4.986
  739   2HB   ARG  91          HB2       ARG  91  -8.083  -2.451   3.901
  740   1HG   ARG  91          HG1       ARG  91  -8.706  -0.067   3.761
  741   2HG   ARG  91          HG2       ARG  91 -10.008  -0.356   4.903
  742   1HD   ARG  91          HD1       ARG  91  -7.053  -0.668   5.459
  743   2HD   ARG  91          HD2       ARG  91  -8.054   0.684   5.962
  744    HE   ARG  91           HE       ARG  91  -7.805  -1.717   6.474
  745   1HH1  ARG  91          HH21      ARG  91  -9.427   1.186   7.479
  746   2HH1  ARG  91          HH22      ARG  91 -10.158   0.717   8.975
  747   1HH2  ARG  91          HH11      ARG  91  -8.936  -2.491   8.930
  748   2HH2  ARG  91          HH12      ARG  91  -9.898  -1.338   9.783
  749    H    ASN  92           HN       ASN  92 -11.631  -4.161   3.806
  750    HA   ASN  92           HA       ASN  92 -10.361  -6.537   3.364
  751   1HB   ASN  92          HB1       ASN  92 -13.307  -5.894   3.278
  752   2HB   ASN  92          HB2       ASN  92 -12.687  -7.537   3.237
  753   1HD2  ASN  92          HD21      ASN  92 -14.422  -6.561   5.193
  754   2HD2  ASN  92          HD22      ASN  92 -13.518  -6.813   6.646
  755    H    ASP  93           HN       ASP  93 -12.587  -5.005   0.996
  756    HA   ASP  93           HA       ASP  93 -12.107  -6.828  -1.100
  757   1HB   ASP  93          HB1       ASP  93 -13.887  -4.824  -0.724
  758   2HB   ASP  93          HB2       ASP  93 -12.788  -4.051  -1.854
  759    H    LEU  94           HN       LEU  94 -10.420  -3.747  -0.298
  760    HA   LEU  94           HA       LEU  94  -8.826  -3.454  -2.501
  761   1HB   LEU  94          HB1       LEU  94  -8.899  -2.508   0.266
  762   2HB   LEU  94          HB2       LEU  94  -7.310  -2.579  -0.401
  763    HG   LEU  94           HG       LEU  94  -9.524  -1.203  -1.887
  764   1HD1  LEU  94          HD11      LEU  94  -9.316  -0.310   0.439
  765   2HD1  LEU  94          HD12      LEU  94  -8.949   0.871  -0.822
  766   3HD1  LEU  94          HD13      LEU  94  -7.639   0.105   0.076
  767   1HD2  LEU  94          HD21      LEU  94  -6.594  -0.488  -1.872
  768   2HD2  LEU  94          HD22      LEU  94  -7.844   0.050  -2.991
  769   3HD2  LEU  94          HD23      LEU  94  -7.286  -1.622  -3.033
  770    H    ILE  95           HN       ILE  95  -8.284  -5.572   0.289
  771    HA   ILE  95           HA       ILE  95  -5.654  -6.395  -0.367
  772    HB   ILE  95           HB       ILE  95  -7.706  -7.883   1.285
  773   1HG1  ILE  95          HG11      ILE  95  -5.637  -5.906   2.285
  774   2HG1  ILE  95          HG12      ILE  95  -7.302  -5.448   1.940
  775   1HG2  ILE  95          HG21      ILE  95  -4.685  -7.940   1.477
  776   2HG2  ILE  95          HG22      ILE  95  -5.655  -9.181   0.686
  777   3HG2  ILE  95          HG23      ILE  95  -5.827  -8.902   2.418
  778   1HD1  ILE  95          HD11      ILE  95  -6.453  -7.537   3.953
  779   2HD1  ILE  95          HD12      ILE  95  -8.105  -7.005   3.636
  780   3HD1  ILE  95          HD13      ILE  95  -6.938  -5.883   4.333
  781    H    THR  96           HN       THR  96  -8.855  -7.827  -1.063
  782    HA   THR  96           HA       THR  96  -8.066 -10.161  -2.336
  783    HB   THR  96           HB       THR  96 -10.441  -8.606  -3.328
  784    HG1  THR  96           HG1      THR  96 -10.733  -8.521  -1.138
  785   1HG2  THR  96          HG21      THR  96 -11.428 -10.755  -3.625
  786   2HG2  THR  96          HG22      THR  96 -10.153 -11.543  -2.694
  787   3HG2  THR  96          HG23      THR  96  -9.795 -10.870  -4.284
  788    H    TYR  97           HN       TYR  97  -8.475  -6.924  -3.836
  789    HA   TYR  97           HA       TYR  97  -7.790  -7.786  -6.447
  790   1HB   TYR  97          HB1       TYR  97  -9.012  -5.749  -6.197
  791   2HB   TYR  97          HB2       TYR  97  -7.751  -5.047  -5.193
  792    HD1  TYR  97           HD1      TYR  97  -6.356  -3.496  -6.164
  793    HD2  TYR  97           HD2      TYR  97  -8.096  -6.562  -8.625
  794    HE1  TYR  97           HE1      TYR  97  -5.267  -2.501  -8.165
  795    HE2  TYR  97           HE2      TYR  97  -7.112  -5.507 -10.651
  796    HH   TYR  97           HH       TYR  97  -4.645  -3.444 -10.643
  797    H    LEU  98           HN       LEU  98  -5.778  -6.041  -4.032
  798    HA   LEU  98           HA       LEU  98  -3.389  -6.020  -5.478
  799   1HB   LEU  98          HB1       LEU  98  -4.225  -5.054  -3.070
  800   2HB   LEU  98          HB2       LEU  98  -3.152  -6.353  -2.554
  801    HG   LEU  98           HG       LEU  98  -1.335  -5.399  -3.965
  802   1HD1  LEU  98          HD11      LEU  98  -3.293  -3.129  -4.388
  803   2HD1  LEU  98          HD12      LEU  98  -2.760  -4.264  -5.628
  804   3HD1  LEU  98          HD13      LEU  98  -1.604  -3.149  -4.897
  805   1HD2  LEU  98          HD21      LEU  98  -0.823  -3.516  -2.550
  806   2HD2  LEU  98          HD22      LEU  98  -1.612  -4.747  -1.563
  807   3HD2  LEU  98          HD23      LEU  98  -2.520  -3.336  -2.103
  808    H    LYS  99           HN       LYS  99  -4.558  -8.326  -3.095
  809    HA   LYS  99           HA       LYS  99  -2.419 -10.120  -3.098
  810   1HB   LYS  99          HB1       LYS  99  -3.922 -10.273  -1.297
  811   2HB   LYS  99          HB2       LYS  99  -5.322 -10.380  -2.349
  812   1HG   LYS  99          HG1       LYS  99  -4.476 -12.639  -3.078
  813   2HG   LYS  99          HG2       LYS  99  -3.264 -12.520  -1.818
  814   1HD   LYS  99          HD1       LYS  99  -5.360 -12.197  -0.256
  815   2HD   LYS  99          HD2       LYS  99  -6.215 -12.970  -1.594
  816   1HE   LYS  99          HE1       LYS  99  -5.352 -14.506   0.226
  817   2HE   LYS  99          HE2       LYS  99  -4.930 -14.932  -1.426
  818   1HZ   LYS  99          HZ1       LYS  99  -2.806 -14.853  -0.899
  819   2HZ   LYS  99          HZ2       LYS  99  -3.235 -14.609   0.723
  820   3HZ   LYS  99          HZ3       LYS  99  -2.958 -13.276  -0.281
  821    H    LYS 100           HN       LYS 100  -5.227  -9.916  -5.268
  822    HA   LYS 100           HA       LYS 100  -4.722 -12.343  -6.642
  823   1HB   LYS 100          HB1       LYS 100  -6.817 -10.584  -6.493
  824   2HB   LYS 100          HB2       LYS 100  -6.286 -10.431  -8.149
  825   1HG   LYS 100          HG1       LYS 100  -8.156 -12.069  -7.776
  826   2HG   LYS 100          HG2       LYS 100  -6.749 -12.750  -8.596
  827   1HD   LYS 100          HD1       LYS 100  -6.733 -12.911  -5.672
  828   2HD   LYS 100          HD2       LYS 100  -8.007 -13.815  -6.429
  829   1HE   LYS 100          HE1       LYS 100  -6.477 -15.452  -6.121
  830   2HE   LYS 100          HE2       LYS 100  -5.928 -14.892  -7.709
  831   1HZ   LYS 100          HZ1       LYS 100  -4.529 -14.812  -5.239
  832   2HZ   LYS 100          HZ2       LYS 100  -4.755 -13.234  -5.798
  833   3HZ   LYS 100          HZ3       LYS 100  -3.979 -14.371  -6.784
  834    H    ALA 101           HN       ALA 101  -3.607  -9.210  -7.158
  835    HA   ALA 101           HA       ALA 101  -2.465  -9.470  -9.753
  836   1HB   ALA 101          HB1       ALA 101  -3.436  -7.384  -8.781
  837   2HB   ALA 101          HB2       ALA 101  -1.809  -7.190  -9.434
  838   3HB   ALA 101          HB3       ALA 101  -2.052  -7.308  -7.690
  839    H    THR 102           HN       THR 102  -1.209  -9.674  -6.449
  840    HA   THR 102           HA       THR 102   1.555  -9.971  -7.160
  841    HB   THR 102           HB       THR 102   0.475 -10.796  -4.493
  842    HG1  THR 102           HG1      THR 102  -0.518  -8.790  -4.937
  843   1HG2  THR 102          HG21      THR 102   2.548  -9.570  -3.748
  844   2HG2  THR 102          HG22      THR 102   2.982  -9.412  -5.451
  845   3HG2  THR 102          HG23      THR 102   2.847 -11.011  -4.720
  846    H    GLU 103           HN       GLU 103  -1.074 -12.216  -6.245
  847    HA   GLU 103           HA       GLU 103   0.664 -14.441  -7.111
  848   1HB   GLU 103          HB1       GLU 103  -1.001 -15.780  -5.500
  849   2HB   GLU 103          HB2       GLU 103   0.501 -15.073  -4.928
  850   1HG   GLU 103          HG1       GLU 103  -0.546 -13.610  -3.612
  851   2HG   GLU 103          HG2       GLU 103  -1.772 -13.248  -4.821
  852    HHA  HEC 104           HA       HEC 104   5.090   3.577   1.451
  853    HHB  HEC 104           HB       HEC 104  -0.620   0.761   0.162
  854    HHC  HEC 104           HC       HEC 104  -3.072   6.555  -1.397
  855    HHD  HEC 104           HD       HEC 104   2.896   9.023  -1.297
  856   1HMA  HEC 104          HMA1      HEC 104   1.144  -0.677   1.980
  857   2HMA  HEC 104          HMA2      HEC 104   2.662  -1.061   1.167
  858   3HMA  HEC 104          HMA3      HEC 104   1.182  -0.868   0.227
  859   1HAA  HEC 104          HAA1      HEC 104   4.205  -0.080   2.097
  860   2HAA  HEC 104          HAA2      HEC 104   4.903   1.481   2.490
  861   1HBA  HEC 104          HBA1      HEC 104   5.785   1.637   0.174
  862   2HBA  HEC 104          HBA2      HEC 104   5.145   0.034  -0.153
  863   1HMB  HEC 104          HMB1      HEC 104  -2.498   0.476  -0.479
  864   2HMB  HEC 104          HMB2      HEC 104  -3.403   1.095  -1.861
  865   3HMB  HEC 104          HMB3      HEC 104  -4.075   1.230  -0.236
  866    HAB  HEC 104           HAB      HEC 104  -4.493   5.244  -1.463
  867   1HBB  HEC 104          HBB1      HEC 104  -4.856   4.012   0.814
  868   2HBB  HEC 104          HBB2      HEC 104  -5.859   2.960  -0.185
  869   3HBB  HEC 104          HBB3      HEC 104  -6.192   4.691  -0.116
  870   1HMC  HEC 104          HMC1      HEC 104  -3.094   9.124  -1.542
  871   2HMC  HEC 104          HMC2      HEC 104  -2.754   8.404  -3.116
  872   3HMC  HEC 104          HMC3      HEC 104  -2.129  10.005  -2.725
  873    HAC  HEC 104           HAC      HEC 104   1.720  10.097  -2.575
  874   1HBC  HEC 104          HBC1      HEC 104   0.933  11.485  -0.899
  875   2HBC  HEC 104          HBC2      HEC 104  -0.724  11.439  -1.501
  876   3HBC  HEC 104          HBC3      HEC 104   0.524  12.291  -2.413
  877   1HMD  HEC 104          HMD1      HEC 104   5.028   9.390  -0.369
  878   2HMD  HEC 104          HMD2      HEC 104   5.477   8.407  -1.764
  879   3HMD  HEC 104          HMD3      HEC 104   6.488   8.401  -0.318
  880   1HAD  HEC 104          HAD1      HEC 104   7.264   6.513   0.454
  881   2HAD  HEC 104          HAD2      HEC 104   6.787   4.971   1.156
  882   1HBD  HEC 104          HBD1      HEC 104   6.268   5.913   3.209
  883   2HBD  HEC 104          HBD2      HEC 104   5.972   7.497   2.526
  884    H2   4NL 105           H2       4NL 105   1.060 -14.140  -0.730
  885    H6   4NL 105           H6       4NL 105   3.338 -12.112   3.202
  886    H3   4NL 105           H3       4NL 105  -1.439 -11.069   1.056
  887    H5   4NL 105           H5       4NL 105  -0.769 -13.292  -1.728
  888    H4   4NL 105           H4       4NL 105   0.117 -10.943   3.019
  889    H1   4NL 105           H1       4NL 105   2.617 -14.015   1.233
  890    H7   4NL 105           H7       4NL 105   2.025 -12.609   4.296
  Start of MODEL   23
    1   1H    THR  -5          HT1       THR  -5 -12.073  -5.510  12.475
    2   2H    THR  -5          HT2       THR  -5 -10.828  -5.527  13.624
    3   3H    THR  -5          HT3       THR  -5 -12.207  -6.474  13.865
    4    HA   THR  -5           HA       THR  -5 -10.382  -6.844  11.571
    5    HB   THR  -5           HB       THR  -5 -10.435  -8.752  13.885
    6    HG1  THR  -5           HG1      THR  -5  -8.582  -7.546  14.706
    7   1HG2  THR  -5          HG21      THR  -5  -8.061  -9.021  13.179
    8   2HG2  THR  -5          HG22      THR  -5  -8.343  -7.838  11.902
    9   3HG2  THR  -5          HG23      THR  -5  -9.210  -9.374  11.888
   10    H    GLU  -4           HN       GLU  -4 -12.473  -7.005  10.437
   11    HA   GLU  -4           HA       GLU  -4 -13.669  -9.666  10.715
   12   1HB   GLU  -4          HB1       GLU  -4 -15.130  -7.758  11.744
   13   2HB   GLU  -4          HB2       GLU  -4 -15.391  -7.259  10.077
   14   1HG   GLU  -4          HG1       GLU  -4 -15.905 -10.098  10.877
   15   2HG   GLU  -4          HG2       GLU  -4 -17.092  -8.856  11.252
   16    H    PHE  -3           HN       PHE  -3 -11.868  -9.710   9.055
   17    HA   PHE  -3           HA       PHE  -3 -12.181  -8.401   6.566
   18   1HB   PHE  -3          HB1       PHE  -3  -9.970  -8.990   7.130
   19   2HB   PHE  -3          HB2       PHE  -3 -10.402 -10.671   7.422
   20    HD1  PHE  -3           HD1      PHE  -3 -10.299  -8.120   4.661
   21    HD2  PHE  -3           HD2      PHE  -3  -9.988 -12.264   5.766
   22    HE1  PHE  -3           HE1      PHE  -3  -9.768  -8.706   2.303
   23    HE2  PHE  -3           HE2      PHE  -3  -9.505 -12.859   3.399
   24    HZ   PHE  -3           HZ       PHE  -3  -9.426 -11.082   1.658
   25    H    LYS  -2           HN       LYS  -2 -13.454  -8.742   5.016
   26    HA   LYS  -2           HA       LYS  -2 -14.659 -11.367   4.489
   27   1HB   LYS  -2          HB1       LYS  -2 -15.846  -8.715   4.851
   28   2HB   LYS  -2          HB2       LYS  -2 -16.320  -9.457   3.325
   29   1HG   LYS  -2          HG1       LYS  -2 -17.019 -11.489   4.546
   30   2HG   LYS  -2          HG2       LYS  -2 -16.599 -10.703   6.066
   31   1HD   LYS  -2          HD1       LYS  -2 -18.282  -8.920   5.517
   32   2HD   LYS  -2          HD2       LYS  -2 -18.767  -9.882   4.122
   33   1HE   LYS  -2          HE1       LYS  -2 -20.338 -10.458   5.751
   34   2HE   LYS  -2          HE2       LYS  -2 -19.175 -11.776   5.824
   35   1HZ   LYS  -2          HZ1       LYS  -2 -18.131 -10.609   7.733
   36   2HZ   LYS  -2          HZ2       LYS  -2 -19.712 -11.123   8.031
   37   3HZ   LYS  -2          HZ3       LYS  -2 -19.412  -9.496   7.701
   38    H    ALA  -1           HN       ALA  -1 -14.013 -12.204   2.670
   39    HA   ALA  -1           HA       ALA  -1 -12.132 -11.210   0.940
   40   1HB   ALA  -1          HB1       ALA  -1 -12.645 -13.110  -0.458
   41   2HB   ALA  -1          HB2       ALA  -1 -14.231 -13.282   0.296
   42   3HB   ALA  -1          HB3       ALA  -1 -12.770 -13.584   1.238
   43    H    GLY   1           HN       GLY   1 -12.118 -10.239  -1.048
   44   1HA   GLY   1          HA1       GLY   1 -14.590  -8.931  -1.983
   45   2HA   GLY   1          HA2       GLY   1 -12.982  -8.232  -2.109
   46    H    SER   2           HN       SER   2 -12.941  -7.977  -4.263
   47    HA   SER   2           HA       SER   2 -12.325 -10.218  -5.947
   48   1HB   SER   2          HB1       SER   2 -14.518  -8.624  -7.137
   49   2HB   SER   2          HB2       SER   2 -14.174 -10.353  -7.270
   50    HG   SER   2           HG       SER   2 -14.915 -10.508  -5.044
   51    H    ALA   3           HN       ALA   3 -11.266  -9.572  -7.861
   52    HA   ALA   3           HA       ALA   3  -9.811  -7.242  -7.858
   53   1HB   ALA   3          HB1       ALA   3  -9.230  -9.246  -9.117
   54   2HB   ALA   3          HB2       ALA   3  -9.184  -7.808 -10.138
   55   3HB   ALA   3          HB3       ALA   3 -10.545  -8.923 -10.249
   56    H    LYS   4           HN       LYS   4 -12.963  -7.690  -9.543
   57    HA   LYS   4           HA       LYS   4 -12.857  -5.091 -10.708
   58   1HB   LYS   4          HB1       LYS   4 -14.389  -7.427 -11.114
   59   2HB   LYS   4          HB2       LYS   4 -15.499  -6.078 -10.871
   60   1HG   LYS   4          HG1       LYS   4 -13.183  -6.063 -12.813
   61   2HG   LYS   4          HG2       LYS   4 -14.852  -6.405 -13.252
   62   1HD   LYS   4          HD1       LYS   4 -13.877  -3.809 -12.039
   63   2HD   LYS   4          HD2       LYS   4 -14.178  -4.074 -13.760
   64   1HE   LYS   4          HE1       LYS   4 -16.401  -3.819 -13.509
   65   2HE   LYS   4          HE2       LYS   4 -16.440  -4.882 -12.102
   66   1HZ   LYS   4          HZ1       LYS   4 -15.739  -2.002 -12.126
   67   2HZ   LYS   4          HZ2       LYS   4 -15.626  -3.002 -10.768
   68   3HZ   LYS   4          HZ3       LYS   4 -17.135  -2.702 -11.468
   69    H    LYS   5           HN       LYS   5 -13.289  -5.687  -7.579
   70    HA   LYS   5           HA       LYS   5 -15.169  -3.440  -7.213
   71   1HB   LYS   5          HB1       LYS   5 -14.613  -5.763  -5.356
   72   2HB   LYS   5          HB2       LYS   5 -15.508  -4.327  -4.875
   73   1HG   LYS   5          HG1       LYS   5 -16.985  -4.908  -6.974
   74   2HG   LYS   5          HG2       LYS   5 -16.310  -6.522  -6.739
   75   1HD   LYS   5          HD1       LYS   5 -17.316  -5.222  -4.286
   76   2HD   LYS   5          HD2       LYS   5 -18.552  -5.592  -5.489
   77   1HE   LYS   5          HE1       LYS   5 -18.368  -7.463  -3.979
   78   2HE   LYS   5          HE2       LYS   5 -17.712  -7.943  -5.544
   79   1HZ   LYS   5          HZ1       LYS   5 -15.640  -8.129  -4.710
   80   2HZ   LYS   5          HZ2       LYS   5 -16.465  -8.347  -3.244
   81   3HZ   LYS   5          HZ3       LYS   5 -15.826  -6.829  -3.634
   82    H    GLY   6           HN       GLY   6 -12.404  -5.012  -5.549
   83   1HA   GLY   6          HA1       GLY   6 -11.606  -2.827  -4.009
   84   2HA   GLY   6          HA2       GLY   6 -10.537  -4.108  -4.556
   85    H    ALA   7           HN       ALA   7 -11.085  -3.400  -7.434
   86    HA   ALA   7           HA       ALA   7  -8.951  -1.654  -7.893
   87   1HB   ALA   7          HB1       ALA   7  -9.700  -3.339  -9.514
   88   2HB   ALA   7          HB2       ALA   7  -9.593  -1.733 -10.235
   89   3HB   ALA   7          HB3       ALA   7 -11.165  -2.400  -9.803
   90    H    THR   8           HN       THR   8 -12.507  -0.931  -8.182
   91    HA   THR   8           HA       THR   8 -12.319   1.693  -8.984
   92    HB   THR   8           HB       THR   8 -14.384   1.878  -7.186
   93    HG1  THR   8           HG1      THR   8 -14.096  -0.370  -6.700
   94   1HG2  THR   8          HG21      THR   8 -15.833   1.505  -9.092
   95   2HG2  THR   8          HG22      THR   8 -14.520   0.722  -9.973
   96   3HG2  THR   8          HG23      THR   8 -14.426   2.443  -9.595
   97    H    LEU   9           HN       LEU   9 -11.769   0.524  -5.697
   98    HA   LEU   9           HA       LEU   9 -11.634   3.035  -4.408
   99   1HB   LEU   9          HB1       LEU   9 -10.952   0.221  -3.730
  100   2HB   LEU   9          HB2       LEU   9 -10.112   1.470  -2.814
  101    HG   LEU   9           HG       LEU   9 -12.035   1.044  -1.536
  102   1HD1  LEU   9          HD11      LEU   9 -13.433   3.061  -1.778
  103   2HD1  LEU   9          HD12      LEU   9 -12.709   3.357  -3.358
  104   3HD1  LEU   9          HD13      LEU   9 -11.714   3.437  -1.905
  105   1HD2  LEU   9          HD21      LEU   9 -13.340  -0.313  -3.049
  106   2HD2  LEU   9          HD22      LEU   9 -13.599   1.062  -4.122
  107   3HD2  LEU   9          HD23      LEU   9 -14.340   1.043  -2.521
  108    H    PHE  10           HN       PHE  10  -8.863   0.852  -4.617
  109    HA   PHE  10           HA       PHE  10  -6.783   2.565  -4.398
  110   1HB   PHE  10          HB1       PHE  10  -6.501   0.169  -4.465
  111   2HB   PHE  10          HB2       PHE  10  -6.987   0.114  -6.152
  112    HD1  PHE  10           HD1      PHE  10  -5.455   1.195  -7.904
  113    HD2  PHE  10           HD2      PHE  10  -4.259   0.431  -3.844
  114    HE1  PHE  10           HE1      PHE  10  -3.060   1.329  -8.580
  115    HE2  PHE  10           HE2      PHE  10  -1.876   0.693  -4.497
  116    HZ   PHE  10           HZ       PHE  10  -1.269   1.116  -6.866
  117    H    LYS  11           HN       LYS  11  -8.564   1.949  -7.398
  118    HA   LYS  11           HA       LYS  11  -6.814   3.262  -9.163
  119   1HB   LYS  11          HB1       LYS  11  -8.867   1.595  -9.515
  120   2HB   LYS  11          HB2       LYS  11  -9.687   3.113  -9.887
  121   1HG   LYS  11          HG1       LYS  11  -8.266   3.592 -11.685
  122   2HG   LYS  11          HG2       LYS  11  -7.036   2.458 -11.136
  123   1HD   LYS  11          HD1       LYS  11  -9.758   1.667 -12.192
  124   2HD   LYS  11          HD2       LYS  11  -8.276   1.680 -13.150
  125   1HE   LYS  11          HE1       LYS  11  -8.888  -0.050 -10.744
  126   2HE   LYS  11          HE2       LYS  11  -8.701  -0.580 -12.413
  127   1HZ   LYS  11          HZ1       LYS  11  -6.737  -1.037 -11.030
  128   2HZ   LYS  11          HZ2       LYS  11  -6.537   0.621 -10.770
  129   3HZ   LYS  11          HZ3       LYS  11  -6.379  -0.008 -12.330
  130    H    THR  12           HN       THR  12  -8.910   4.701  -6.924
  131    HA   THR  12           HA       THR  12  -8.477   7.347  -8.037
  132    HB   THR  12           HB       THR  12 -10.701   6.366  -8.780
  133    HG1  THR  12           HG1      THR  12 -10.148   8.512  -9.049
  134   1HG2  THR  12          HG21      THR  12 -11.725   7.403  -6.152
  135   2HG2  THR  12          HG22      THR  12 -11.459   5.686  -6.456
  136   3HG2  THR  12          HG23      THR  12 -12.615   6.587  -7.438
  137    H    ARG  13           HN       ARG  13  -7.603   5.656  -5.732
  138    HA   ARG  13           HA       ARG  13  -7.763   7.664  -3.598
  139   1HB   ARG  13          HB1       ARG  13  -8.340   4.720  -3.338
  140   2HB   ARG  13          HB2       ARG  13  -7.833   5.682  -1.966
  141   1HG   ARG  13          HG1       ARG  13 -10.297   6.237  -3.604
  142   2HG   ARG  13          HG2       ARG  13 -10.281   5.277  -2.132
  143   1HD   ARG  13          HD1       ARG  13 -11.017   7.448  -1.516
  144   2HD   ARG  13          HD2       ARG  13  -9.343   7.326  -0.962
  145    HE   ARG  13           HE       ARG  13 -10.120   8.261  -3.485
  146   1HH1  ARG  13          HH11      ARG  13  -8.717   8.984  -0.367
  147   2HH1  ARG  13          HH12      ARG  13  -7.748  10.345  -0.801
  148   1HH2  ARG  13          HH21      ARG  13  -8.584  10.316  -4.117
  149   2HH2  ARG  13          HH22      ARG  13  -7.682  11.080  -2.856
  150    H    CYS  14           HN       CYS  14  -5.953   5.381  -5.364
  151    HA   CYS  14           HA       CYS  14  -3.543   5.909  -3.769
  152   1HB   CYS  14          HB1       CYS  14  -4.020   3.210  -4.966
  153   2HB   CYS  14          HB2       CYS  14  -2.910   3.665  -3.692
  154    H    LEU  15           HN       LEU  15  -4.893   4.892  -6.884
  155    HA   LEU  15           HA       LEU  15  -2.737   4.619  -8.493
  156   1HB   LEU  15          HB1       LEU  15  -5.329   4.603  -8.945
  157   2HB   LEU  15          HB2       LEU  15  -5.032   6.242  -9.509
  158    HG   LEU  15           HG       LEU  15  -3.277   5.329 -11.065
  159   1HD1  LEU  15          HD11      LEU  15  -3.221   2.968 -11.558
  160   2HD1  LEU  15          HD12      LEU  15  -4.465   2.649 -10.350
  161   3HD1  LEU  15          HD13      LEU  15  -2.869   3.207  -9.846
  162   1HD2  LEU  15          HD21      LEU  15  -5.463   5.829 -11.957
  163   2HD2  LEU  15          HD22      LEU  15  -6.091   4.282 -11.388
  164   3HD2  LEU  15          HD23      LEU  15  -4.883   4.326 -12.673
  165    H    GLN  16           HN       GLN  16  -4.049   7.739  -7.448
  166    HA   GLN  16           HA       GLN  16  -2.858   9.593  -8.972
  167   1HB   GLN  16          HB1       GLN  16  -2.616  10.867  -6.652
  168   2HB   GLN  16          HB2       GLN  16  -4.172  10.558  -7.407
  169   1HG   GLN  16          HG1       GLN  16  -4.353   8.488  -5.977
  170   2HG   GLN  16          HG2       GLN  16  -2.911   9.041  -5.122
  171   1HE2  GLN  16          HE21      GLN  16  -3.651  11.881  -5.308
  172   2HE2  GLN  16          HE22      GLN  16  -4.946  12.096  -4.191
  173    H    CYS  17           HN       CYS  17  -1.084   7.739  -6.513
  174    HA   CYS  17           HA       CYS  17   1.413   9.030  -7.381
  175   1HB   CYS  17          HB1       CYS  17   1.289   7.889  -4.649
  176   2HB   CYS  17          HB2       CYS  17   2.136   9.295  -5.271
  177    H    HIS  18           HN       HIS  18  -0.055   5.978  -6.363
  178    HA   HIS  18           HA       HIS  18   2.443   4.496  -6.598
  179   1HB   HIS  18          HB1       HIS  18  -0.295   3.894  -5.543
  180   2HB   HIS  18          HB2       HIS  18   0.851   2.602  -5.841
  181    HD1  HIS  18           HD1      HIS  18   3.301   3.050  -4.433
  182    HD2  HIS  18           HD2      HIS  18  -0.256   4.837  -3.135
  183    HE1  HIS  18           HE1      HIS  18   3.635   3.578  -1.975
  184    H    THR  19           HN       THR  19   2.267   2.317  -7.519
  185    HA   THR  19           HA       THR  19   0.642   2.040  -9.938
  186    HB   THR  19           HB       THR  19   2.985   0.799 -10.611
  187    HG1  THR  19           HG1      THR  19   4.224   3.052 -10.145
  188   1HG2  THR  19          HG21      THR  19   1.670   2.259 -12.082
  189   2HG2  THR  19          HG22      THR  19   3.383   2.677 -12.119
  190   3HG2  THR  19          HG23      THR  19   2.253   3.669 -11.198
  191    H    VAL  20           HN       VAL  20  -0.484   0.155  -9.910
  192    HA   VAL  20           HA       VAL  20  -0.156  -1.742  -7.795
  193    HB   VAL  20           HB       VAL  20  -2.244  -0.827  -9.159
  194   1HG1  VAL  20          HG11      VAL  20  -1.838  -3.564 -10.339
  195   2HG1  VAL  20          HG12      VAL  20  -1.809  -2.028 -11.206
  196   3HG1  VAL  20          HG13      VAL  20  -3.305  -2.591 -10.458
  197   1HG2  VAL  20          HG21      VAL  20  -3.641  -2.347  -7.994
  198   2HG2  VAL  20          HG22      VAL  20  -2.253  -2.003  -6.964
  199   3HG2  VAL  20          HG23      VAL  20  -2.341  -3.528  -7.842
  200    H    GLU  21           HN       GLU  21   0.763  -1.749 -11.123
  201    HA   GLU  21           HA       GLU  21   1.721  -4.530 -10.986
  202   1HB   GLU  21          HB1       GLU  21   1.776  -4.068 -13.620
  203   2HB   GLU  21          HB2       GLU  21   0.325  -4.645 -12.824
  204   1HG   GLU  21          HG1       GLU  21  -0.028  -2.802 -14.494
  205   2HG   GLU  21          HG2       GLU  21  -0.684  -2.488 -12.891
  206    H    LYS  22           HN       LYS  22   3.701  -4.577 -12.915
  207    HA   LYS  22           HA       LYS  22   5.505  -2.476 -11.985
  208   1HB   LYS  22          HB1       LYS  22   5.819  -5.273 -12.280
  209   2HB   LYS  22          HB2       LYS  22   6.980  -4.471 -13.350
  210   1HG   LYS  22          HG1       LYS  22   8.076  -3.431 -11.638
  211   2HG   LYS  22          HG2       LYS  22   6.620  -3.291 -10.652
  212   1HD   LYS  22          HD1       LYS  22   6.763  -5.585  -9.996
  213   2HD   LYS  22          HD2       LYS  22   8.070  -5.884 -11.143
  214   1HE   LYS  22          HE1       LYS  22   9.057  -5.707  -8.971
  215   2HE   LYS  22          HE2       LYS  22   9.482  -4.259  -9.864
  216   1HZ   LYS  22          HZ1       LYS  22   7.571  -4.525  -7.606
  217   2HZ   LYS  22          HZ2       LYS  22   7.576  -3.167  -8.606
  218   3HZ   LYS  22          HZ3       LYS  22   8.951  -3.548  -7.704
  219    H    GLY  23           HN       GLY  23   3.627  -2.181 -14.407
  220   1HA   GLY  23          HA1       GLY  23   5.599  -1.741 -16.539
  221   2HA   GLY  23          HA2       GLY  23   3.854  -1.665 -16.715
  222    H    GLY  24           HN       GLY  24   3.779   0.097 -14.224
  223   1HA   GLY  24          HA1       GLY  24   4.118   2.658 -15.545
  224   2HA   GLY  24          HA2       GLY  24   3.288   2.354 -14.028
  225    HA   PRO  25           HA       PRO  25   8.061   3.368 -13.495
  226   1HB   PRO  25          HB1       PRO  25   8.120   6.090 -13.928
  227   2HB   PRO  25          HB2       PRO  25   8.659   4.880 -15.097
  228   1HG   PRO  25          HG1       PRO  25   6.058   6.347 -14.947
  229   2HG   PRO  25          HG2       PRO  25   7.031   5.929 -16.370
  230   1HD   PRO  25          HD1       PRO  25   4.829   4.537 -15.699
  231   2HD   PRO  25          HD2       PRO  25   6.248   3.751 -16.421
  232    H    HIS  26           HN       HIS  26   8.787   4.364 -11.560
  233    HA   HIS  26           HA       HIS  26   6.939   4.621  -9.484
  234   1HB   HIS  26          HB1       HIS  26   9.804   5.544  -9.771
  235   2HB   HIS  26          HB2       HIS  26   8.917   5.633  -8.258
  236    HD2  HIS  26           HD2      HIS  26  10.636   3.120 -10.612
  237    HE1  HIS  26           HE1      HIS  26   9.801   1.049  -7.000
  238    HE2  HIS  26           HE2      HIS  26  11.012   0.937  -9.229
  239    H    LYS  27           HN       LYS  27   5.688   6.328  -8.844
  240    HA   LYS  27           HA       LYS  27   6.174   8.968 -10.038
  241   1HB   LYS  27          HB1       LYS  27   4.099   7.547 -10.662
  242   2HB   LYS  27          HB2       LYS  27   3.471   8.051  -9.098
  243   1HG   LYS  27          HG1       LYS  27   3.932  10.449  -9.848
  244   2HG   LYS  27          HG2       LYS  27   4.162   9.781 -11.468
  245   1HD   LYS  27          HD1       LYS  27   1.674  10.133  -9.900
  246   2HD   LYS  27          HD2       LYS  27   1.919  10.143 -11.651
  247   1HE   LYS  27          HE1       LYS  27   1.966   7.751 -11.740
  248   2HE   LYS  27          HE2       LYS  27   2.042   7.627  -9.982
  249   1HZ   LYS  27          HZ1       LYS  27  -0.207   8.848 -10.080
  250   2HZ   LYS  27          HZ2       LYS  27  -0.161   7.197 -10.433
  251   3HZ   LYS  27          HZ3       LYS  27  -0.251   8.322 -11.692
  252    H    VAL  28           HN       VAL  28   3.934   9.797  -7.973
  253    HA   VAL  28           HA       VAL  28   5.647  10.993  -6.076
  254    HB   VAL  28           HB       VAL  28   2.688  10.578  -5.690
  255   1HG1  VAL  28          HG11      VAL  28   2.787  12.678  -4.488
  256   2HG1  VAL  28          HG12      VAL  28   4.491  12.872  -4.898
  257   3HG1  VAL  28          HG13      VAL  28   3.986  11.570  -3.821
  258   1HG2  VAL  28          HG21      VAL  28   2.893  11.468  -7.935
  259   2HG2  VAL  28          HG22      VAL  28   4.028  12.699  -7.382
  260   3HG2  VAL  28          HG23      VAL  28   2.346  12.752  -6.855
  261    H    GLY  29           HN       GLY  29   4.114   7.919  -6.226
  262   1HA   GLY  29          HA1       GLY  29   5.037   7.179  -3.524
  263   2HA   GLY  29          HA2       GLY  29   3.542   6.570  -4.215
  264    HA   PRO  30           HA       PRO  30   7.450   3.979  -5.420
  265   1HB   PRO  30          HB1       PRO  30   7.443   2.096  -3.473
  266   2HB   PRO  30          HB2       PRO  30   8.352   3.607  -3.351
  267   1HG   PRO  30          HG1       PRO  30   5.679   2.908  -2.190
  268   2HG   PRO  30          HG2       PRO  30   7.049   3.732  -1.421
  269   1HD   PRO  30          HD1       PRO  30   4.921   5.078  -2.384
  270   2HD   PRO  30          HD2       PRO  30   6.564   5.749  -2.432
  271    H    ASN  31           HN       ASN  31   7.383   1.897  -6.385
  272    HA   ASN  31           HA       ASN  31   4.815   1.019  -7.224
  273   1HB   ASN  31          HB1       ASN  31   6.889   0.978  -8.609
  274   2HB   ASN  31          HB2       ASN  31   7.532  -0.293  -7.579
  275   1HD2  ASN  31          HD21      ASN  31   4.981   0.438  -9.924
  276   2HD2  ASN  31          HD22      ASN  31   4.762  -1.213 -10.404
  277    H    LEU  32           HN       LEU  32   3.475  -0.367  -6.213
  278    HA   LEU  32           HA       LEU  32   4.157  -1.683  -3.743
  279   1HB   LEU  32          HB1       LEU  32   1.531  -1.423  -5.214
  280   2HB   LEU  32          HB2       LEU  32   1.728  -2.044  -3.587
  281    HG   LEU  32           HG       LEU  32   2.353   0.795  -4.449
  282   1HD1  LEU  32          HD11      LEU  32  -0.048   0.355  -4.480
  283   2HD1  LEU  32          HD12      LEU  32   0.370   1.389  -3.113
  284   3HD1  LEU  32          HD13      LEU  32   0.041  -0.323  -2.852
  285   1HD2  LEU  32          HD21      LEU  32   2.623   1.302  -2.111
  286   2HD2  LEU  32          HD22      LEU  32   3.708  -0.029  -2.515
  287   3HD2  LEU  32          HD23      LEU  32   2.201  -0.349  -1.656
  288    H    HIS  33           HN       HIS  33   3.883  -2.670  -7.015
  289    HA   HIS  33           HA       HIS  33   2.958  -5.285  -6.932
  290   1HB   HIS  33          HB1       HIS  33   3.346  -3.749  -8.928
  291   2HB   HIS  33          HB2       HIS  33   5.044  -4.205  -8.830
  292    HD2  HIS  33           HD2      HIS  33   1.786  -6.381  -8.723
  293    HE1  HIS  33           HE1      HIS  33   4.327  -7.940 -11.752
  294    HE2  HIS  33           HE2      HIS  33   2.145  -8.274 -10.493
  295    H    GLY  34           HN       GLY  34   3.824  -6.502  -5.284
  296   1HA   GLY  34          HA1       GLY  34   5.393  -8.381  -5.095
  297   2HA   GLY  34          HA2       GLY  34   6.674  -7.249  -5.473
  298    H    ILE  35           HN       ILE  35   4.638  -5.593  -3.359
  299    HA   ILE  35           HA       ILE  35   6.512  -5.795  -1.259
  300    HB   ILE  35           HB       ILE  35   5.102  -4.470   0.128
  301   1HG1  ILE  35          HG11      ILE  35   2.906  -5.139  -1.791
  302   2HG1  ILE  35          HG12      ILE  35   2.853  -4.948  -0.040
  303   1HG2  ILE  35          HG21      ILE  35   5.219  -2.489  -1.151
  304   2HG2  ILE  35          HG22      ILE  35   5.022  -3.367  -2.667
  305   3HG2  ILE  35          HG23      ILE  35   6.501  -3.555  -1.727
  306   1HD1  ILE  35          HD11      ILE  35   3.034  -2.500  -0.316
  307   2HD1  ILE  35          HD12      ILE  35   1.610  -3.159  -1.123
  308   3HD1  ILE  35          HD13      ILE  35   3.029  -2.713  -2.069
  309    H    PHE  36           HN       PHE  36   3.432  -7.515  -1.688
  310    HA   PHE  36           HA       PHE  36   3.161  -8.603   0.842
  311   1HB   PHE  36          HB1       PHE  36   2.321  -9.642  -1.857
  312   2HB   PHE  36          HB2       PHE  36   1.924 -10.480  -0.358
  313    HD1  PHE  36           HD1      PHE  36   1.170  -8.526   1.532
  314    HD2  PHE  36           HD2      PHE  36   0.467  -8.524  -2.712
  315    HE1  PHE  36           HE1      PHE  36  -0.769  -7.003   1.862
  316    HE2  PHE  36           HE2      PHE  36  -1.473  -7.001  -2.386
  317    HZ   PHE  36           HZ       PHE  36  -2.085  -6.231  -0.101
  318    H    GLY  37           HN       GLY  37   4.667  -9.532   1.944
  319   1HA   GLY  37          HA1       GLY  37   5.729 -11.585   2.568
  320   2HA   GLY  37          HA2       GLY  37   6.169 -11.831   0.888
  321    H    ARG  38           HN       ARG  38   6.851  -8.694   1.165
  322    HA   ARG  38           HA       ARG  38   9.639  -9.104   2.019
  323   1HB   ARG  38          HB1       ARG  38   8.299  -7.329   0.001
  324   2HB   ARG  38          HB2       ARG  38   9.801  -6.784   0.734
  325   1HG   ARG  38          HG1       ARG  38  11.057  -8.264  -0.422
  326   2HG   ARG  38          HG2       ARG  38   9.840  -9.539  -0.319
  327   1HD   ARG  38          HD1       ARG  38   9.875  -9.014  -2.602
  328   2HD   ARG  38          HD2       ARG  38   8.499  -8.090  -1.996
  329    HE   ARG  38           HE       ARG  38  10.559  -7.016  -1.568
  330   1HH1  ARG  38          HH21      ARG  38   8.779  -7.760  -4.423
  331   2HH1  ARG  38          HH22      ARG  38   8.908  -6.213  -5.083
  332   1HH2  ARG  38          HH11      ARG  38  11.254  -4.829  -3.254
  333   2HH2  ARG  38          HH12      ARG  38  10.743  -5.176  -4.850
  334    H    HIS  39           HN       HIS  39  10.614  -6.960   2.847
  335    HA   HIS  39           HA       HIS  39   9.009  -6.140   5.134
  336   1HB   HIS  39          HB1       HIS  39  11.878  -5.359   4.596
  337   2HB   HIS  39          HB2       HIS  39  11.051  -5.492   6.150
  338    HD2  HIS  39           HD2      HIS  39  10.270  -8.136   6.822
  339    HE1  HIS  39           HE1      HIS  39  13.354  -9.958   4.527
  340    HE2  HIS  39           HE2      HIS  39  11.561 -10.346   6.283
  341    H    SER  40           HN       SER  40   9.026  -3.797   5.776
  342    HA   SER  40           HA       SER  40   8.039  -2.130   3.801
  343   1HB   SER  40          HB1       SER  40   9.388  -0.788   6.088
  344   2HB   SER  40          HB2       SER  40   7.816  -0.473   5.368
  345    HG   SER  40           HG       SER  40   7.330  -2.669   6.367
  346    H    GLY  41           HN       GLY  41   8.832  -0.444   2.599
  347   1HA   GLY  41          HA1       GLY  41  10.363   0.899   1.537
  348   2HA   GLY  41          HA2       GLY  41  11.523   0.492   2.779
  349    H    GLN  42           HN       GLN  42  10.014  -1.602   0.199
  350    HA   GLN  42           HA       GLN  42  12.760  -2.156  -0.680
  351   1HB   GLN  42          HB1       GLN  42  10.463  -4.059  -0.430
  352   2HB   GLN  42          HB2       GLN  42  11.880  -4.434  -1.403
  353   1HG   GLN  42          HG1       GLN  42  13.243  -3.881   0.710
  354   2HG   GLN  42          HG2       GLN  42  11.710  -4.008   1.569
  355   1HE2  GLN  42          HE21      GLN  42  12.625  -5.834   2.739
  356   2HE2  GLN  42          HE22      GLN  42  12.754  -7.378   1.980
  357    H    ALA  43           HN       ALA  43  10.522  -0.290  -1.972
  358    HA   ALA  43           HA       ALA  43  10.020  -1.271  -4.544
  359   1HB   ALA  43          HB1       ALA  43   8.979   0.706  -3.340
  360   2HB   ALA  43          HB2       ALA  43   9.258   0.876  -5.072
  361   3HB   ALA  43          HB3       ALA  43  10.353   1.643  -3.924
  362    H    GLU  44           HN       GLU  44  11.301  -1.739  -6.183
  363    HA   GLU  44           HA       GLU  44  14.042  -1.037  -6.311
  364   1HB   GLU  44          HB1       GLU  44  12.665  -2.359  -8.628
  365   2HB   GLU  44          HB2       GLU  44  14.260  -2.664  -7.946
  366   1HG   GLU  44          HG1       GLU  44  13.109  -4.539  -7.249
  367   2HG   GLU  44          HG2       GLU  44  12.951  -3.491  -5.853
  368    H    GLY  45           HN       GLY  45  13.806   1.296  -6.310
  369   1HA   GLY  45          HA1       GLY  45  14.760   2.733  -8.269
  370   2HA   GLY  45          HA2       GLY  45  13.118   2.585  -8.853
  371    H    TYR  46           HN       TYR  46  12.224   2.784  -5.890
  372    HA   TYR  46           HA       TYR  46  12.449   5.696  -5.617
  373   1HB   TYR  46          HB1       TYR  46  10.259   4.932  -6.404
  374   2HB   TYR  46          HB2       TYR  46  10.075   3.969  -4.945
  375    HD1  TYR  46           HD1      TYR  46   9.807   7.285  -6.426
  376    HD2  TYR  46           HD2      TYR  46   9.904   5.106  -2.725
  377    HE1  TYR  46           HE1      TYR  46   8.689   9.197  -5.287
  378    HE2  TYR  46           HE2      TYR  46   8.686   6.960  -1.591
  379    HH   TYR  46           HH       TYR  46   7.162   9.483  -3.325
  380    H    SER  47           HN       SER  47  13.030   6.583  -3.739
  381    HA   SER  47           HA       SER  47  14.005   4.928  -1.592
  382   1HB   SER  47          HB1       SER  47  14.169   7.722  -0.972
  383   2HB   SER  47          HB2       SER  47  15.471   6.588  -1.337
  384    HG   SER  47           HG       SER  47  15.608   7.412  -3.261
  385    H    TYR  48           HN       TYR  48  13.444   5.000   0.520
  386    HA   TYR  48           HA       TYR  48  10.791   5.933   1.326
  387   1HB   TYR  48          HB1       TYR  48  12.504   3.572   2.080
  388   2HB   TYR  48          HB2       TYR  48  11.088   4.033   3.018
  389    HD1  TYR  48           HD1      TYR  48   8.846   3.846   2.103
  390    HD2  TYR  48           HD2      TYR  48  12.276   2.603  -0.172
  391    HE1  TYR  48           HE1      TYR  48   7.370   2.483   0.637
  392    HE2  TYR  48           HE2      TYR  48  10.812   1.237  -1.644
  393    HH   TYR  48           HH       TYR  48   7.854   0.210  -0.751
  394    H    THR  49           HN       THR  49  10.558   6.536   3.715
  395    HA   THR  49           HA       THR  49  12.492   8.468   4.552
  396    HB   THR  49           HB       THR  49  10.998   8.391   6.712
  397    HG1  THR  49           HG1      THR  49   9.051   7.524   4.915
  398   1HG2  THR  49          HG21      THR  49   9.493   9.993   5.730
  399   2HG2  THR  49          HG22      THR  49   9.912   9.437   4.110
  400   3HG2  THR  49          HG23      THR  49  11.125  10.241   5.107
  401    H    ASP  50           HN       ASP  50  13.392   8.616   6.738
  402    HA   ASP  50           HA       ASP  50  15.067   6.549   7.475
  403   1HB   ASP  50          HB1       ASP  50  15.391   8.920   8.027
  404   2HB   ASP  50          HB2       ASP  50  14.033   8.852   9.148
  405    H    ALA  51           HN       ALA  51  11.796   7.199   8.588
  406    HA   ALA  51           HA       ALA  51  11.881   5.327  10.770
  407   1HB   ALA  51          HB1       ALA  51   9.722   6.159  11.324
  408   2HB   ALA  51          HB2       ALA  51   9.506   6.850   9.715
  409   3HB   ALA  51          HB3       ALA  51  10.700   7.538  10.815
  410    H    ASN  52           HN       ASN  52  10.558   5.253   7.441
  411    HA   ASN  52           HA       ASN  52   8.945   2.934   7.911
  412   1HB   ASN  52          HB1       ASN  52   8.096   4.180   6.180
  413   2HB   ASN  52          HB2       ASN  52   9.684   4.604   5.555
  414   1HD2  ASN  52          HD21      ASN  52   7.015   2.460   5.206
  415   2HD2  ASN  52          HD22      ASN  52   7.701   1.613   3.868
  416    H    ILE  53           HN       ILE  53  12.207   3.428   6.628
  417    HA   ILE  53           HA       ILE  53  12.700   0.737   5.908
  418    HB   ILE  53           HB       ILE  53  14.588   2.984   6.551
  419   1HG1  ILE  53          HG11      ILE  53  13.741   1.872   3.854
  420   2HG1  ILE  53          HG12      ILE  53  13.022   3.298   4.596
  421   1HG2  ILE  53          HG21      ILE  53  15.181   0.315   5.247
  422   2HG2  ILE  53          HG22      ILE  53  15.801   0.891   6.794
  423   3HG2  ILE  53          HG23      ILE  53  16.299   1.680   5.299
  424   1HD1  ILE  53          HD11      ILE  53  15.861   2.962   3.631
  425   2HD1  ILE  53          HD12      ILE  53  15.322   4.332   4.603
  426   3HD1  ILE  53          HD13      ILE  53  14.627   4.057   3.006
  427    H    LYS  54           HN       LYS  54  14.278   2.441   8.672
  428    HA   LYS  54           HA       LYS  54  15.075   0.444  10.255
  429   1HB   LYS  54          HB1       LYS  54  13.647   2.974  11.051
  430   2HB   LYS  54          HB2       LYS  54  14.448   1.913  12.212
  431   1HG   LYS  54          HG1       LYS  54  16.578   2.211  11.119
  432   2HG   LYS  54          HG2       LYS  54  15.824   3.125   9.809
  433   1HD   LYS  54          HD1       LYS  54  15.154   4.865  11.440
  434   2HD   LYS  54          HD2       LYS  54  15.992   3.962  12.713
  435   1HE   LYS  54          HE1       LYS  54  18.111   4.277  11.675
  436   2HE   LYS  54          HE2       LYS  54  17.369   4.859  10.181
  437   1HZ   LYS  54          HZ1       LYS  54  17.499   6.244  12.790
  438   2HZ   LYS  54          HZ2       LYS  54  16.476   6.740  11.532
  439   3HZ   LYS  54          HZ3       LYS  54  18.153   6.740  11.306
  440    H    LYS  55           HN       LYS  55  11.792   0.824   9.402
  441    HA   LYS  55           HA       LYS  55  10.606  -0.413  11.716
  442   1HB   LYS  55          HB1       LYS  55   9.410   1.295  10.556
  443   2HB   LYS  55          HB2       LYS  55   9.531   0.439   9.037
  444   1HG   LYS  55          HG1       LYS  55   7.364   0.048   9.550
  445   2HG   LYS  55          HG2       LYS  55   8.103  -1.364  10.284
  446   1HD   LYS  55          HD1       LYS  55   7.329   1.148  11.778
  447   2HD   LYS  55          HD2       LYS  55   6.334  -0.303  11.672
  448   1HE   LYS  55          HE1       LYS  55   9.090  -0.119  12.909
  449   2HE   LYS  55          HE2       LYS  55   7.564  -0.236  13.787
  450   1HZ   LYS  55          HZ1       LYS  55   8.350  -2.408  13.748
  451   2HZ   LYS  55          HZ2       LYS  55   8.918  -2.294  12.162
  452   3HZ   LYS  55          HZ3       LYS  55   7.256  -2.387  12.453
  453    H    ASN  56           HN       ASN  56  11.575  -1.547   8.557
  454    HA   ASN  56           HA       ASN  56  11.452  -3.433   7.380
  455   1HB   ASN  56          HB1       ASN  56  13.396  -3.596   9.015
  456   2HB   ASN  56          HB2       ASN  56  12.424  -4.743   9.908
  457   1HD2  ASN  56          HD21      ASN  56  14.057  -4.247   6.743
  458   2HD2  ASN  56          HD22      ASN  56  13.831  -5.910   6.414
  459    H    VAL  57           HN       VAL  57   8.843  -2.950   8.426
  460    HA   VAL  57           HA       VAL  57   7.742  -5.302   9.586
  461    HB   VAL  57           HB       VAL  57   6.839  -2.726   9.135
  462   1HG1  VAL  57          HG11      VAL  57   4.574  -2.983   8.218
  463   2HG1  VAL  57          HG12      VAL  57   4.984  -4.611   7.680
  464   3HG1  VAL  57          HG13      VAL  57   5.814  -3.218   6.986
  465   1HG2  VAL  57          HG21      VAL  57   6.490  -4.048  11.096
  466   2HG2  VAL  57          HG22      VAL  57   5.472  -5.181  10.207
  467   3HG2  VAL  57          HG23      VAL  57   4.922  -3.528  10.478
  468    H    LEU  58           HN       LEU  58   6.980  -7.140   8.664
  469    HA   LEU  58           HA       LEU  58   7.457  -7.450   5.818
  470   1HB   LEU  58          HB1       LEU  58   8.317  -9.121   7.470
  471   2HB   LEU  58          HB2       LEU  58   6.653  -9.563   7.827
  472    HG   LEU  58           HG       LEU  58   7.378  -9.639   4.953
  473   1HD1  LEU  58          HD11      LEU  58   9.437 -10.508   5.996
  474   2HD1  LEU  58          HD12      LEU  58   8.555 -11.766   5.129
  475   3HD1  LEU  58          HD13      LEU  58   8.475 -11.688   6.890
  476   1HD2  LEU  58          HD21      LEU  58   6.115 -11.727   4.996
  477   2HD2  LEU  58          HD22      LEU  58   5.188 -10.442   5.769
  478   3HD2  LEU  58          HD23      LEU  58   6.011 -11.650   6.755
  479    H    TRP  59           HN       TRP  59   5.883  -6.557   4.663
  480    HA   TRP  59           HA       TRP  59   3.225  -6.189   5.358
  481   1HB   TRP  59          HB1       TRP  59   4.469  -6.433   2.620
  482   2HB   TRP  59          HB2       TRP  59   2.861  -5.807   2.932
  483    HD1  TRP  59           HD1      TRP  59   6.017  -4.560   2.014
  484    HE1  TRP  59           HE1      TRP  59   6.401  -2.136   2.807
  485    HE3  TRP  59           HE3      TRP  59   2.237  -4.142   5.434
  486    HZ2  TRP  59           HZ2      TRP  59   5.361  -0.316   4.752
  487    HZ3  TRP  59           HZ3      TRP  59   1.942  -2.053   6.709
  488    HH2  TRP  59           HH2      TRP  59   3.473  -0.143   6.387
  489    H    ASP  60           HN       ASP  60   1.925  -7.729   5.912
  490    HA   ASP  60           HA       ASP  60   1.560 -10.194   4.378
  491   1HB   ASP  60          HB1       ASP  60   1.986 -11.183   6.342
  492   2HB   ASP  60          HB2       ASP  60   1.982  -9.643   7.179
  493    H    GLU  61           HN       GLU  61  -0.871 -10.994   5.221
  494    HA   GLU  61           HA       GLU  61  -2.646  -9.464   3.640
  495   1HB   GLU  61          HB1       GLU  61  -2.649 -12.044   4.481
  496   2HB   GLU  61          HB2       GLU  61  -3.837 -11.362   5.587
  497   1HG   GLU  61          HG1       GLU  61  -5.193 -12.005   3.839
  498   2HG   GLU  61          HG2       GLU  61  -4.852 -10.332   3.391
  499    H    ASN  62           HN       ASN  62  -2.500  -9.932   7.186
  500    HA   ASN  62           HA       ASN  62  -4.456  -7.879   7.676
  501   1HB   ASN  62          HB1       ASN  62  -4.390  -9.860   9.060
  502   2HB   ASN  62          HB2       ASN  62  -2.725  -9.542   9.515
  503   1HD2  ASN  62          HD21      ASN  62  -2.303  -7.824  10.962
  504   2HD2  ASN  62          HD22      ASN  62  -3.552  -7.176  11.964
  505    H    ASN  63           HN       ASN  63  -0.892  -8.110   8.155
  506    HA   ASN  63           HA       ASN  63  -0.404  -5.676   9.325
  507   1HB   ASN  63          HB1       ASN  63   1.271  -7.382   9.074
  508   2HB   ASN  63          HB2       ASN  63   1.256  -7.214   7.330
  509   1HD2  ASN  63          HD21      ASN  63   1.550  -4.777   9.969
  510   2HD2  ASN  63          HD22      ASN  63   2.854  -4.065   9.085
  511    H    MET  64           HN       MET  64  -0.532  -6.101   5.705
  512    HA   MET  64           HA       MET  64  -0.056  -3.427   5.079
  513   1HB   MET  64          HB1       MET  64  -0.014  -5.170   3.410
  514   2HB   MET  64          HB2       MET  64  -1.736  -5.458   3.612
  515   1HG   MET  64          HG1       MET  64  -1.635  -2.784   3.009
  516   2HG   MET  64          HG2       MET  64  -0.333  -3.443   2.037
  517   1HE   MET  64          HE1       MET  64  -3.440  -5.470   3.032
  518   2HE   MET  64          HE2       MET  64  -4.579  -5.217   1.708
  519   3HE   MET  64          HE3       MET  64  -4.254  -3.914   2.853
  520    H    SER  65           HN       SER  65  -3.171  -4.914   5.975
  521    HA   SER  65           HA       SER  65  -4.818  -2.690   5.524
  522   1HB   SER  65          HB1       SER  65  -5.280  -4.739   7.683
  523   2HB   SER  65          HB2       SER  65  -6.481  -3.796   6.810
  524    HG   SER  65           HG       SER  65  -5.198  -6.123   6.111
  525    H    GLU  66           HN       GLU  66  -2.930  -3.542   8.405
  526    HA   GLU  66           HA       GLU  66  -3.820  -1.689  10.238
  527   1HB   GLU  66          HB1       GLU  66  -0.938  -2.509   9.779
  528   2HB   GLU  66          HB2       GLU  66  -1.640  -1.937  11.289
  529   1HG   GLU  66          HG1       GLU  66  -2.913  -3.913  11.568
  530   2HG   GLU  66          HG2       GLU  66  -2.612  -4.430   9.909
  531    H    TYR  67           HN       TYR  67  -1.210  -1.230   7.876
  532    HA   TYR  67           HA       TYR  67  -0.640   1.467   8.292
  533   1HB   TYR  67          HB1       TYR  67   0.587  -0.450   7.024
  534   2HB   TYR  67          HB2       TYR  67  -0.317   0.130   5.637
  535    HD1  TYR  67           HD1      TYR  67   0.958   1.404   4.188
  536    HD2  TYR  67           HD2      TYR  67   1.610   1.740   8.420
  537    HE1  TYR  67           HE1      TYR  67   2.840   2.980   3.766
  538    HE2  TYR  67           HE2      TYR  67   3.526   3.273   8.021
  539    HH   TYR  67           HH       TYR  67   4.155   4.805   5.198
  540    H    LEU  68           HN       LEU  68  -2.976   0.012   5.951
  541    HA   LEU  68           HA       LEU  68  -3.543   2.389   4.586
  542   1HB   LEU  68          HB1       LEU  68  -5.521   0.183   5.103
  543   2HB   LEU  68          HB2       LEU  68  -5.510   1.315   3.763
  544    HG   LEU  68           HG       LEU  68  -3.565  -0.951   4.247
  545   1HD1  LEU  68          HD11      LEU  68  -5.763  -1.535   3.343
  546   2HD1  LEU  68          HD12      LEU  68  -4.523  -1.721   2.104
  547   3HD1  LEU  68          HD13      LEU  68  -5.587  -0.315   2.083
  548   1HD2  LEU  68          HD21      LEU  68  -2.365   1.034   3.294
  549   2HD2  LEU  68          HD22      LEU  68  -3.533   1.058   1.973
  550   3HD2  LEU  68          HD23      LEU  68  -2.457  -0.324   2.173
  551    H    THR  69           HN       THR  69  -5.066   1.198   7.603
  552    HA   THR  69           HA       THR  69  -7.121   3.130   7.699
  553    HB   THR  69           HB       THR  69  -6.371   2.436  10.355
  554    HG1  THR  69           HG1      THR  69  -5.204   0.735   9.445
  555   1HG2  THR  69          HG21      THR  69  -8.478   1.203  10.343
  556   2HG2  THR  69          HG22      THR  69  -8.552   1.308   8.584
  557   3HG2  THR  69          HG23      THR  69  -8.694   2.769   9.560
  558    H    ASN  70           HN       ASN  70  -3.753   3.309   8.729
  559    HA   ASN  70           HA       ASN  70  -3.802   6.134   8.827
  560   1HB   ASN  70          HB1       ASN  70  -4.783   5.092  11.145
  561   2HB   ASN  70          HB2       ASN  70  -3.074   5.232  11.541
  562   1HD2  ASN  70          HD21      ASN  70  -3.594   6.876  13.083
  563   2HD2  ASN  70          HD22      ASN  70  -3.733   8.472  12.434
  564    HA   PRO  71           HA       PRO  71   0.307   4.293   7.781
  565   1HB   PRO  71          HB1       PRO  71   1.019   6.451   6.221
  566   2HB   PRO  71          HB2       PRO  71   0.176   5.016   5.630
  567   1HG   PRO  71          HG1       PRO  71  -0.931   7.686   6.396
  568   2HG   PRO  71          HG2       PRO  71  -1.373   6.635   5.037
  569   1HD   PRO  71          HD1       PRO  71  -2.884   6.790   7.253
  570   2HD   PRO  71          HD2       PRO  71  -2.689   5.265   6.363
  571    H    LYS  72           HN       LYS  72  -0.176   7.778   8.387
  572    HA   LYS  72           HA       LYS  72   2.366   8.385   9.352
  573   1HB   LYS  72          HB1       LYS  72  -0.286   9.708   9.928
  574   2HB   LYS  72          HB2       LYS  72   1.263  10.378  10.411
  575   1HG   LYS  72          HG1       LYS  72   1.391   9.801   7.631
  576   2HG   LYS  72          HG2       LYS  72  -0.111  10.663   7.940
  577   1HD   LYS  72          HD1       LYS  72   1.187  12.441   9.084
  578   2HD   LYS  72          HD2       LYS  72   2.674  11.584   8.675
  579   1HE   LYS  72          HE1       LYS  72   0.667  12.667   6.694
  580   2HE   LYS  72          HE2       LYS  72   2.187  13.439   7.120
  581   1HZ   LYS  72          HZ1       LYS  72   3.289  11.364   6.275
  582   2HZ   LYS  72          HZ2       LYS  72   2.529  12.315   5.104
  583   3HZ   LYS  72          HZ3       LYS  72   1.778  10.906   5.650
  584    H    LYS  73           HN       LYS  73  -0.426   7.095  11.079
  585    HA   LYS  73           HA       LYS  73   0.780   7.414  13.661
  586   1HB   LYS  73          HB1       LYS  73  -1.623   7.418  13.511
  587   2HB   LYS  73          HB2       LYS  73  -1.628   5.816  12.790
  588   1HG   LYS  73          HG1       LYS  73  -2.289   5.644  15.100
  589   2HG   LYS  73          HG2       LYS  73  -0.715   4.888  14.895
  590   1HD   LYS  73          HD1       LYS  73   0.040   7.396  15.607
  591   2HD   LYS  73          HD2       LYS  73  -1.492   7.272  16.468
  592   1HE   LYS  73          HE1       LYS  73   0.012   6.475  18.040
  593   2HE   LYS  73          HE2       LYS  73  -0.553   4.985  17.290
  594   1HZ   LYS  73          HZ1       LYS  73   1.707   4.698  17.322
  595   2HZ   LYS  73          HZ2       LYS  73   2.046   6.325  17.021
  596   3HZ   LYS  73          HZ3       LYS  73   1.487   5.338  15.768
  597    H    TYR  74           HN       TYR  74   0.531   4.694  11.397
  598    HA   TYR  74           HA       TYR  74   1.790   2.775  13.061
  599   1HB   TYR  74          HB1       TYR  74   0.336   2.463  10.954
  600   2HB   TYR  74          HB2       TYR  74   1.839   2.695  10.062
  601    HD1  TYR  74           HD1      TYR  74   3.533   0.936   9.979
  602    HD2  TYR  74           HD2      TYR  74   0.097   0.634  12.545
  603    HE1  TYR  74           HE1      TYR  74   4.036  -1.480  10.367
  604    HE2  TYR  74           HE2      TYR  74   0.578  -1.766  12.935
  605    HH   TYR  74           HH       TYR  74   1.738  -3.609  11.748
  606    H    ILE  75           HN       ILE  75   3.059   4.963  10.626
  607    HA   ILE  75           HA       ILE  75   5.804   4.477  11.530
  608    HB   ILE  75           HB       ILE  75   4.862   4.574   8.657
  609   1HG1  ILE  75          HG11      ILE  75   6.442   2.517  10.245
  610   2HG1  ILE  75          HG12      ILE  75   4.804   2.325   9.637
  611   1HG2  ILE  75          HG21      ILE  75   7.699   4.702   9.721
  612   2HG2  ILE  75          HG22      ILE  75   6.821   6.039   8.982
  613   3HG2  ILE  75          HG23      ILE  75   7.235   4.620   8.022
  614   1HD1  ILE  75          HD11      ILE  75   5.712   2.430   7.317
  615   2HD1  ILE  75          HD12      ILE  75   6.316   1.063   8.252
  616   3HD1  ILE  75          HD13      ILE  75   7.338   2.477   7.999
  617    HA   PRO  76           HA       PRO  76   4.881   8.912  12.042
  618   1HB   PRO  76          HB1       PRO  76   6.920   9.329  13.807
  619   2HB   PRO  76          HB2       PRO  76   5.332   8.711  14.274
  620   1HG   PRO  76          HG1       PRO  76   7.879   7.220  13.788
  621   2HG   PRO  76          HG2       PRO  76   6.672   6.989  15.066
  622   1HD   PRO  76          HD1       PRO  76   6.796   5.395  12.888
  623   2HD   PRO  76          HD2       PRO  76   5.263   5.786  13.693
  624    H    GLY  77           HN       GLY  77   5.533  10.218  10.440
  625   1HA   GLY  77          HA1       GLY  77   7.230  11.736   9.645
  626   2HA   GLY  77          HA2       GLY  77   8.408  10.453   9.840
  627    H    THR  78           HN       THR  78   5.938   8.828   8.506
  628    HA   THR  78           HA       THR  78   7.031   8.363   6.016
  629    HB   THR  78           HB       THR  78   5.287   7.040   7.287
  630    HG1  THR  78           HG1      THR  78   6.020   6.599   5.110
  631   1HG2  THR  78          HG21      THR  78   2.950   7.253   6.471
  632   2HG2  THR  78          HG22      THR  78   3.368   8.828   5.797
  633   3HG2  THR  78          HG23      THR  78   3.451   8.565   7.539
  634    H    LYS  79           HN       LYS  79   6.751   9.073   3.967
  635    HA   LYS  79           HA       LYS  79   5.905  11.765   3.526
  636   1HB   LYS  79          HB1       LYS  79   6.540   9.643   1.476
  637   2HB   LYS  79          HB2       LYS  79   6.539  11.380   1.223
  638   1HG   LYS  79          HG1       LYS  79   8.435  11.536   2.865
  639   2HG   LYS  79          HG2       LYS  79   8.496   9.765   2.854
  640   1HD   LYS  79          HD1       LYS  79   8.397  10.491   0.150
  641   2HD   LYS  79          HD2       LYS  79   9.514  11.648   0.886
  642   1HE   LYS  79          HE1       LYS  79  10.966   9.921   0.408
  643   2HE   LYS  79          HE2       LYS  79  10.479   9.487   2.047
  644   1HZ   LYS  79          HZ1       LYS  79   8.826   8.443  -0.103
  645   2HZ   LYS  79          HZ2       LYS  79   9.330   7.706   1.331
  646   3HZ   LYS  79          HZ3       LYS  79  10.388   7.798   0.019
  647    H    MET  80           HN       MET  80   4.152   8.719   3.250
  648    HA   MET  80           HA       MET  80   2.246   9.599   1.360
  649   1HB   MET  80          HB1       MET  80   2.287   7.320   1.418
  650   2HB   MET  80          HB2       MET  80   2.485   7.253   3.173
  651   1HG   MET  80          HG1       MET  80   0.254   7.514   3.588
  652   2HG   MET  80          HG2       MET  80  -0.040   8.379   2.091
  653   1HE   MET  80          HE1       MET  80   0.172   4.968   3.921
  654   2HE   MET  80          HE2       MET  80   1.604   4.902   2.893
  655   3HE   MET  80          HE3       MET  80   0.254   3.807   2.596
  656    H    ALA  81           HN       ALA  81   1.145  11.336   1.640
  657    HA   ALA  81           HA       ALA  81   0.020  12.110   4.190
  658   1HB   ALA  81          HB1       ALA  81   0.248  13.652   1.621
  659   2HB   ALA  81          HB2       ALA  81   1.371  13.707   2.979
  660   3HB   ALA  81          HB3       ALA  81  -0.279  14.294   3.178
  661    H    PHE  82           HN       PHE  82  -1.150  10.073   2.342
  662    HA   PHE  82           HA       PHE  82  -3.582  10.681   1.243
  663   1HB   PHE  82          HB1       PHE  82  -2.522   8.686   0.634
  664   2HB   PHE  82          HB2       PHE  82  -2.390   8.139   2.300
  665    HD1  PHE  82           HD1      PHE  82  -4.936   8.924  -0.342
  666    HD2  PHE  82           HD2      PHE  82  -3.949   6.640   3.168
  667    HE1  PHE  82           HE1      PHE  82  -7.108   7.721  -0.512
  668    HE2  PHE  82           HE2      PHE  82  -6.123   5.449   3.006
  669    HZ   PHE  82           HZ       PHE  82  -7.711   6.004   1.178
  670    H    GLY  83           HN       GLY  83  -2.963  10.460   4.666
  671   1HA   GLY  83          HA1       GLY  83  -4.493  11.127   6.325
  672   2HA   GLY  83          HA2       GLY  83  -5.797  10.939   5.174
  673    H    GLY  84           HN       GLY  84  -5.280   8.202   4.468
  674   1HA   GLY  84          HA1       GLY  84  -5.221   6.006   5.300
  675   2HA   GLY  84          HA2       GLY  84  -5.403   6.631   6.929
  676    H    LEU  85           HN       LEU  85  -6.897   4.801   4.746
  677    HA   LEU  85           HA       LEU  85  -9.606   5.712   4.799
  678   1HB   LEU  85          HB1       LEU  85  -8.213   3.244   3.833
  679   2HB   LEU  85          HB2       LEU  85  -9.956   3.243   3.994
  680    HG   LEU  85           HG       LEU  85  -8.360   5.123   2.233
  681   1HD1  LEU  85          HD11      LEU  85 -10.027   2.666   1.675
  682   2HD1  LEU  85          HD12      LEU  85  -8.321   2.919   1.306
  683   3HD1  LEU  85          HD13      LEU  85  -9.556   3.821   0.428
  684   1HD2  LEU  85          HD21      LEU  85 -10.437   6.207   2.935
  685   2HD2  LEU  85          HD22      LEU  85 -11.356   4.764   2.511
  686   3HD2  LEU  85          HD23      LEU  85 -10.559   5.702   1.250
  687    H    LYS  86           HN       LYS  86 -10.353   5.936   6.743
  688    HA   LYS  86           HA       LYS  86 -10.055   4.247   8.991
  689   1HB   LYS  86          HB1       LYS  86 -12.040   6.484   8.560
  690   2HB   LYS  86          HB2       LYS  86 -11.518   5.823  10.104
  691   1HG   LYS  86          HG1       LYS  86  -9.566   7.088   8.189
  692   2HG   LYS  86          HG2       LYS  86 -10.478   8.043   9.361
  693   1HD   LYS  86          HD1       LYS  86  -9.544   6.678  11.191
  694   2HD   LYS  86          HD2       LYS  86  -8.625   5.737  10.017
  695   1HE   LYS  86          HE1       LYS  86  -8.321   8.722  10.375
  696   2HE   LYS  86          HE2       LYS  86  -7.318   7.536  11.206
  697   1HZ   LYS  86          HZ1       LYS  86  -6.567   6.721   9.063
  698   2HZ   LYS  86          HZ2       LYS  86  -6.243   8.373   9.215
  699   3HZ   LYS  86          HZ3       LYS  86  -7.540   7.856   8.264
  700    H    LYS  87           HN       LYS  87 -11.530   3.182   6.482
  701    HA   LYS  87           HA       LYS  87 -13.949   2.128   7.806
  702   1HB   LYS  87          HB1       LYS  87 -14.142   1.578   5.103
  703   2HB   LYS  87          HB2       LYS  87 -15.033   2.783   5.993
  704   1HG   LYS  87          HG1       LYS  87 -13.293   4.481   5.286
  705   2HG   LYS  87          HG2       LYS  87 -12.615   3.212   4.221
  706   1HD   LYS  87          HD1       LYS  87 -14.808   2.766   3.323
  707   2HD   LYS  87          HD2       LYS  87 -15.530   3.930   4.381
  708   1HE   LYS  87          HE1       LYS  87 -15.725   4.932   2.347
  709   2HE   LYS  87          HE2       LYS  87 -14.165   5.612   2.863
  710   1HZ   LYS  87          HZ1       LYS  87 -14.006   4.637   0.636
  711   2HZ   LYS  87          HZ2       LYS  87 -14.519   3.143   1.227
  712   3HZ   LYS  87          HZ3       LYS  87 -13.033   3.783   1.733
  713    H    GLU  88           HN       GLU  88 -13.042   0.256   8.675
  714    HA   GLU  88           HA       GLU  88 -11.228  -1.512   7.661
  715   1HB   GLU  88          HB1       GLU  88 -12.253  -1.476   9.941
  716   2HB   GLU  88          HB2       GLU  88 -13.653  -2.300   9.263
  717   1HG   GLU  88          HG1       GLU  88 -11.520  -3.850   8.398
  718   2HG   GLU  88          HG2       GLU  88 -11.067  -3.387  10.045
  719    H    LYS  89           HN       LYS  89 -14.768  -1.783   7.090
  720    HA   LYS  89           HA       LYS  89 -14.742  -4.208   5.739
  721   1HB   LYS  89          HB1       LYS  89 -16.717  -2.149   4.910
  722   2HB   LYS  89          HB2       LYS  89 -16.964  -3.832   5.370
  723   1HG   LYS  89          HG1       LYS  89 -16.287  -1.588   7.271
  724   2HG   LYS  89          HG2       LYS  89 -17.892  -2.257   7.025
  725   1HD   LYS  89          HD1       LYS  89 -15.537  -3.427   8.449
  726   2HD   LYS  89          HD2       LYS  89 -17.244  -3.399   8.923
  727   1HE   LYS  89          HE1       LYS  89 -17.809  -5.122   7.401
  728   2HE   LYS  89          HE2       LYS  89 -16.288  -4.958   6.525
  729   1HZ   LYS  89          HZ1       LYS  89 -16.823  -6.289   9.085
  730   2HZ   LYS  89          HZ2       LYS  89 -15.286  -5.641   8.808
  731   3HZ   LYS  89          HZ3       LYS  89 -15.903  -6.820   7.765
  732    H    ASP  90           HN       ASP  90 -14.520  -0.985   4.468
  733    HA   ASP  90           HA       ASP  90 -14.323  -1.344   1.770
  734   1HB   ASP  90          HB1       ASP  90 -14.544   0.737   3.261
  735   2HB   ASP  90          HB2       ASP  90 -12.793   0.712   3.349
  736    H    ARG  91           HN       ARG  91 -11.556  -1.275   4.123
  737    HA   ARG  91           HA       ARG  91  -9.552  -1.816   2.218
  738   1HB   ARG  91          HB1       ARG  91  -9.088  -2.975   4.911
  739   2HB   ARG  91          HB2       ARG  91  -8.033  -1.986   3.908
  740   1HG   ARG  91          HG1       ARG  91  -9.066   0.010   4.592
  741   2HG   ARG  91          HG2       ARG  91 -10.458  -0.834   5.251
  742   1HD   ARG  91          HD1       ARG  91  -7.681  -0.624   6.399
  743   2HD   ARG  91          HD2       ARG  91  -9.185  -0.038   7.090
  744    HE   ARG  91           HE       ARG  91  -9.442  -2.195   6.489
  745   1HH1  ARG  91          HH21      ARG  91  -7.111  -0.844   8.684
  746   2HH1  ARG  91          HH22      ARG  91  -7.085  -2.001   9.970
  747   1HH2  ARG  91          HH11      ARG  91  -9.360  -4.130   8.527
  748   2HH2  ARG  91          HH12      ARG  91  -8.351  -3.828   9.896
  749    H    ASN  92           HN       ASN  92 -11.672  -4.057   3.940
  750    HA   ASN  92           HA       ASN  92 -10.481  -6.471   3.536
  751   1HB   ASN  92          HB1       ASN  92 -13.397  -5.726   3.345
  752   2HB   ASN  92          HB2       ASN  92 -12.839  -7.391   3.316
  753   1HD2  ASN  92          HD21      ASN  92 -14.599  -6.521   5.215
  754   2HD2  ASN  92          HD22      ASN  92 -13.735  -6.752   6.696
  755    H    ASP  93           HN       ASP  93 -12.719  -5.048   1.102
  756    HA   ASP  93           HA       ASP  93 -12.092  -6.844  -0.969
  757   1HB   ASP  93          HB1       ASP  93 -13.970  -4.916  -0.644
  758   2HB   ASP  93          HB2       ASP  93 -12.889  -4.112  -1.771
  759    H    LEU  94           HN       LEU  94 -10.573  -3.676  -0.161
  760    HA   LEU  94           HA       LEU  94  -8.987  -3.294  -2.351
  761   1HB   LEU  94          HB1       LEU  94  -9.121  -2.367   0.417
  762   2HB   LEU  94          HB2       LEU  94  -7.524  -2.359  -0.234
  763    HG   LEU  94           HG       LEU  94  -9.788  -1.082  -1.734
  764   1HD1  LEU  94          HD11      LEU  94  -9.612  -0.206   0.614
  765   2HD1  LEU  94          HD12      LEU  94  -9.352   1.001  -0.649
  766   3HD1  LEU  94          HD13      LEU  94  -7.975   0.328   0.222
  767   1HD2  LEU  94          HD21      LEU  94  -7.608  -1.354  -2.937
  768   2HD2  LEU  94          HD22      LEU  94  -6.856  -0.347  -1.702
  769   3HD2  LEU  94          HD23      LEU  94  -8.111   0.326  -2.739
  770    H    ILE  95           HN       ILE  95  -8.359  -5.423   0.406
  771    HA   ILE  95           HA       ILE  95  -5.681  -6.083  -0.151
  772    HB   ILE  95           HB       ILE  95  -7.724  -7.833   1.230
  773   1HG1  ILE  95          HG11      ILE  95  -5.921  -5.843   2.613
  774   2HG1  ILE  95          HG12      ILE  95  -7.512  -5.368   2.027
  775   1HG2  ILE  95          HG21      ILE  95  -4.735  -7.636   1.671
  776   2HG2  ILE  95          HG22      ILE  95  -5.524  -8.903   0.733
  777   3HG2  ILE  95          HG23      ILE  95  -5.851  -8.754   2.459
  778   1HD1  ILE  95          HD11      ILE  95  -6.983  -7.591   4.004
  779   2HD1  ILE  95          HD12      ILE  95  -8.565  -7.035   3.458
  780   3HD1  ILE  95          HD13      ILE  95  -7.539  -5.967   4.414
  781    H    THR  96           HN       THR  96  -8.703  -7.799  -1.047
  782    HA   THR  96           HA       THR  96  -7.615  -9.911  -2.471
  783    HB   THR  96           HB       THR  96 -10.099  -8.773  -3.616
  784    HG1  THR  96           HG1      THR  96 -10.700  -8.316  -1.586
  785   1HG2  THR  96          HG21      THR  96  -9.354 -11.471  -2.463
  786   2HG2  THR  96          HG22      THR  96  -9.355 -11.042  -4.174
  787   3HG2  THR  96          HG23      THR  96 -10.873 -11.088  -3.276
  788    H    TYR  97           HN       TYR  97  -8.387  -6.640  -3.728
  789    HA   TYR  97           HA       TYR  97  -7.660  -7.179  -6.398
  790   1HB   TYR  97          HB1       TYR  97  -8.988  -5.249  -5.916
  791   2HB   TYR  97          HB2       TYR  97  -7.738  -4.581  -4.875
  792    HD1  TYR  97           HD1      TYR  97  -6.699  -2.728  -5.744
  793    HD2  TYR  97           HD2      TYR  97  -7.851  -5.905  -8.402
  794    HE1  TYR  97           HE1      TYR  97  -5.718  -1.477  -7.656
  795    HE2  TYR  97           HE2      TYR  97  -6.983  -4.610 -10.340
  796    HH   TYR  97           HH       TYR  97  -4.895  -2.402 -10.299
  797    H    LEU  98           HN       LEU  98  -5.704  -5.513  -3.878
  798    HA   LEU  98           HA       LEU  98  -3.335  -5.293  -5.348
  799   1HB   LEU  98          HB1       LEU  98  -4.196  -4.510  -2.875
  800   2HB   LEU  98          HB2       LEU  98  -3.031  -5.763  -2.455
  801    HG   LEU  98           HG       LEU  98  -1.326  -4.608  -3.885
  802   1HD1  LEU  98          HD11      LEU  98  -3.464  -2.471  -4.039
  803   2HD1  LEU  98          HD12      LEU  98  -2.832  -3.410  -5.391
  804   3HD1  LEU  98          HD13      LEU  98  -1.786  -2.268  -4.544
  805   1HD2  LEU  98          HD21      LEU  98  -1.539  -4.189  -1.417
  806   2HD2  LEU  98          HD22      LEU  98  -2.516  -2.772  -1.802
  807   3HD2  LEU  98          HD23      LEU  98  -0.834  -2.852  -2.326
  808    H    LYS  99           HN       LYS  99  -4.401  -7.790  -3.117
  809    HA   LYS  99           HA       LYS  99  -2.180  -9.477  -3.196
  810   1HB   LYS  99          HB1       LYS  99  -3.427 -10.260  -1.510
  811   2HB   LYS  99          HB2       LYS  99  -4.900  -9.574  -2.170
  812   1HG   LYS  99          HG1       LYS  99  -5.208 -11.522  -3.591
  813   2HG   LYS  99          HG2       LYS  99  -3.688 -12.199  -3.040
  814   1HD   LYS  99          HD1       LYS  99  -5.519 -11.665  -0.834
  815   2HD   LYS  99          HD2       LYS  99  -6.214 -12.756  -2.036
  816   1HE   LYS  99          HE1       LYS  99  -5.017 -13.995  -0.306
  817   2HE   LYS  99          HE2       LYS  99  -4.264 -14.202  -1.880
  818   1HZ   LYS  99          HZ1       LYS  99  -3.141 -13.238   0.513
  819   2HZ   LYS  99          HZ2       LYS  99  -2.997 -12.060  -0.694
  820   3HZ   LYS  99          HZ3       LYS  99  -2.388 -13.616  -0.967
  821    H    LYS 100           HN       LYS 100  -4.963  -9.271  -5.399
  822    HA   LYS 100           HA       LYS 100  -4.324 -11.591  -6.899
  823   1HB   LYS 100          HB1       LYS 100  -6.512  -9.964  -6.669
  824   2HB   LYS 100          HB2       LYS 100  -5.980  -9.677  -8.308
  825   1HG   LYS 100          HG1       LYS 100  -7.761 -11.442  -8.033
  826   2HG   LYS 100          HG2       LYS 100  -6.326 -11.971  -8.915
  827   1HD   LYS 100          HD1       LYS 100  -6.382 -12.348  -5.987
  828   2HD   LYS 100          HD2       LYS 100  -7.455 -13.348  -6.916
  829   1HE   LYS 100          HE1       LYS 100  -5.742 -14.788  -6.656
  830   2HE   LYS 100          HE2       LYS 100  -5.130 -13.971  -8.104
  831   1HZ   LYS 100          HZ1       LYS 100  -3.396 -13.211  -6.935
  832   2HZ   LYS 100          HZ2       LYS 100  -3.927 -14.089  -5.591
  833   3HZ   LYS 100          HZ3       LYS 100  -4.428 -12.486  -5.800
  834    H    ALA 101           HN       ALA 101  -3.401  -8.367  -7.250
  835    HA   ALA 101           HA       ALA 101  -2.229  -8.432  -9.843
  836   1HB   ALA 101          HB1       ALA 101  -3.307  -6.442  -8.923
  837   2HB   ALA 101          HB2       ALA 101  -1.617  -6.124  -9.313
  838   3HB   ALA 101          HB3       ALA 101  -2.103  -6.374  -7.636
  839    H    THR 102           HN       THR 102  -0.970  -8.676  -6.539
  840    HA   THR 102           HA       THR 102   1.809  -8.771  -7.271
  841    HB   THR 102           HB       THR 102   0.526  -9.438  -4.618
  842    HG1  THR 102           HG1      THR 102   0.319  -7.200  -5.525
  843   1HG2  THR 102          HG21      THR 102   2.739  -8.943  -3.680
  844   2HG2  THR 102          HG22      THR 102   3.377  -8.702  -5.307
  845   3HG2  THR 102          HG23      THR 102   2.817 -10.298  -4.808
  846    H    GLU 103           HN       GLU 103  -0.670 -11.186  -6.355
  847    HA   GLU 103           HA       GLU 103   1.204 -13.278  -7.266
  848   1HB   GLU 103          HB1       GLU 103  -0.396 -14.721  -5.635
  849   2HB   GLU 103          HB2       GLU 103   1.130 -14.018  -5.127
  850   1HG   GLU 103          HG1       GLU 103   0.135 -12.697  -3.654
  851   2HG   GLU 103          HG2       GLU 103  -1.049 -12.146  -4.834
  852    HHA  HEC 104           HA       HEC 104   4.949   3.480   1.559
  853    HHB  HEC 104           HB       HEC 104  -0.780   0.672   0.338
  854    HHC  HEC 104           HC       HEC 104  -3.134   6.405  -1.560
  855    HHD  HEC 104           HD       HEC 104   2.865   8.800  -1.504
  856   1HMA  HEC 104          HMA1      HEC 104   0.939  -0.691   2.256
  857   2HMA  HEC 104          HMA2      HEC 104   2.463  -1.135   1.486
  858   3HMA  HEC 104          HMA3      HEC 104   0.999  -0.974   0.516
  859   1HAA  HEC 104          HAA1      HEC 104   4.006  -0.126   2.385
  860   2HAA  HEC 104          HAA2      HEC 104   4.719   1.444   2.705
  861   1HBA  HEC 104          HBA1      HEC 104   5.635   1.467   0.397
  862   2HBA  HEC 104          HBA2      HEC 104   4.978  -0.143   0.146
  863   1HMB  HEC 104          HMB1      HEC 104  -2.653   0.376  -0.313
  864   2HMB  HEC 104          HMB2      HEC 104  -3.530   0.933  -1.739
  865   3HMB  HEC 104          HMB3      HEC 104  -4.223   1.162  -0.134
  866    HAB  HEC 104           HAB      HEC 104  -4.571   5.111  -1.577
  867   1HBB  HEC 104          HBB1      HEC 104  -4.981   4.005   0.756
  868   2HBB  HEC 104          HBB2      HEC 104  -5.984   2.914  -0.199
  869   3HBB  HEC 104          HBB3      HEC 104  -6.295   4.651  -0.227
  870   1HMC  HEC 104          HMC1      HEC 104  -3.120   8.962  -1.840
  871   2HMC  HEC 104          HMC2      HEC 104  -2.767   8.156  -3.369
  872   3HMC  HEC 104          HMC3      HEC 104  -2.126   9.768  -3.054
  873    HAC  HEC 104           HAC      HEC 104   1.721   9.819  -2.854
  874   1HBC  HEC 104          HBC1      HEC 104   0.929  11.303  -1.265
  875   2HBC  HEC 104          HBC2      HEC 104  -0.719  11.247  -1.887
  876   3HBC  HEC 104          HBC3      HEC 104   0.552  12.033  -2.825
  877   1HMD  HEC 104          HMD1      HEC 104   4.989   9.188  -0.565
  878   2HMD  HEC 104          HMD2      HEC 104   5.444   8.128  -1.899
  879   3HMD  HEC 104          HMD3      HEC 104   6.435   8.185  -0.442
  880   1HAD  HEC 104          HAD1      HEC 104   7.175   6.332   0.440
  881   2HAD  HEC 104          HAD2      HEC 104   6.668   4.835   1.216
  882   1HBD  HEC 104          HBD1      HEC 104   6.133   5.891   3.208
  883   2HBD  HEC 104          HBD2      HEC 104   5.867   7.440   2.439
  884    H2   4NL 105           H2       4NL 105   0.732 -13.137  -1.297
  885    H6   4NL 105           H6       4NL 105   1.798 -13.742   3.697
  886    H3   4NL 105           H3       4NL 105  -1.370 -10.384   1.323
  887    H5   4NL 105           H5       4NL 105  -0.976 -11.846  -1.972
  888    H4   4NL 105           H4       4NL 105   0.076 -11.106   3.241
  889    H1   4NL 105           H1       4NL 105   2.178 -13.859   0.621
  890    H7   4NL 105           H7       4NL 105   2.897 -12.382   3.359
  Start of MODEL   24
    1   1H    THR  -5          HT1       THR  -5 -10.918  -5.640  12.097
    2   2H    THR  -5          HT2       THR  -5 -10.124  -5.680  10.602
    3   3H    THR  -5          HT3       THR  -5  -9.234  -5.457  12.024
    4    HA   THR  -5           HA       THR  -5  -9.173  -7.750  11.002
    5    HB   THR  -5           HB       THR  -5 -10.226  -8.106  13.749
    6    HG1  THR  -5           HG1      THR  -5  -8.026  -7.025  14.320
    7   1HG2  THR  -5          HG21      THR  -5  -8.804  -9.761  12.576
    8   2HG2  THR  -5          HG22      THR  -5  -8.058  -9.177  14.063
    9   3HG2  THR  -5          HG23      THR  -5  -7.509  -8.566  12.502
   10    H    GLU  -4           HN       GLU  -4 -11.538  -6.916   9.860
   11    HA   GLU  -4           HA       GLU  -4 -13.386  -9.091  10.548
   12   1HB   GLU  -4          HB1       GLU  -4 -14.140  -6.722  11.376
   13   2HB   GLU  -4          HB2       GLU  -4 -14.423  -6.387   9.672
   14   1HG   GLU  -4          HG1       GLU  -4 -15.666  -8.843  10.117
   15   2HG   GLU  -4          HG2       GLU  -4 -16.032  -7.896  11.554
   16    H    PHE  -3           HN       PHE  -3 -11.218  -8.761   8.653
   17    HA   PHE  -3           HA       PHE  -3 -11.934  -8.042   6.096
   18   1HB   PHE  -3          HB1       PHE  -3  -9.637  -8.444   6.573
   19   2HB   PHE  -3          HB2       PHE  -3  -9.948 -10.123   6.995
   20    HD1  PHE  -3           HD1      PHE  -3 -10.353  -7.779   4.071
   21    HD2  PHE  -3           HD2      PHE  -3  -9.426 -11.755   5.424
   22    HE1  PHE  -3           HE1      PHE  -3  -9.972  -8.488   1.718
   23    HE2  PHE  -3           HE2      PHE  -3  -9.093 -12.479   3.068
   24    HZ   PHE  -3           HZ       PHE  -3  -9.395 -10.852   1.210
   25    H    LYS  -2           HN       LYS  -2 -12.839  -8.917   4.396
   26    HA   LYS  -2           HA       LYS  -2 -13.937 -11.609   4.369
   27   1HB   LYS  -2          HB1       LYS  -2 -15.511  -9.353   5.028
   28   2HB   LYS  -2          HB2       LYS  -2 -15.913  -9.749   3.358
   29   1HG   LYS  -2          HG1       LYS  -2 -17.130 -11.497   4.008
   30   2HG   LYS  -2          HG2       LYS  -2 -15.759 -12.171   4.886
   31   1HD   LYS  -2          HD1       LYS  -2 -17.769 -10.169   5.943
   32   2HD   LYS  -2          HD2       LYS  -2 -17.654 -11.871   6.387
   33   1HE   LYS  -2          HE1       LYS  -2 -15.517 -11.502   7.453
   34   2HE   LYS  -2          HE2       LYS  -2 -15.464  -9.842   6.869
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.631 -10.770   8.656
   36   2HZ   LYS  -2          HZ2       LYS  -2 -17.108  -9.190   8.365
   37   3HZ   LYS  -2          HZ3       LYS  -2 -16.141 -10.237   9.268
   38    H    ALA  -1           HN       ALA  -1 -13.605 -12.471   2.459
   39    HA   ALA  -1           HA       ALA  -1 -11.973 -11.486   0.517
   40   1HB   ALA  -1          HB1       ALA  -1 -12.524 -13.846   0.830
   41   2HB   ALA  -1          HB2       ALA  -1 -12.732 -13.361  -0.854
   42   3HB   ALA  -1          HB3       ALA  -1 -14.142 -13.560   0.187
   43    H    GLY   1           HN       GLY   1 -12.170 -10.502  -1.451
   44   1HA   GLY   1          HA1       GLY   1 -14.746  -9.248  -2.159
   45   2HA   GLY   1          HA2       GLY   1 -13.190  -8.451  -2.341
   46    H    SER   2           HN       SER   2 -13.249  -8.120  -4.482
   47    HA   SER   2           HA       SER   2 -12.626 -10.297  -6.261
   48   1HB   SER   2          HB1       SER   2 -14.872  -8.636  -7.280
   49   2HB   SER   2          HB2       SER   2 -14.486 -10.333  -7.596
   50    HG   SER   2           HG       SER   2 -15.104 -10.646  -5.294
   51    H    ALA   3           HN       ALA   3 -11.314  -9.599  -7.890
   52    HA   ALA   3           HA       ALA   3  -9.991  -7.221  -7.810
   53   1HB   ALA   3          HB1       ALA   3  -9.319  -9.276  -9.027
   54   2HB   ALA   3          HB2       ALA   3  -9.065  -7.788  -9.940
   55   3HB   ALA   3          HB3       ALA   3 -10.437  -8.828 -10.317
   56    H    LYS   4           HN       LYS   4 -13.020  -7.744  -9.661
   57    HA   LYS   4           HA       LYS   4 -12.851  -5.196 -10.933
   58   1HB   LYS   4          HB1       LYS   4 -13.897  -7.261 -11.921
   59   2HB   LYS   4          HB2       LYS   4 -15.299  -6.918 -10.907
   60   1HG   LYS   4          HG1       LYS   4 -14.549  -4.501 -12.215
   61   2HG   LYS   4          HG2       LYS   4 -14.615  -5.775 -13.426
   62   1HD   LYS   4          HD1       LYS   4 -16.881  -6.040 -13.214
   63   2HD   LYS   4          HD2       LYS   4 -16.882  -5.590 -11.505
   64   1HE   LYS   4          HE1       LYS   4 -16.372  -3.619 -13.743
   65   2HE   LYS   4          HE2       LYS   4 -17.972  -3.912 -13.059
   66   1HZ   LYS   4          HZ1       LYS   4 -16.313  -2.053 -12.158
   67   2HZ   LYS   4          HZ2       LYS   4 -15.858  -3.337 -11.158
   68   3HZ   LYS   4          HZ3       LYS   4 -17.467  -2.819 -11.181
   69    H    LYS   5           HN       LYS   5 -13.463  -5.662  -7.813
   70    HA   LYS   5           HA       LYS   5 -15.343  -3.390  -7.658
   71   1HB   LYS   5          HB1       LYS   5 -14.963  -5.622  -5.647
   72   2HB   LYS   5          HB2       LYS   5 -15.938  -4.185  -5.367
   73   1HG   LYS   5          HG1       LYS   5 -17.246  -4.879  -7.470
   74   2HG   LYS   5          HG2       LYS   5 -16.447  -6.443  -7.291
   75   1HD   LYS   5          HD1       LYS   5 -17.732  -5.319  -4.859
   76   2HD   LYS   5          HD2       LYS   5 -18.814  -5.864  -6.140
   77   1HE   LYS   5          HE1       LYS   5 -18.464  -7.694  -4.613
   78   2HE   LYS   5          HE2       LYS   5 -17.628  -8.064  -6.121
   79   1HZ   LYS   5          HZ1       LYS   5 -15.605  -7.882  -5.144
   80   2HZ   LYS   5          HZ2       LYS   5 -16.494  -8.331  -3.771
   81   3HZ   LYS   5          HZ3       LYS   5 -16.110  -6.703  -4.033
   82    H    GLY   6           HN       GLY   6 -12.607  -4.946  -5.954
   83   1HA   GLY   6          HA1       GLY   6 -11.913  -2.746  -4.342
   84   2HA   GLY   6          HA2       GLY   6 -10.824  -4.036  -4.823
   85    H    ALA   7           HN       ALA   7 -11.187  -3.401  -7.725
   86    HA   ALA   7           HA       ALA   7  -9.061  -1.656  -8.135
   87   1HB   ALA   7          HB1       ALA   7 -11.233  -2.382 -10.103
   88   2HB   ALA   7          HB2       ALA   7  -9.788  -3.338  -9.771
   89   3HB   ALA   7          HB3       ALA   7  -9.637  -1.737 -10.493
   90    H    THR   8           HN       THR   8 -12.598  -0.892  -8.541
   91    HA   THR   8           HA       THR   8 -12.326   1.736  -9.332
   92    HB   THR   8           HB       THR   8 -14.494   1.943  -7.667
   93    HG1  THR   8           HG1      THR   8 -14.233  -0.326  -7.183
   94   1HG2  THR   8          HG21      THR   8 -14.341   0.885 -10.491
   95   2HG2  THR   8          HG22      THR   8 -14.521   2.569  -9.996
   96   3HG2  THR   8          HG23      THR   8 -15.826   1.419  -9.701
   97    H    LEU   9           HN       LEU   9 -11.936   0.527  -6.047
   98    HA   LEU   9           HA       LEU   9 -11.899   3.010  -4.701
   99   1HB   LEU   9          HB1       LEU   9 -11.330   0.194  -4.055
  100   2HB   LEU   9          HB2       LEU   9 -10.348   1.343  -3.150
  101    HG   LEU   9           HG       LEU   9 -12.361   0.883  -1.887
  102   1HD1  LEU   9          HD11      LEU   9 -11.491   3.193  -1.859
  103   2HD1  LEU   9          HD12      LEU   9 -13.241   3.144  -1.645
  104   3HD1  LEU   9          HD13      LEU   9 -12.557   3.594  -3.206
  105   1HD2  LEU   9          HD21      LEU   9 -14.593   1.580  -2.803
  106   2HD2  LEU   9          HD22      LEU   9 -13.907   0.160  -3.591
  107   3HD2  LEU   9          HD23      LEU   9 -13.833   1.731  -4.390
  108    H    PHE  10           HN       PHE  10  -9.080   0.879  -4.858
  109    HA   PHE  10           HA       PHE  10  -7.035   2.599  -4.496
  110   1HB   PHE  10          HB1       PHE  10  -6.287   0.456  -4.636
  111   2HB   PHE  10          HB2       PHE  10  -7.355   0.053  -5.972
  112    HD1  PHE  10           HD1      PHE  10  -6.689   0.630  -8.328
  113    HD2  PHE  10           HD2      PHE  10  -4.033   1.107  -4.979
  114    HE1  PHE  10           HE1      PHE  10  -4.741   0.715  -9.880
  115    HE2  PHE  10           HE2      PHE  10  -2.108   1.320  -6.536
  116    HZ   PHE  10           HZ       PHE  10  -2.451   1.100  -8.985
  117    H    LYS  11           HN       LYS  11  -8.744   2.157  -7.561
  118    HA   LYS  11           HA       LYS  11  -6.991   3.536  -9.247
  119   1HB   LYS  11          HB1       LYS  11  -9.264   2.060  -9.586
  120   2HB   LYS  11          HB2       LYS  11  -9.809   3.675 -10.041
  121   1HG   LYS  11          HG1       LYS  11  -8.369   3.821 -11.829
  122   2HG   LYS  11          HG2       LYS  11  -7.201   2.710 -11.119
  123   1HD   LYS  11          HD1       LYS  11  -9.884   1.934 -12.287
  124   2HD   LYS  11          HD2       LYS  11  -8.324   1.739 -13.088
  125   1HE   LYS  11          HE1       LYS  11  -8.992   0.459 -10.432
  126   2HE   LYS  11          HE2       LYS  11  -9.266  -0.339 -11.977
  127   1HZ   LYS  11          HZ1       LYS  11  -7.186  -1.066 -11.089
  128   2HZ   LYS  11          HZ2       LYS  11  -6.656   0.522 -10.855
  129   3HZ   LYS  11          HZ3       LYS  11  -6.858  -0.072 -12.424
  130    H    THR  12           HN       THR  12  -9.079   4.903  -6.919
  131    HA   THR  12           HA       THR  12  -8.472   7.601  -7.821
  132    HB   THR  12           HB       THR  12 -10.648   7.049  -8.735
  133    HG1  THR  12           HG1      THR  12 -10.570   9.051  -6.751
  134   1HG2  THR  12          HG21      THR  12 -11.668   5.591  -7.127
  135   2HG2  THR  12          HG22      THR  12 -12.654   7.046  -7.278
  136   3HG2  THR  12          HG23      THR  12 -11.596   6.838  -5.882
  137    H    ARG  13           HN       ARG  13  -7.451   5.886  -5.745
  138    HA   ARG  13           HA       ARG  13  -7.582   7.680  -3.442
  139   1HB   ARG  13          HB1       ARG  13  -8.113   4.712  -3.324
  140   2HB   ARG  13          HB2       ARG  13  -7.679   5.661  -1.918
  141   1HG   ARG  13          HG1       ARG  13 -10.113   6.211  -3.596
  142   2HG   ARG  13          HG2       ARG  13 -10.117   5.137  -2.205
  143   1HD   ARG  13          HD1       ARG  13 -10.967   7.372  -1.642
  144   2HD   ARG  13          HD2       ARG  13  -9.485   7.002  -0.751
  145    HE   ARG  13           HE       ARG  13  -9.444   8.194  -3.266
  146   1HH1  ARG  13          HH11      ARG  13  -9.250   8.748   0.179
  147   2HH1  ARG  13          HH12      ARG  13  -8.102  10.038   0.196
  148   1HH2  ARG  13          HH21      ARG  13  -7.652  10.139  -3.194
  149   2HH2  ARG  13          HH22      ARG  13  -7.256  10.825  -1.658
  150    H    CYS  14           HN       CYS  14  -5.955   5.164  -5.214
  151    HA   CYS  14           HA       CYS  14  -3.449   5.696  -3.757
  152   1HB   CYS  14          HB1       CYS  14  -4.006   3.041  -5.005
  153   2HB   CYS  14          HB2       CYS  14  -2.891   3.443  -3.717
  154    H    LEU  15           HN       LEU  15  -4.935   4.858  -6.862
  155    HA   LEU  15           HA       LEU  15  -2.757   4.600  -8.495
  156   1HB   LEU  15          HB1       LEU  15  -5.221   4.316  -9.033
  157   2HB   LEU  15          HB2       LEU  15  -5.276   6.055  -9.289
  158    HG   LEU  15           HG       LEU  15  -3.497   5.818 -11.031
  159   1HD1  LEU  15          HD11      LEU  15  -3.996   2.859 -10.715
  160   2HD1  LEU  15          HD12      LEU  15  -2.517   3.701 -10.252
  161   3HD1  LEU  15          HD13      LEU  15  -2.994   3.623 -11.950
  162   1HD2  LEU  15          HD21      LEU  15  -5.687   5.979 -11.890
  163   2HD2  LEU  15          HD22      LEU  15  -6.097   4.344 -11.373
  164   3HD2  LEU  15          HD23      LEU  15  -4.973   4.592 -12.711
  165    H    GLN  16           HN       GLN  16  -4.178   7.649  -7.390
  166    HA   GLN  16           HA       GLN  16  -3.060   9.565  -8.904
  167   1HB   GLN  16          HB1       GLN  16  -2.914  10.875  -6.638
  168   2HB   GLN  16          HB2       GLN  16  -4.464  10.390  -7.307
  169   1HG   GLN  16          HG1       GLN  16  -4.325   8.337  -5.813
  170   2HG   GLN  16          HG2       GLN  16  -2.961   9.128  -5.018
  171   1HE2  GLN  16          HE21      GLN  16  -3.396  11.193  -3.933
  172   2HE2  GLN  16          HE22      GLN  16  -4.991  11.530  -3.372
  173    H    CYS  17           HN       CYS  17  -1.229   7.744  -6.469
  174    HA   CYS  17           HA       CYS  17   1.226   9.114  -7.336
  175   1HB   CYS  17          HB1       CYS  17   1.165   7.887  -4.639
  176   2HB   CYS  17          HB2       CYS  17   1.971   9.331  -5.228
  177    H    HIS  18           HN       HIS  18  -0.172   5.995  -6.457
  178    HA   HIS  18           HA       HIS  18   2.373   4.591  -6.688
  179   1HB   HIS  18          HB1       HIS  18  -0.343   3.910  -5.630
  180   2HB   HIS  18          HB2       HIS  18   0.815   2.638  -5.973
  181    HD1  HIS  18           HD1      HIS  18   3.285   3.109  -4.591
  182    HD2  HIS  18           HD2      HIS  18  -0.296   4.769  -3.193
  183    HE1  HIS  18           HE1      HIS  18   3.640   3.570  -2.122
  184    H    THR  19           HN       THR  19   2.082   2.320  -7.552
  185    HA   THR  19           HA       THR  19   0.568   2.121 -10.045
  186    HB   THR  19           HB       THR  19   2.867   0.853 -10.715
  187    HG1  THR  19           HG1      THR  19   4.304   2.886 -10.129
  188   1HG2  THR  19          HG21      THR  19   1.758   2.421 -12.176
  189   2HG2  THR  19          HG22      THR  19   3.452   2.883 -12.020
  190   3HG2  THR  19          HG23      THR  19   2.212   3.769 -11.135
  191    H    VAL  20           HN       VAL  20  -0.628   0.286 -10.015
  192    HA   VAL  20           HA       VAL  20  -0.323  -1.714  -7.995
  193    HB   VAL  20           HB       VAL  20  -2.399  -0.715  -9.315
  194   1HG1  VAL  20          HG11      VAL  20  -1.968  -1.820 -11.419
  195   2HG1  VAL  20          HG12      VAL  20  -3.474  -2.395 -10.705
  196   3HG1  VAL  20          HG13      VAL  20  -2.024  -3.396 -10.628
  197   1HG2  VAL  20          HG21      VAL  20  -2.474  -1.952  -7.187
  198   2HG2  VAL  20          HG22      VAL  20  -2.471  -3.465  -8.092
  199   3HG2  VAL  20          HG23      VAL  20  -3.814  -2.339  -8.266
  200    H    GLU  21           HN       GLU  21   0.664  -1.553 -11.287
  201    HA   GLU  21           HA       GLU  21   1.518  -4.371 -11.320
  202   1HB   GLU  21          HB1       GLU  21   1.647  -3.751 -13.913
  203   2HB   GLU  21          HB2       GLU  21   0.150  -4.300 -13.185
  204   1HG   GLU  21          HG1       GLU  21  -0.032  -2.327 -14.756
  205   2HG   GLU  21          HG2       GLU  21  -0.768  -2.115 -13.170
  206    H    LYS  22           HN       LYS  22   3.555  -4.395 -13.162
  207    HA   LYS  22           HA       LYS  22   5.401  -2.411 -12.078
  208   1HB   LYS  22          HB1       LYS  22   5.622  -5.201 -12.528
  209   2HB   LYS  22          HB2       LYS  22   6.852  -4.377 -13.498
  210   1HG   LYS  22          HG1       LYS  22   7.910  -3.483 -11.680
  211   2HG   LYS  22          HG2       LYS  22   6.419  -3.357 -10.746
  212   1HD   LYS  22          HD1       LYS  22   6.461  -5.704 -10.255
  213   2HD   LYS  22          HD2       LYS  22   7.828  -5.951 -11.342
  214   1HE   LYS  22          HE1       LYS  22   8.675  -5.950  -9.100
  215   2HE   LYS  22          HE2       LYS  22   9.197  -4.464  -9.873
  216   1HZ   LYS  22          HZ1       LYS  22   7.195  -3.419  -8.674
  217   2HZ   LYS  22          HZ2       LYS  22   8.545  -3.819  -7.743
  218   3HZ   LYS  22          HZ3       LYS  22   7.187  -4.821  -7.725
  219    H    GLY  23           HN       GLY  23   3.608  -1.948 -14.551
  220   1HA   GLY  23          HA1       GLY  23   5.636  -1.485 -16.612
  221   2HA   GLY  23          HA2       GLY  23   3.903  -1.264 -16.793
  222    H    GLY  24           HN       GLY  24   3.812   0.368 -14.275
  223   1HA   GLY  24          HA1       GLY  24   4.381   2.956 -15.435
  224   2HA   GLY  24          HA2       GLY  24   3.484   2.631 -13.961
  225    HA   PRO  25           HA       PRO  25   8.277   3.345 -13.211
  226   1HB   PRO  25          HB1       PRO  25   8.511   6.073 -13.529
  227   2HB   PRO  25          HB2       PRO  25   9.024   4.881 -14.728
  228   1HG   PRO  25          HG1       PRO  25   6.510   6.494 -14.611
  229   2HG   PRO  25          HG2       PRO  25   7.511   6.077 -16.014
  230   1HD   PRO  25          HD1       PRO  25   5.206   4.794 -15.482
  231   2HD   PRO  25          HD2       PRO  25   6.602   3.955 -16.190
  232    H    HIS  26           HN       HIS  26   8.998   4.321 -11.231
  233    HA   HIS  26           HA       HIS  26   7.091   4.532  -9.202
  234   1HB   HIS  26          HB1       HIS  26   9.960   5.485  -9.341
  235   2HB   HIS  26          HB2       HIS  26   9.020   5.420  -7.861
  236    HD2  HIS  26           HD2      HIS  26  11.315   3.362  -9.988
  237    HE1  HIS  26           HE1      HIS  26   9.676   0.636  -7.176
  238    HE2  HIS  26           HE2      HIS  26  11.486   0.986  -8.921
  239    H    LYS  27           HN       LYS  27   5.604   6.149  -9.047
  240    HA   LYS  27           HA       LYS  27   6.238   8.848  -9.951
  241   1HB   LYS  27          HB1       LYS  27   4.208   7.618 -10.758
  242   2HB   LYS  27          HB2       LYS  27   3.552   7.732  -9.129
  243   1HG   LYS  27          HG1       LYS  27   3.571  10.171  -9.261
  244   2HG   LYS  27          HG2       LYS  27   4.296  10.092 -10.871
  245   1HD   LYS  27          HD1       LYS  27   1.635  10.321 -10.474
  246   2HD   LYS  27          HD2       LYS  27   2.328   9.492 -11.874
  247   1HE   LYS  27          HE1       LYS  27   1.983   7.361 -10.928
  248   2HE   LYS  27          HE2       LYS  27   1.758   8.022  -9.309
  249   1HZ   LYS  27          HZ1       LYS  27  -0.354   7.373 -10.168
  250   2HZ   LYS  27          HZ2       LYS  27  -0.113   8.243 -11.597
  251   3HZ   LYS  27          HZ3       LYS  27  -0.310   9.069 -10.136
  252    H    VAL  28           HN       VAL  28   3.993   9.687  -7.915
  253    HA   VAL  28           HA       VAL  28   5.644  10.900  -6.012
  254    HB   VAL  28           HB       VAL  28   2.720  10.286  -5.600
  255   1HG1  VAL  28          HG11      VAL  28   2.713  12.369  -4.330
  256   2HG1  VAL  28          HG12      VAL  28   4.423  12.611  -4.685
  257   3HG1  VAL  28          HG13      VAL  28   3.915  11.256  -3.676
  258   1HG2  VAL  28          HG21      VAL  28   2.804  11.290  -7.780
  259   2HG2  VAL  28          HG22      VAL  28   3.946  12.516  -7.233
  260   3HG2  VAL  28          HG23      VAL  28   2.286  12.532  -6.640
  261    H    GLY  29           HN       GLY  29   4.223   7.752  -6.124
  262   1HA   GLY  29          HA1       GLY  29   5.334   7.024  -3.491
  263   2HA   GLY  29          HA2       GLY  29   3.786   6.415  -4.055
  264    HA   PRO  30           HA       PRO  30   7.508   3.707  -5.470
  265   1HB   PRO  30          HB1       PRO  30   7.345   1.718  -3.640
  266   2HB   PRO  30          HB2       PRO  30   8.343   3.159  -3.410
  267   1HG   PRO  30          HG1       PRO  30   5.607   2.563  -2.340
  268   2HG   PRO  30          HG2       PRO  30   7.010   3.249  -1.499
  269   1HD   PRO  30          HD1       PRO  30   4.994   4.787  -2.413
  270   2HD   PRO  30          HD2       PRO  30   6.677   5.351  -2.393
  271    H    ASN  31           HN       ASN  31   7.372   1.403  -6.202
  272    HA   ASN  31           HA       ASN  31   4.763   0.859  -7.293
  273   1HB   ASN  31          HB1       ASN  31   6.898   0.672  -8.580
  274   2HB   ASN  31          HB2       ASN  31   7.367  -0.682  -7.563
  275   1HD2  ASN  31          HD21      ASN  31   5.140   0.347 -10.090
  276   2HD2  ASN  31          HD22      ASN  31   4.711  -1.261 -10.573
  277    H    LEU  32           HN       LEU  32   3.291  -0.539  -6.478
  278    HA   LEU  32           HA       LEU  32   3.703  -1.888  -3.962
  279   1HB   LEU  32          HB1       LEU  32   1.220  -1.497  -5.638
  280   2HB   LEU  32          HB2       LEU  32   1.255  -2.132  -4.006
  281    HG   LEU  32           HG       LEU  32   2.110   0.673  -4.773
  282   1HD1  LEU  32          HD11      LEU  32   0.036   1.435  -3.837
  283   2HD1  LEU  32          HD12      LEU  32  -0.396  -0.198  -3.329
  284   3HD1  LEU  32          HD13      LEU  32  -0.339   0.203  -5.045
  285   1HD2  LEU  32          HD21      LEU  32   3.211  -0.151  -2.727
  286   2HD2  LEU  32          HD22      LEU  32   1.633  -0.549  -2.047
  287   3HD2  LEU  32          HD23      LEU  32   2.053   1.132  -2.376
  288    H    HIS  33           HN       HIS  33   3.545  -2.833  -7.276
  289    HA   HIS  33           HA       HIS  33   2.515  -5.419  -7.218
  290   1HB   HIS  33          HB1       HIS  33   2.948  -3.883  -9.202
  291   2HB   HIS  33          HB2       HIS  33   4.634  -4.383  -9.105
  292    HD2  HIS  33           HD2      HIS  33   1.567  -6.746  -8.719
  293    HE1  HIS  33           HE1      HIS  33   3.655  -7.910 -12.233
  294    HE2  HIS  33           HE2      HIS  33   1.774  -8.516 -10.634
  295    H    GLY  34           HN       GLY  34   3.344  -6.670  -5.574
  296   1HA   GLY  34          HA1       GLY  34   4.777  -8.591  -5.286
  297   2HA   GLY  34          HA2       GLY  34   6.115  -7.624  -5.870
  298    H    ILE  35           HN       ILE  35   4.034  -6.039  -3.527
  299    HA   ILE  35           HA       ILE  35   6.250  -5.963  -1.711
  300    HB   ILE  35           HB       ILE  35   4.852  -4.654  -0.194
  301   1HG1  ILE  35          HG11      ILE  35   2.669  -5.271  -2.137
  302   2HG1  ILE  35          HG12      ILE  35   2.593  -5.033  -0.393
  303   1HG2  ILE  35          HG21      ILE  35   6.320  -3.705  -1.895
  304   2HG2  ILE  35          HG22      ILE  35   4.939  -2.663  -1.554
  305   3HG2  ILE  35          HG23      ILE  35   4.967  -3.634  -3.025
  306   1HD1  ILE  35          HD11      ILE  35   2.807  -2.616  -0.694
  307   2HD1  ILE  35          HD12      ILE  35   1.432  -3.242  -1.605
  308   3HD1  ILE  35          HD13      ILE  35   2.929  -2.835  -2.441
  309    H    PHE  36           HN       PHE  36   3.301  -7.887  -1.787
  310    HA   PHE  36           HA       PHE  36   3.264  -8.736   0.871
  311   1HB   PHE  36          HB1       PHE  36   2.229 -10.054  -1.637
  312   2HB   PHE  36          HB2       PHE  36   1.952 -10.702  -0.021
  313    HD1  PHE  36           HD1      PHE  36   1.287  -8.567   1.675
  314    HD2  PHE  36           HD2      PHE  36   0.329  -9.022  -2.494
  315    HE1  PHE  36           HE1      PHE  36  -0.642  -7.022   1.958
  316    HE2  PHE  36           HE2      PHE  36  -1.601  -7.477  -2.215
  317    HZ   PHE  36           HZ       PHE  36  -2.081  -6.468   0.007
  318    H    GLY  37           HN       GLY  37   4.774  -9.662   1.941
  319   1HA   GLY  37          HA1       GLY  37   5.950 -11.649   2.561
  320   2HA   GLY  37          HA2       GLY  37   6.326 -11.918   0.869
  321    H    ARG  38           HN       ARG  38   6.810  -8.670   1.396
  322    HA   ARG  38           HA       ARG  38   9.679  -8.988   2.012
  323   1HB   ARG  38          HB1       ARG  38   8.201  -7.267   0.039
  324   2HB   ARG  38          HB2       ARG  38   9.723  -6.689   0.702
  325   1HG   ARG  38          HG1       ARG  38  10.962  -8.180  -0.474
  326   2HG   ARG  38          HG2       ARG  38   9.736  -9.445  -0.371
  327   1HD   ARG  38          HD1       ARG  38   9.628  -8.921  -2.622
  328   2HD   ARG  38          HD2       ARG  38   8.391  -7.845  -1.971
  329    HE   ARG  38           HE       ARG  38  10.674  -7.097  -1.717
  330   1HH1  ARG  38          HH21      ARG  38   8.316  -7.309  -4.222
  331   2HH1  ARG  38          HH22      ARG  38   8.632  -5.778  -4.858
  332   1HH2  ARG  38          HH11      ARG  38  11.435  -4.926  -3.396
  333   2HH2  ARG  38          HH12      ARG  38  10.632  -5.088  -4.898
  334    H    HIS  39           HN       HIS  39  10.628  -6.920   2.898
  335    HA   HIS  39           HA       HIS  39   9.012  -6.045   5.149
  336   1HB   HIS  39          HB1       HIS  39  11.896  -5.339   4.539
  337   2HB   HIS  39          HB2       HIS  39  11.076  -5.261   6.102
  338    HD2  HIS  39           HD2      HIS  39  10.812  -7.501   7.500
  339    HE1  HIS  39           HE1      HIS  39  12.773 -10.138   4.797
  340    HE2  HIS  39           HE2      HIS  39  11.710  -9.924   7.094
  341    H    SER  40           HN       SER  40   9.009  -3.688   5.745
  342    HA   SER  40           HA       SER  40   8.081  -2.070   3.664
  343   1HB   SER  40          HB1       SER  40   9.172  -0.766   6.123
  344   2HB   SER  40          HB2       SER  40   7.734  -0.370   5.194
  345    HG   SER  40           HG       SER  40   6.976  -2.521   6.040
  346    H    GLY  41           HN       GLY  41   8.958  -0.531   2.402
  347   1HA   GLY  41          HA1       GLY  41  10.554   0.943   1.579
  348   2HA   GLY  41          HA2       GLY  41  11.653   0.438   2.838
  349    H    GLN  42           HN       GLN  42  10.190  -1.625   0.227
  350    HA   GLN  42           HA       GLN  42  12.943  -2.140  -0.647
  351   1HB   GLN  42          HB1       GLN  42  10.649  -4.052  -0.436
  352   2HB   GLN  42          HB2       GLN  42  12.079  -4.415  -1.395
  353   1HG   GLN  42          HG1       GLN  42  13.436  -3.919   0.708
  354   2HG   GLN  42          HG2       GLN  42  11.906  -3.960   1.579
  355   1HE2  GLN  42          HE21      GLN  42  12.802  -5.797   2.775
  356   2HE2  GLN  42          HE22      GLN  42  12.827  -7.362   2.051
  357    H    ALA  43           HN       ALA  43  10.902  -0.178  -1.955
  358    HA   ALA  43           HA       ALA  43  10.191  -1.074  -4.480
  359   1HB   ALA  43          HB1       ALA  43   9.504   1.049  -3.371
  360   2HB   ALA  43          HB2       ALA  43   9.914   1.208  -5.078
  361   3HB   ALA  43          HB3       ALA  43  11.058   1.734  -3.844
  362    H    GLU  44           HN       GLU  44  11.199  -1.582  -6.302
  363    HA   GLU  44           HA       GLU  44  14.018  -1.590  -6.550
  364   1HB   GLU  44          HB1       GLU  44  12.125  -2.275  -8.802
  365   2HB   GLU  44          HB2       GLU  44  13.724  -2.933  -8.470
  366   1HG   GLU  44          HG1       GLU  44  12.470  -4.672  -7.694
  367   2HG   GLU  44          HG2       GLU  44  12.570  -3.726  -6.222
  368    H    GLY  45           HN       GLY  45  14.294   0.758  -6.269
  369   1HA   GLY  45          HA1       GLY  45  15.573   2.321  -7.689
  370   2HA   GLY  45          HA2       GLY  45  14.245   2.243  -8.825
  371    H    TYR  46           HN       TYR  46  13.440   2.466  -5.447
  372    HA   TYR  46           HA       TYR  46  13.069   5.354  -5.551
  373   1HB   TYR  46          HB1       TYR  46  11.001   4.425  -6.352
  374   2HB   TYR  46          HB2       TYR  46  10.881   3.377  -4.946
  375    HD1  TYR  46           HD1      TYR  46  10.306   6.725  -6.280
  376    HD2  TYR  46           HD2      TYR  46  10.454   4.357  -2.700
  377    HE1  TYR  46           HE1      TYR  46   8.923   8.434  -5.109
  378    HE2  TYR  46           HE2      TYR  46   8.976   5.997  -1.543
  379    HH   TYR  46           HH       TYR  46   7.350   8.537  -3.266
  380    H    SER  47           HN       SER  47  13.238   6.452  -3.657
  381    HA   SER  47           HA       SER  47  14.374   5.045  -1.382
  382   1HB   SER  47          HB1       SER  47  14.320   7.860  -0.946
  383   2HB   SER  47          HB2       SER  47  15.712   6.824  -1.268
  384    HG   SER  47           HG       SER  47  15.723   7.454  -3.286
  385    H    TYR  48           HN       TYR  48  13.673   5.138   0.661
  386    HA   TYR  48           HA       TYR  48  10.975   6.062   1.327
  387   1HB   TYR  48          HB1       TYR  48  12.656   3.721   2.215
  388   2HB   TYR  48          HB2       TYR  48  11.192   4.203   3.069
  389    HD1  TYR  48           HD1      TYR  48   9.005   3.917   2.096
  390    HD2  TYR  48           HD2      TYR  48  12.536   2.766  -0.070
  391    HE1  TYR  48           HE1      TYR  48   7.613   2.510   0.591
  392    HE2  TYR  48           HE2      TYR  48  11.155   1.356  -1.581
  393    HH   TYR  48           HH       TYR  48   8.202   0.248  -0.775
  394    H    THR  49           HN       THR  49  10.648   6.718   3.693
  395    HA   THR  49           HA       THR  49  12.547   8.681   4.544
  396    HB   THR  49           HB       THR  49  10.962   8.674   6.640
  397    HG1  THR  49           HG1      THR  49   9.102   7.738   4.779
  398   1HG2  THR  49          HG21      THR  49   9.437  10.194   5.479
  399   2HG2  THR  49          HG22      THR  49  10.089   9.651   3.933
  400   3HG2  THR  49          HG23      THR  49  11.126  10.505   5.076
  401    H    ASP  50           HN       ASP  50  13.194   8.899   6.872
  402    HA   ASP  50           HA       ASP  50  14.920   6.894   7.709
  403   1HB   ASP  50          HB1       ASP  50  15.356   9.111   8.371
  404   2HB   ASP  50          HB2       ASP  50  13.739   9.325   9.038
  405    H    ALA  51           HN       ALA  51  11.560   7.433   8.591
  406    HA   ALA  51           HA       ALA  51  11.551   5.560  10.774
  407   1HB   ALA  51          HB1       ALA  51  10.281   7.618  10.923
  408   2HB   ALA  51          HB2       ALA  51   9.196   6.230  10.993
  409   3HB   ALA  51          HB3       ALA  51   9.334   7.165   9.504
  410    H    ASN  52           HN       ASN  52  10.450   5.454   7.362
  411    HA   ASN  52           HA       ASN  52   8.886   3.091   7.703
  412   1HB   ASN  52          HB1       ASN  52   8.192   4.385   5.912
  413   2HB   ASN  52          HB2       ASN  52   9.833   4.710   5.369
  414   1HD2  ASN  52          HD21      ASN  52   7.083   2.683   4.937
  415   2HD2  ASN  52          HD22      ASN  52   7.803   1.752   3.674
  416    H    ILE  53           HN       ILE  53  12.233   3.651   6.699
  417    HA   ILE  53           HA       ILE  53  12.844   0.982   6.010
  418    HB   ILE  53           HB       ILE  53  14.595   3.286   6.813
  419   1HG1  ILE  53          HG11      ILE  53  14.150   2.076   4.066
  420   2HG1  ILE  53          HG12      ILE  53  13.216   3.439   4.677
  421   1HG2  ILE  53          HG21      ILE  53  15.835   1.231   7.249
  422   2HG2  ILE  53          HG22      ILE  53  16.485   2.028   5.816
  423   3HG2  ILE  53          HG23      ILE  53  15.436   0.623   5.641
  424   1HD1  ILE  53          HD11      ILE  53  15.380   4.689   4.949
  425   2HD1  ILE  53          HD12      ILE  53  14.948   4.312   3.282
  426   3HD1  ILE  53          HD13      ILE  53  16.179   3.359   4.110
  427    H    LYS  54           HN       LYS  54  14.176   2.670   8.909
  428    HA   LYS  54           HA       LYS  54  14.818   0.669  10.550
  429   1HB   LYS  54          HB1       LYS  54  13.407   3.247  11.146
  430   2HB   LYS  54          HB2       LYS  54  13.906   2.155  12.440
  431   1HG   LYS  54          HG1       LYS  54  16.203   2.213  11.084
  432   2HG   LYS  54          HG2       LYS  54  15.572   3.788  10.595
  433   1HD   LYS  54          HD1       LYS  54  15.114   3.640  13.358
  434   2HD   LYS  54          HD2       LYS  54  16.746   2.996  13.115
  435   1HE   LYS  54          HE1       LYS  54  16.919   5.388  13.402
  436   2HE   LYS  54          HE2       LYS  54  17.261   5.002  11.713
  437   1HZ   LYS  54          HZ1       LYS  54  14.780   5.465  11.380
  438   2HZ   LYS  54          HZ2       LYS  54  15.831   6.780  11.579
  439   3HZ   LYS  54          HZ3       LYS  54  14.873   6.260  12.874
  440    H    LYS  55           HN       LYS  55  11.623   1.068   9.414
  441    HA   LYS  55           HA       LYS  55  10.280  -0.271  11.602
  442   1HB   LYS  55          HB1       LYS  55   9.286   1.614  10.383
  443   2HB   LYS  55          HB2       LYS  55   9.257   0.657   8.921
  444   1HG   LYS  55          HG1       LYS  55   7.070   0.645   9.670
  445   2HG   LYS  55          HG2       LYS  55   7.699  -0.917  10.163
  446   1HD   LYS  55          HD1       LYS  55   7.626   1.408  12.069
  447   2HD   LYS  55          HD2       LYS  55   6.205   0.401  11.800
  448   1HE   LYS  55          HE1       LYS  55   8.905  -0.580  12.751
  449   2HE   LYS  55          HE2       LYS  55   7.488  -0.328  13.772
  450   1HZ   LYS  55          HZ1       LYS  55   7.652  -2.641  13.207
  451   2HZ   LYS  55          HZ2       LYS  55   7.751  -2.291  11.559
  452   3HZ   LYS  55          HZ3       LYS  55   6.313  -1.990  12.395
  453    H    ASN  56           HN       ASN  56  11.349  -1.162   8.392
  454    HA   ASN  56           HA       ASN  56  11.029  -2.958   7.042
  455   1HB   ASN  56          HB1       ASN  56  12.866  -3.431   9.249
  456   2HB   ASN  56          HB2       ASN  56  12.313  -4.919   8.514
  457   1HD2  ASN  56          HD21      ASN  56  13.952  -1.806   7.718
  458   2HD2  ASN  56          HD22      ASN  56  14.486  -2.521   6.259
  459    H    VAL  57           HN       VAL  57   8.534  -2.770   8.151
  460    HA   VAL  57           HA       VAL  57   7.705  -5.131   9.503
  461    HB   VAL  57           HB       VAL  57   6.553  -2.681   8.963
  462   1HG1  VAL  57          HG11      VAL  57   4.816  -4.784   7.672
  463   2HG1  VAL  57          HG12      VAL  57   5.509  -3.373   6.872
  464   3HG1  VAL  57          HG13      VAL  57   4.296  -3.163   8.136
  465   1HG2  VAL  57          HG21      VAL  57   6.360  -3.874  10.997
  466   2HG2  VAL  57          HG22      VAL  57   5.503  -5.201  10.213
  467   3HG2  VAL  57          HG23      VAL  57   4.726  -3.627  10.379
  468    H    LEU  58           HN       LEU  58   6.929  -7.055   8.726
  469    HA   LEU  58           HA       LEU  58   7.432  -7.607   5.938
  470   1HB   LEU  58          HB1       LEU  58   8.073  -9.175   7.801
  471   2HB   LEU  58          HB2       LEU  58   6.361  -9.504   8.034
  472    HG   LEU  58           HG       LEU  58   6.323 -10.164   5.534
  473   1HD1  LEU  58          HD11      LEU  58   8.472  -9.198   4.916
  474   2HD1  LEU  58          HD12      LEU  58   8.495 -10.943   4.657
  475   3HD1  LEU  58          HD13      LEU  58   9.299 -10.251   6.066
  476   1HD2  LEU  58          HD21      LEU  58   7.944 -11.887   7.422
  477   2HD2  LEU  58          HD22      LEU  58   7.140 -12.433   5.951
  478   3HD2  LEU  58          HD23      LEU  58   6.183 -11.860   7.316
  479    H    TRP  59           HN       TRP  59   5.983  -6.710   4.632
  480    HA   TRP  59           HA       TRP  59   3.318  -6.127   5.169
  481   1HB   TRP  59          HB1       TRP  59   4.773  -6.545   2.564
  482   2HB   TRP  59          HB2       TRP  59   3.124  -5.957   2.658
  483    HD1  TRP  59           HD1      TRP  59   6.315  -4.655   1.994
  484    HE1  TRP  59           HE1      TRP  59   6.547  -2.177   2.669
  485    HE3  TRP  59           HE3      TRP  59   2.196  -4.170   4.986
  486    HZ2  TRP  59           HZ2      TRP  59   5.262  -0.284   4.385
  487    HZ3  TRP  59           HZ3      TRP  59   1.713  -2.021   6.094
  488    HH2  TRP  59           HH2      TRP  59   3.213  -0.081   5.809
  489    H    ASP  60           HN       ASP  60   1.929  -7.579   5.764
  490    HA   ASP  60           HA       ASP  60   1.450 -10.066   4.295
  491   1HB   ASP  60          HB1       ASP  60   1.901 -11.064   6.248
  492   2HB   ASP  60          HB2       ASP  60   1.989  -9.523   7.077
  493    H    GLU  61           HN       GLU  61  -0.980 -10.760   5.213
  494    HA   GLU  61           HA       GLU  61  -2.728  -9.046   3.741
  495   1HB   GLU  61          HB1       GLU  61  -2.804 -11.674   4.140
  496   2HB   GLU  61          HB2       GLU  61  -3.818 -11.210   5.502
  497   1HG   GLU  61          HG1       GLU  61  -5.541 -11.179   4.082
  498   2HG   GLU  61          HG2       GLU  61  -4.826  -9.733   3.365
  499    H    ASN  62           HN       ASN  62  -2.711 -10.011   7.195
  500    HA   ASN  62           HA       ASN  62  -4.636  -8.052   7.952
  501   1HB   ASN  62          HB1       ASN  62  -3.781 -10.392   8.988
  502   2HB   ASN  62          HB2       ASN  62  -2.891  -9.273  10.012
  503   1HD2  ASN  62          HD21      ASN  62  -5.101 -11.098  10.651
  504   2HD2  ASN  62          HD22      ASN  62  -6.331 -10.098  11.338
  505    H    ASN  63           HN       ASN  63  -1.051  -8.130   8.173
  506    HA   ASN  63           HA       ASN  63  -0.694  -5.782   9.628
  507   1HB   ASN  63          HB1       ASN  63   1.200  -7.032   9.524
  508   2HB   ASN  63          HB2       ASN  63   0.955  -7.481   7.848
  509   1HD2  ASN  63          HD21      ASN  63   1.908  -4.652   9.851
  510   2HD2  ASN  63          HD22      ASN  63   2.767  -4.007   8.496
  511    H    MET  64           HN       MET  64  -1.013  -6.014   6.025
  512    HA   MET  64           HA       MET  64  -0.406  -3.371   5.428
  513   1HB   MET  64          HB1       MET  64  -0.710  -5.060   3.724
  514   2HB   MET  64          HB2       MET  64  -2.421  -5.188   4.107
  515   1HG   MET  64          HG1       MET  64  -2.786  -2.912   3.348
  516   2HG   MET  64          HG2       MET  64  -1.073  -2.719   3.030
  517   1HE   MET  64          HE1       MET  64  -3.862  -5.506   0.617
  518   2HE   MET  64          HE2       MET  64  -4.267  -4.754   2.162
  519   3HE   MET  64          HE3       MET  64  -3.070  -6.049   2.098
  520    H    SER  65           HN       SER  65  -3.547  -4.620   6.584
  521    HA   SER  65           HA       SER  65  -4.939  -2.163   6.463
  522   1HB   SER  65          HB1       SER  65  -5.614  -4.294   8.461
  523   2HB   SER  65          HB2       SER  65  -6.691  -3.222   7.576
  524    HG   SER  65           HG       SER  65  -5.515  -5.615   6.806
  525    H    GLU  66           HN       GLU  66  -2.971  -3.587   9.038
  526    HA   GLU  66           HA       GLU  66  -3.559  -1.957  11.180
  527   1HB   GLU  66          HB1       GLU  66  -2.121  -3.652  11.753
  528   2HB   GLU  66          HB2       GLU  66  -1.192  -3.508  10.264
  529   1HG   GLU  66          HG1       GLU  66  -0.404  -1.240  11.297
  530   2HG   GLU  66          HG2       GLU  66  -0.922  -1.974  12.815
  531    H    TYR  67           HN       TYR  67  -1.003  -1.406   8.776
  532    HA   TYR  67           HA       TYR  67  -0.300   1.221   9.514
  533   1HB   TYR  67          HB1       TYR  67   1.348   0.064   8.404
  534   2HB   TYR  67          HB2       TYR  67   0.235  -0.616   7.231
  535    HD1  TYR  67           HD1      TYR  67  -0.190   0.478   5.131
  536    HD2  TYR  67           HD2      TYR  67   2.158   2.394   8.175
  537    HE1  TYR  67           HE1      TYR  67   0.685   2.082   3.438
  538    HE2  TYR  67           HE2      TYR  67   3.085   3.971   6.492
  539    HH   TYR  67           HH       TYR  67   1.896   4.077   3.189
  540    H    LEU  68           HN       LEU  68  -2.595   0.046   6.992
  541    HA   LEU  68           HA       LEU  68  -2.977   2.502   5.724
  542   1HB   LEU  68          HB1       LEU  68  -4.826   0.162   6.086
  543   2HB   LEU  68          HB2       LEU  68  -5.248   1.559   5.113
  544    HG   LEU  68           HG       LEU  68  -2.918  -0.312   4.614
  545   1HD1  LEU  68          HD11      LEU  68  -5.607   0.132   3.303
  546   2HD1  LEU  68          HD12      LEU  68  -5.039  -1.328   4.112
  547   3HD1  LEU  68          HD13      LEU  68  -4.314  -0.828   2.584
  548   1HD2  LEU  68          HD21      LEU  68  -2.464   2.055   3.870
  549   2HD2  LEU  68          HD22      LEU  68  -3.911   1.959   2.867
  550   3HD2  LEU  68          HD23      LEU  68  -2.546   0.890   2.547
  551    H    THR  69           HN       THR  69  -4.623   1.329   8.678
  552    HA   THR  69           HA       THR  69  -6.637   3.221   8.867
  553    HB   THR  69           HB       THR  69  -5.332   2.565  11.423
  554    HG1  THR  69           HG1      THR  69  -4.917   0.634  10.521
  555   1HG2  THR  69          HG21      THR  69  -7.565   3.420  11.534
  556   2HG2  THR  69          HG22      THR  69  -7.663   1.694  11.882
  557   3HG2  THR  69          HG23      THR  69  -8.120   2.299  10.290
  558    H    ASN  70           HN       ASN  70  -3.219   3.625   9.723
  559    HA   ASN  70           HA       ASN  70  -3.405   6.445   9.441
  560   1HB   ASN  70          HB1       ASN  70  -4.326   6.034  11.784
  561   2HB   ASN  70          HB2       ASN  70  -2.692   5.566  12.240
  562   1HD2  ASN  70          HD21      ASN  70  -4.077   7.744  13.390
  563   2HD2  ASN  70          HD22      ASN  70  -3.042   9.077  13.017
  564    HA   PRO  71           HA       PRO  71   0.720   4.742   8.256
  565   1HB   PRO  71          HB1       PRO  71   1.174   6.853   6.521
  566   2HB   PRO  71          HB2       PRO  71   0.434   5.314   6.072
  567   1HG   PRO  71          HG1       PRO  71  -0.865   7.925   6.725
  568   2HG   PRO  71          HG2       PRO  71  -1.291   6.740   5.476
  569   1HD   PRO  71          HD1       PRO  71  -2.685   6.930   7.757
  570   2HD   PRO  71          HD2       PRO  71  -2.384   5.358   6.985
  571    H    LYS  72           HN       LYS  72  -0.231   8.006   9.174
  572    HA   LYS  72           HA       LYS  72   2.364   9.011   9.764
  573   1HB   LYS  72          HB1       LYS  72  -0.380   9.972  10.574
  574   2HB   LYS  72          HB2       LYS  72   1.102  10.828  10.966
  575   1HG   LYS  72          HG1       LYS  72   0.735  11.956   9.076
  576   2HG   LYS  72          HG2       LYS  72   1.340  10.518   8.261
  577   1HD   LYS  72          HD1       LYS  72  -0.717  11.213   7.212
  578   2HD   LYS  72          HD2       LYS  72  -1.003   9.700   8.073
  579   1HE   LYS  72          HE1       LYS  72  -2.073  10.864   9.884
  580   2HE   LYS  72          HE2       LYS  72  -1.630  12.424   9.209
  581   1HZ   LYS  72          HZ1       LYS  72  -3.087  11.876   7.293
  582   2HZ   LYS  72          HZ2       LYS  72  -3.909  12.025   8.761
  583   3HZ   LYS  72          HZ3       LYS  72  -3.598  10.491   8.131
  584    H    LYS  73           HN       LYS  73  -0.080   7.356  11.696
  585    HA   LYS  73           HA       LYS  73   1.263   7.865  14.178
  586   1HB   LYS  73          HB1       LYS  73  -1.156   7.546  14.125
  587   2HB   LYS  73          HB2       LYS  73  -0.943   5.900  13.550
  588   1HG   LYS  73          HG1       LYS  73  -1.450   5.841  15.899
  589   2HG   LYS  73          HG2       LYS  73   0.220   5.340  15.669
  590   1HD   LYS  73          HD1       LYS  73   0.463   8.055  16.094
  591   2HD   LYS  73          HD2       LYS  73  -0.876   7.621  17.153
  592   1HE   LYS  73          HE1       LYS  73   0.970   7.339  18.534
  593   2HE   LYS  73          HE2       LYS  73   0.683   5.703  17.947
  594   1HZ   LYS  73          HZ1       LYS  73   2.397   6.171  16.217
  595   2HZ   LYS  73          HZ2       LYS  73   2.988   6.118  17.800
  596   3HZ   LYS  73          HZ3       LYS  73   2.758   7.609  17.039
  597    H    TYR  74           HN       TYR  74   1.159   5.076  11.981
  598    HA   TYR  74           HA       TYR  74   2.844   3.427  13.596
  599   1HB   TYR  74          HB1       TYR  74   1.139   2.687  11.867
  600   2HB   TYR  74          HB2       TYR  74   2.335   3.119  10.645
  601    HD1  TYR  74           HD1      TYR  74   3.236   1.120   9.737
  602    HD2  TYR  74           HD2      TYR  74   2.651   1.529  13.976
  603    HE1  TYR  74           HE1      TYR  74   4.292  -1.114  10.097
  604    HE2  TYR  74           HE2      TYR  74   3.691  -0.691  14.351
  605    HH   TYR  74           HH       TYR  74   3.902  -2.895  12.780
  606    H    ILE  75           HN       ILE  75   3.430   5.358  10.702
  607    HA   ILE  75           HA       ILE  75   6.336   5.192  11.120
  608    HB   ILE  75           HB       ILE  75   4.906   5.453   8.462
  609   1HG1  ILE  75          HG11      ILE  75   6.412   3.102   9.669
  610   2HG1  ILE  75          HG12      ILE  75   4.687   3.160   9.338
  611   1HG2  ILE  75          HG21      ILE  75   7.188   5.200   7.525
  612   2HG2  ILE  75          HG22      ILE  75   7.845   5.195   9.160
  613   3HG2  ILE  75          HG23      ILE  75   7.045   6.637   8.537
  614   1HD1  ILE  75          HD11      ILE  75   5.175   3.280   6.920
  615   2HD1  ILE  75          HD12      ILE  75   5.837   1.825   7.664
  616   3HD1  ILE  75          HD13      ILE  75   6.899   3.179   7.277
  617    HA   PRO  76           HA       PRO  76   5.072   9.550  11.867
  618   1HB   PRO  76          HB1       PRO  76   7.123  10.057  13.587
  619   2HB   PRO  76          HB2       PRO  76   5.592   9.329  14.085
  620   1HG   PRO  76          HG1       PRO  76   8.215   8.016  13.505
  621   2HG   PRO  76          HG2       PRO  76   7.059   7.684  14.808
  622   1HD   PRO  76          HD1       PRO  76   7.234   6.148  12.584
  623   2HD   PRO  76          HD2       PRO  76   5.707   6.404  13.451
  624    H    GLY  77           HN       GLY  77   5.589  10.724  10.102
  625   1HA   GLY  77          HA1       GLY  77   7.073  12.375   9.199
  626   2HA   GLY  77          HA2       GLY  77   8.423  11.324   9.581
  627    H    THR  78           HN       THR  78   5.999   9.438   8.232
  628    HA   THR  78           HA       THR  78   7.402   8.850   5.856
  629    HB   THR  78           HB       THR  78   5.614   7.531   7.319
  630    HG1  THR  78           HG1      THR  78   6.875   7.109   5.054
  631   1HG2  THR  78          HG21      THR  78   3.992   8.358   4.912
  632   2HG2  THR  78          HG22      THR  78   3.609   8.701   6.599
  633   3HG2  THR  78          HG23      THR  78   3.598   7.037   6.014
  634    H    LYS  79           HN       LYS  79   6.834   9.097   3.686
  635    HA   LYS  79           HA       LYS  79   5.774  11.669   2.981
  636   1HB   LYS  79          HB1       LYS  79   6.490   9.393   1.136
  637   2HB   LYS  79          HB2       LYS  79   6.389  11.098   0.729
  638   1HG   LYS  79          HG1       LYS  79   8.332  11.516   2.239
  639   2HG   LYS  79          HG2       LYS  79   8.470   9.764   2.461
  640   1HD   LYS  79          HD1       LYS  79   8.252  10.169  -0.321
  641   2HD   LYS  79          HD2       LYS  79   9.394  11.390   0.255
  642   1HE   LYS  79          HE1       LYS  79  10.860   9.655  -0.020
  643   2HE   LYS  79          HE2       LYS  79  10.331   9.302   1.625
  644   1HZ   LYS  79          HZ1       LYS  79  10.312   7.475  -0.233
  645   2HZ   LYS  79          HZ2       LYS  79   8.810   8.155  -0.597
  646   3HZ   LYS  79          HZ3       LYS  79   9.096   7.534   0.947
  647    H    MET  80           HN       MET  80   4.143   8.684   3.490
  648    HA   MET  80           HA       MET  80   2.161   9.115   1.447
  649   1HB   MET  80          HB1       MET  80   2.522   6.856   1.693
  650   2HB   MET  80          HB2       MET  80   2.659   6.957   3.451
  651   1HG   MET  80          HG1       MET  80   0.400   7.007   3.778
  652   2HG   MET  80          HG2       MET  80   0.073   7.710   2.205
  653   1HE   MET  80          HE1       MET  80  -2.102   5.967   2.581
  654   2HE   MET  80          HE2       MET  80  -1.321   5.264   3.997
  655   3HE   MET  80          HE3       MET  80  -1.885   4.220   2.693
  656    H    ALA  81           HN       ALA  81   1.407  11.121   1.953
  657    HA   ALA  81           HA       ALA  81   0.026  11.654   4.417
  658   1HB   ALA  81          HB1       ALA  81   0.368  13.463   2.046
  659   2HB   ALA  81          HB2       ALA  81   1.549  13.274   3.341
  660   3HB   ALA  81          HB3       ALA  81  -0.053  13.917   3.699
  661    H    PHE  82           HN       PHE  82  -1.026   9.854   2.251
  662    HA   PHE  82           HA       PHE  82  -3.313  10.549   1.000
  663   1HB   PHE  82          HB1       PHE  82  -2.503   8.509   0.396
  664   2HB   PHE  82          HB2       PHE  82  -2.194   8.008   2.054
  665    HD1  PHE  82           HD1      PHE  82  -4.853   8.446  -0.515
  666    HD2  PHE  82           HD2      PHE  82  -3.784   6.748   3.292
  667    HE1  PHE  82           HE1      PHE  82  -7.017   7.217  -0.453
  668    HE2  PHE  82           HE2      PHE  82  -5.950   5.532   3.360
  669    HZ   PHE  82           HZ       PHE  82  -7.575   5.783   1.497
  670    H    GLY  83           HN       GLY  83  -3.125   9.894   4.490
  671   1HA   GLY  83          HA1       GLY  83  -4.988  11.154   5.668
  672   2HA   GLY  83          HA2       GLY  83  -6.061  10.257   4.616
  673    H    GLY  84           HN       GLY  84  -5.943   7.805   4.894
  674   1HA   GLY  84          HA1       GLY  84  -5.054   6.015   6.437
  675   2HA   GLY  84          HA2       GLY  84  -5.607   7.065   7.729
  676    H    LEU  85           HN       LEU  85  -6.472   4.637   5.490
  677    HA   LEU  85           HA       LEU  85  -9.328   4.890   5.628
  678   1HB   LEU  85          HB1       LEU  85  -7.439   2.888   4.435
  679   2HB   LEU  85          HB2       LEU  85  -9.144   2.517   4.574
  680    HG   LEU  85           HG       LEU  85  -7.963   4.824   3.004
  681   1HD1  LEU  85          HD11      LEU  85  -9.340   2.290   2.088
  682   2HD1  LEU  85          HD12      LEU  85  -7.598   2.563   2.045
  683   3HD1  LEU  85          HD13      LEU  85  -8.670   3.556   1.057
  684   1HD2  LEU  85          HD21      LEU  85 -10.204   5.417   3.817
  685   2HD2  LEU  85          HD22      LEU  85 -10.837   3.886   3.215
  686   3HD2  LEU  85          HD23      LEU  85 -10.235   5.096   2.083
  687    H    LYS  86           HN       LYS  86 -10.302   4.549   7.396
  688    HA   LYS  86           HA       LYS  86  -9.608   2.476   9.331
  689   1HB   LYS  86          HB1       LYS  86 -11.425   4.865   9.682
  690   2HB   LYS  86          HB2       LYS  86 -10.848   3.787  10.947
  691   1HG   LYS  86          HG1       LYS  86  -8.707   4.677  10.925
  692   2HG   LYS  86          HG2       LYS  86  -8.859   5.275   9.271
  693   1HD   LYS  86          HD1       LYS  86 -10.431   7.005  10.038
  694   2HD   LYS  86          HD2       LYS  86 -10.296   6.402  11.689
  695   1HE   LYS  86          HE1       LYS  86  -8.905   8.458  11.102
  696   2HE   LYS  86          HE2       LYS  86  -8.058   7.128  11.887
  697   1HZ   LYS  86          HZ1       LYS  86  -8.105   7.283   8.952
  698   2HZ   LYS  86          HZ2       LYS  86  -6.946   6.591   9.969
  699   3HZ   LYS  86          HZ3       LYS  86  -7.039   8.272   9.823
  700    H    LYS  87           HN       LYS  87 -11.629   2.641   6.786
  701    HA   LYS  87           HA       LYS  87 -13.983   1.392   8.006
  702   1HB   LYS  87          HB1       LYS  87 -13.575   2.004   5.102
  703   2HB   LYS  87          HB2       LYS  87 -15.078   1.764   5.951
  704   1HG   LYS  87          HG1       LYS  87 -14.957   4.004   6.903
  705   2HG   LYS  87          HG2       LYS  87 -13.332   4.239   6.188
  706   1HD   LYS  87          HD1       LYS  87 -14.603   5.030   4.479
  707   2HD   LYS  87          HD2       LYS  87 -14.410   3.370   4.030
  708   1HE   LYS  87          HE1       LYS  87 -16.820   3.064   4.797
  709   2HE   LYS  87          HE2       LYS  87 -16.888   4.841   4.833
  710   1HZ   LYS  87          HZ1       LYS  87 -15.991   4.856   2.558
  711   2HZ   LYS  87          HZ2       LYS  87 -17.490   4.087   2.633
  712   3HZ   LYS  87          HZ3       LYS  87 -16.075   3.161   2.509
  713    H    GLU  88           HN       GLU  88 -13.592  -0.755   8.318
  714    HA   GLU  88           HA       GLU  88 -11.960  -2.480   6.916
  715   1HB   GLU  88          HB1       GLU  88 -13.175  -2.729   9.172
  716   2HB   GLU  88          HB2       GLU  88 -14.494  -3.406   8.221
  717   1HG   GLU  88          HG1       GLU  88 -13.350  -5.334   8.745
  718   2HG   GLU  88          HG2       GLU  88 -12.551  -4.911   7.224
  719    H    LYS  89           HN       LYS  89 -15.465  -2.009   6.313
  720    HA   LYS  89           HA       LYS  89 -15.897  -4.018   4.484
  721   1HB   LYS  89          HB1       LYS  89 -17.168  -1.308   4.190
  722   2HB   LYS  89          HB2       LYS  89 -17.872  -2.896   3.904
  723   1HG   LYS  89          HG1       LYS  89 -16.919  -2.180   6.644
  724   2HG   LYS  89          HG2       LYS  89 -18.468  -1.575   6.078
  725   1HD   LYS  89          HD1       LYS  89 -19.422  -3.700   6.029
  726   2HD   LYS  89          HD2       LYS  89 -17.851  -4.508   5.902
  727   1HE   LYS  89          HE1       LYS  89 -17.321  -3.728   8.213
  728   2HE   LYS  89          HE2       LYS  89 -18.955  -3.076   8.333
  729   1HZ   LYS  89          HZ1       LYS  89 -18.418  -5.423   9.254
  730   2HZ   LYS  89          HZ2       LYS  89 -18.579  -5.905   7.642
  731   3HZ   LYS  89          HZ3       LYS  89 -19.874  -5.156   8.425
  732    H    ASP  90           HN       ASP  90 -14.715  -0.809   3.892
  733    HA   ASP  90           HA       ASP  90 -14.356  -0.864   1.135
  734   1HB   ASP  90          HB1       ASP  90 -13.340   0.766   3.440
  735   2HB   ASP  90          HB2       ASP  90 -12.767   1.078   1.815
  736    H    ARG  91           HN       ARG  91 -12.004  -1.591   3.796
  737    HA   ARG  91           HA       ARG  91  -9.833  -2.111   2.035
  738   1HB   ARG  91          HB1       ARG  91 -10.122  -3.229   4.834
  739   2HB   ARG  91          HB2       ARG  91  -8.641  -3.128   3.890
  740   1HG   ARG  91          HG1       ARG  91  -8.977  -0.619   3.873
  741   2HG   ARG  91          HG2       ARG  91 -10.239  -0.866   5.068
  742   1HD   ARG  91          HD1       ARG  91  -7.447  -1.884   5.518
  743   2HD   ARG  91          HD2       ARG  91  -7.861  -0.210   5.848
  744    HE   ARG  91           HE       ARG  91  -9.232  -2.179   6.466
  745   1HH1  ARG  91          HH21      ARG  91  -6.945   0.096   7.757
  746   2HH1  ARG  91          HH22      ARG  91  -7.318   0.097   9.445
  747   1HH2  ARG  91          HH11      ARG  91  -9.812  -2.255   9.217
  748   2HH2  ARG  91          HH12      ARG  91  -8.964  -1.164  10.255
  749    H    ASN  92           HN       ASN  92 -12.355  -4.237   3.309
  750    HA   ASN  92           HA       ASN  92 -11.441  -6.727   2.847
  751   1HB   ASN  92          HB1       ASN  92 -14.167  -5.573   2.285
  752   2HB   ASN  92          HB2       ASN  92 -13.832  -7.290   2.129
  753   1HD2  ASN  92          HD21      ASN  92 -15.742  -6.263   3.855
  754   2HD2  ASN  92          HD22      ASN  92 -15.190  -6.823   5.396
  755    H    ASP  93           HN       ASP  93 -13.102  -4.928   0.207
  756    HA   ASP  93           HA       ASP  93 -12.229  -6.679  -1.844
  757   1HB   ASP  93          HB1       ASP  93 -13.905  -4.350  -1.637
  758   2HB   ASP  93          HB2       ASP  93 -12.825  -4.180  -3.012
  759    H    LEU  94           HN       LEU  94 -10.837  -3.593  -0.636
  760    HA   LEU  94           HA       LEU  94  -8.999  -3.063  -2.595
  761   1HB   LEU  94          HB1       LEU  94  -9.487  -2.299   0.187
  762   2HB   LEU  94          HB2       LEU  94  -7.827  -2.225  -0.274
  763    HG   LEU  94           HG       LEU  94  -9.935  -0.904  -1.952
  764   1HD1  LEU  94          HD11      LEU  94 -10.023  -0.176   0.467
  765   2HD1  LEU  94          HD12      LEU  94  -9.715   1.107  -0.706
  766   3HD1  LEU  94          HD13      LEU  94  -8.387   0.452   0.251
  767   1HD2  LEU  94          HD21      LEU  94  -8.229   0.516  -2.774
  768   2HD2  LEU  94          HD22      LEU  94  -7.544  -1.108  -2.822
  769   3HD2  LEU  94          HD23      LEU  94  -7.090   0.002  -1.529
  770    H    ILE  95           HN       ILE  95  -8.561  -5.169   0.251
  771    HA   ILE  95           HA       ILE  95  -5.863  -5.846  -0.190
  772    HB   ILE  95           HB       ILE  95  -8.046  -7.301   1.315
  773   1HG1  ILE  95          HG11      ILE  95  -5.748  -5.667   2.421
  774   2HG1  ILE  95          HG12      ILE  95  -7.314  -4.954   2.045
  775   1HG2  ILE  95          HG21      ILE  95  -6.181  -8.456   2.512
  776   2HG2  ILE  95          HG22      ILE  95  -5.062  -7.804   1.316
  777   3HG2  ILE  95          HG23      ILE  95  -6.326  -8.929   0.818
  778   1HD1  ILE  95          HD11      ILE  95  -8.400  -6.397   3.669
  779   2HD1  ILE  95          HD12      ILE  95  -7.074  -5.522   4.436
  780   3HD1  ILE  95          HD13      ILE  95  -6.873  -7.218   3.997
  781    H    THR  96           HN       THR  96  -8.863  -7.613  -1.062
  782    HA   THR  96           HA       THR  96  -7.731  -9.771  -2.392
  783    HB   THR  96           HB       THR  96 -10.310  -8.489  -3.291
  784    HG1  THR  96           HG1      THR  96 -10.381  -8.750  -1.020
  785   1HG2  THR  96          HG21      THR  96 -10.976 -10.794  -3.730
  786   2HG2  THR  96          HG22      THR  96  -9.431 -11.379  -3.109
  787   3HG2  THR  96          HG23      THR  96  -9.482 -10.428  -4.594
  788    H    TYR  97           HN       TYR  97  -8.452  -6.527  -3.723
  789    HA   TYR  97           HA       TYR  97  -7.775  -7.090  -6.387
  790   1HB   TYR  97          HB1       TYR  97  -8.955  -5.054  -5.722
  791   2HB   TYR  97          HB2       TYR  97  -7.505  -4.470  -4.915
  792    HD1  TYR  97           HD1      TYR  97  -6.307  -2.854  -6.023
  793    HD2  TYR  97           HD2      TYR  97  -8.421  -5.815  -8.315
  794    HE1  TYR  97           HE1      TYR  97  -5.526  -1.779  -8.124
  795    HE2  TYR  97           HE2      TYR  97  -7.747  -4.678 -10.423
  796    HH   TYR  97           HH       TYR  97  -5.334  -2.753 -10.791
  797    H    LEU  98           HN       LEU  98  -5.657  -5.523  -3.931
  798    HA   LEU  98           HA       LEU  98  -3.295  -5.574  -5.435
  799   1HB   LEU  98          HB1       LEU  98  -4.065  -4.619  -2.980
  800   2HB   LEU  98          HB2       LEU  98  -2.971  -5.925  -2.533
  801    HG   LEU  98           HG       LEU  98  -1.229  -4.945  -4.039
  802   1HD1  LEU  98          HD11      LEU  98  -1.601  -2.548  -4.721
  803   2HD1  LEU  98          HD12      LEU  98  -3.306  -2.769  -4.328
  804   3HD1  LEU  98          HD13      LEU  98  -2.567  -3.724  -5.614
  805   1HD2  LEU  98          HD21      LEU  98  -1.327  -4.394  -1.607
  806   2HD2  LEU  98          HD22      LEU  98  -2.284  -2.968  -2.010
  807   3HD2  LEU  98          HD23      LEU  98  -0.625  -3.109  -2.591
  808    H    LYS  99           HN       LYS  99  -4.597  -7.877  -3.130
  809    HA   LYS  99           HA       LYS  99  -2.526  -9.748  -3.096
  810   1HB   LYS  99          HB1       LYS  99  -3.865 -10.356  -1.410
  811   2HB   LYS  99          HB2       LYS  99  -5.262  -9.570  -2.124
  812   1HG   LYS  99          HG1       LYS  99  -5.652 -11.555  -3.524
  813   2HG   LYS  99          HG2       LYS  99  -4.263 -12.341  -2.800
  814   1HD   LYS  99          HD1       LYS  99  -6.227 -11.471  -0.817
  815   2HD   LYS  99          HD2       LYS  99  -6.896 -12.600  -1.999
  816   1HE   LYS  99          HE1       LYS  99  -5.935 -13.712  -0.001
  817   2HE   LYS  99          HE2       LYS  99  -5.199 -14.218  -1.514
  818   1HZ   LYS  99          HZ1       LYS  99  -3.227 -13.377  -0.920
  819   2HZ   LYS  99          HZ2       LYS  99  -3.836 -13.535   0.654
  820   3HZ   LYS  99          HZ3       LYS  99  -3.908 -12.035  -0.125
  821    H    LYS 100           HN       LYS 100  -5.254  -9.403  -5.354
  822    HA   LYS 100           HA       LYS 100  -4.742 -11.800  -6.785
  823   1HB   LYS 100          HB1       LYS 100  -6.829 -10.032  -6.630
  824   2HB   LYS 100          HB2       LYS 100  -6.256  -9.827  -8.267
  825   1HG   LYS 100          HG1       LYS 100  -8.141 -11.458  -8.016
  826   2HG   LYS 100          HG2       LYS 100  -6.708 -12.138  -8.793
  827   1HD   LYS 100          HD1       LYS 100  -6.874 -12.359  -5.865
  828   2HD   LYS 100          HD2       LYS 100  -8.056 -13.276  -6.746
  829   1HE   LYS 100          HE1       LYS 100  -6.510 -14.879  -6.354
  830   2HE   LYS 100          HE2       LYS 100  -5.851 -14.263  -7.878
  831   1HZ   LYS 100          HZ1       LYS 100  -4.886 -12.647  -5.789
  832   2HZ   LYS 100          HZ2       LYS 100  -4.009 -13.658  -6.821
  833   3HZ   LYS 100          HZ3       LYS 100  -4.615 -14.265  -5.360
  834    H    ALA 101           HN       ALA 101  -3.585  -8.665  -7.168
  835    HA   ALA 101           HA       ALA 101  -2.385  -8.835  -9.740
  836   1HB   ALA 101          HB1       ALA 101  -1.985  -6.787  -7.559
  837   2HB   ALA 101          HB2       ALA 101  -3.321  -6.771  -8.710
  838   3HB   ALA 101          HB3       ALA 101  -1.661  -6.591  -9.282
  839    H    THR 102           HN       THR 102  -1.201  -9.221  -6.425
  840    HA   THR 102           HA       THR 102   1.573  -9.547  -7.150
  841    HB   THR 102           HB       THR 102   0.426 -10.187  -4.447
  842    HG1  THR 102           HG1      THR 102  -0.260  -8.055  -5.199
  843   1HG2  THR 102          HG21      THR 102   2.782 -10.689  -4.717
  844   2HG2  THR 102          HG22      THR 102   2.606  -9.266  -3.689
  845   3HG2  THR 102          HG23      THR 102   3.081  -9.080  -5.377
  846    H    GLU 103           HN       GLU 103  -1.121 -11.692  -6.184
  847    HA   GLU 103           HA       GLU 103   0.578 -13.977  -6.967
  848   1HB   GLU 103          HB1       GLU 103  -1.260 -15.158  -5.324
  849   2HB   GLU 103          HB2       GLU 103   0.366 -14.699  -4.846
  850   1HG   GLU 103          HG1       GLU 103  -0.395 -13.223  -3.386
  851   2HG   GLU 103          HG2       GLU 103  -1.448 -12.479  -4.584
  852    HHA  HEC 104           HA       HEC 104   5.006   3.402   1.389
  853    HHB  HEC 104           HB       HEC 104  -0.667   0.487   0.161
  854    HHC  HEC 104           HC       HEC 104  -3.190   6.213  -1.532
  855    HHD  HEC 104           HD       HEC 104   2.748   8.756  -1.484
  856   1HMA  HEC 104          HMA1      HEC 104   1.112  -0.887   2.013
  857   2HMA  HEC 104          HMA2      HEC 104   2.636  -1.270   1.210
  858   3HMA  HEC 104          HMA3      HEC 104   1.154  -1.118   0.265
  859   1HAA  HEC 104          HAA1      HEC 104   4.166  -0.249   2.118
  860   2HAA  HEC 104          HAA2      HEC 104   4.844   1.328   2.476
  861   1HBA  HEC 104          HBA1      HEC 104   5.726   1.442   0.157
  862   2HBA  HEC 104          HBA2      HEC 104   5.106  -0.175  -0.134
  863   1HMB  HEC 104          HMB1      HEC 104  -2.542   0.164  -0.474
  864   2HMB  HEC 104          HMB2      HEC 104  -3.452   0.740  -1.871
  865   3HMB  HEC 104          HMB3      HEC 104  -4.127   0.904  -0.250
  866    HAB  HEC 104           HAB      HEC 104  -4.594   4.884  -1.569
  867   1HBB  HEC 104          HBB1      HEC 104  -4.944   3.699   0.735
  868   2HBB  HEC 104          HBB2      HEC 104  -5.933   2.612  -0.239
  869   3HBB  HEC 104          HBB3      HEC 104  -6.287   4.341  -0.210
  870   1HMC  HEC 104          HMC1      HEC 104  -3.243   8.777  -1.736
  871   2HMC  HEC 104          HMC2      HEC 104  -2.893   8.026  -3.293
  872   3HMC  HEC 104          HMC3      HEC 104  -2.287   9.643  -2.938
  873    HAC  HEC 104           HAC      HEC 104   1.560   9.786  -2.787
  874   1HBC  HEC 104          HBC1      HEC 104   0.754  11.202  -1.144
  875   2HBC  HEC 104          HBC2      HEC 104  -0.901  11.122  -1.746
  876   3HBC  HEC 104          HBC3      HEC 104   0.336  11.968  -2.676
  877   1HMD  HEC 104          HMD1      HEC 104   4.874   9.170  -0.563
  878   2HMD  HEC 104          HMD2      HEC 104   5.336   8.162  -1.935
  879   3HMD  HEC 104          HMD3      HEC 104   6.346   8.201  -0.489
  880   1HAD  HEC 104          HAD1      HEC 104   7.145   6.341   0.326
  881   2HAD  HEC 104          HAD2      HEC 104   6.686   4.810   1.064
  882   1HBD  HEC 104          HBD1      HEC 104   6.153   5.792   3.094
  883   2HBD  HEC 104          HBD2      HEC 104   5.838   7.357   2.375
  884    H2   4NL 105           H2       4NL 105   0.031 -13.184  -1.291
  885    H6   4NL 105           H6       4NL 105   2.458 -13.818   2.773
  886    H3   4NL 105           H3       4NL 105  -1.798 -10.498   1.592
  887    H5   4NL 105           H5       4NL 105  -1.717 -11.861  -1.769
  888    H4   4NL 105           H4       4NL 105  -0.173 -11.269   3.340
  889    H1   4NL 105           H1       4NL 105   1.656 -13.954   0.458
  890    H7   4NL 105           H7       4NL 105   1.764 -12.657   3.930
  Start of MODEL   25
    1   1H    THR  -5          HT1       THR  -5 -11.625  -6.731  13.491
    2   2H    THR  -5          HT2       THR  -5 -11.171  -6.130  11.974
    3   3H    THR  -5          HT3       THR  -5 -10.051  -6.152  13.243
    4    HA   THR  -5           HA       THR  -5  -9.705  -7.935  11.589
    5    HB   THR  -5           HB       THR  -5 -10.481  -9.360  14.090
    6    HG1  THR  -5           HG1      THR  -5  -8.442  -8.286  14.959
    7   1HG2  THR  -5          HG21      THR  -5  -9.027 -10.413  12.431
    8   2HG2  THR  -5          HG22      THR  -5  -8.133 -10.115  13.921
    9   3HG2  THR  -5          HG23      THR  -5  -7.907  -9.053  12.530
   10    H    GLU  -4           HN       GLU  -4 -12.091  -7.371  10.603
   11    HA   GLU  -4           HA       GLU  -4 -13.617  -9.878  10.756
   12   1HB   GLU  -4          HB1       GLU  -4 -14.729  -7.841  11.955
   13   2HB   GLU  -4          HB2       GLU  -4 -14.980  -7.208  10.332
   14   1HG   GLU  -4          HG1       GLU  -4 -15.934  -9.938  11.178
   15   2HG   GLU  -4          HG2       GLU  -4 -16.914  -8.489  11.365
   16    H    PHE  -3           HN       PHE  -3 -11.858 -10.019   9.012
   17    HA   PHE  -3           HA       PHE  -3 -12.178  -8.592   6.587
   18   1HB   PHE  -3          HB1       PHE  -3 -10.005  -9.408   7.012
   19   2HB   PHE  -3          HB2       PHE  -3 -10.581 -11.051   7.262
   20    HD1  PHE  -3           HD1      PHE  -3 -10.296  -8.400   4.616
   21    HD2  PHE  -3           HD2      PHE  -3 -10.489 -12.603   5.508
   22    HE1  PHE  -3           HE1      PHE  -3  -9.947  -8.925   2.210
   23    HE2  PHE  -3           HE2      PHE  -3 -10.191 -13.129   3.096
   24    HZ   PHE  -3           HZ       PHE  -3  -9.949 -11.288   1.440
   25    H    LYS  -2           HN       LYS  -2 -13.463  -8.806   5.015
   26    HA   LYS  -2           HA       LYS  -2 -14.964 -11.280   4.510
   27   1HB   LYS  -2          HB1       LYS  -2 -15.900  -8.573   5.040
   28   2HB   LYS  -2          HB2       LYS  -2 -16.468  -9.150   3.476
   29   1HG   LYS  -2          HG1       LYS  -2 -17.474 -11.091   4.472
   30   2HG   LYS  -2          HG2       LYS  -2 -16.750 -10.726   6.036
   31   1HD   LYS  -2          HD1       LYS  -2 -18.101  -8.572   6.014
   32   2HD   LYS  -2          HD2       LYS  -2 -18.957  -9.227   4.619
   33   1HE   LYS  -2          HE1       LYS  -2 -20.082  -9.540   6.872
   34   2HE   LYS  -2          HE2       LYS  -2 -19.892 -10.991   5.893
   35   1HZ   LYS  -2          HZ1       LYS  -2 -17.961 -10.253   8.022
   36   2HZ   LYS  -2          HZ2       LYS  -2 -18.155 -11.748   7.262
   37   3HZ   LYS  -2          HZ3       LYS  -2 -19.343 -11.192   8.322
   38    H    ALA  -1           HN       ALA  -1 -14.468 -12.115   2.645
   39    HA   ALA  -1           HA       ALA  -1 -12.627 -11.232   0.817
   40   1HB   ALA  -1          HB1       ALA  -1 -13.280 -13.536   0.970
   41   2HB   ALA  -1          HB2       ALA  -1 -13.588 -12.982  -0.676
   42   3HB   ALA  -1          HB3       ALA  -1 -14.926 -13.154   0.461
   43    H    GLY   1           HN       GLY   1 -12.659 -10.205  -1.148
   44   1HA   GLY   1          HA1       GLY   1 -15.059  -8.657  -1.875
   45   2HA   GLY   1          HA2       GLY   1 -13.407  -8.100  -2.095
   46    H    SER   2           HN       SER   2 -13.487  -7.785  -4.241
   47    HA   SER   2           HA       SER   2 -13.137 -10.021  -6.001
   48   1HB   SER   2          HB1       SER   2 -15.255  -8.265  -7.069
   49   2HB   SER   2          HB2       SER   2 -15.071 -10.019  -7.190
   50    HG   SER   2           HG       SER   2 -15.700 -10.073  -4.919
   51    H    ALA   3           HN       ALA   3 -11.980  -9.436  -7.825
   52    HA   ALA   3           HA       ALA   3 -10.413  -7.221  -7.901
   53   1HB   ALA   3          HB1       ALA   3  -9.980  -7.762 -10.249
   54   2HB   ALA   3          HB2       ALA   3 -11.399  -8.809 -10.264
   55   3HB   ALA   3          HB3       ALA   3 -10.025  -9.205  -9.234
   56    H    LYS   4           HN       LYS   4 -13.631  -7.387  -9.532
   57    HA   LYS   4           HA       LYS   4 -13.384  -4.784 -10.633
   58   1HB   LYS   4          HB1       LYS   4 -14.727  -6.666 -11.599
   59   2HB   LYS   4          HB2       LYS   4 -15.958  -6.298 -10.390
   60   1HG   LYS   4          HG1       LYS   4 -15.253  -3.834 -11.562
   61   2HG   LYS   4          HG2       LYS   4 -15.422  -4.975 -12.890
   62   1HD   LYS   4          HD1       LYS   4 -17.675  -5.233 -12.556
   63   2HD   LYS   4          HD2       LYS   4 -17.558  -4.949 -10.815
   64   1HE   LYS   4          HE1       LYS   4 -17.241  -2.814 -12.940
   65   2HE   LYS   4          HE2       LYS   4 -18.716  -3.100 -12.016
   66   1HZ   LYS   4          HZ1       LYS   4 -17.890  -2.061 -10.245
   67   2HZ   LYS   4          HZ2       LYS   4 -16.751  -1.406 -11.307
   68   3HZ   LYS   4          HZ3       LYS   4 -16.361  -2.776 -10.398
   69    H    LYS   5           HN       LYS   5 -13.645  -5.346  -7.488
   70    HA   LYS   5           HA       LYS   5 -15.300  -2.949  -7.002
   71   1HB   LYS   5          HB1       LYS   5 -14.889  -5.311  -5.151
   72   2HB   LYS   5          HB2       LYS   5 -15.716  -3.824  -4.707
   73   1HG   LYS   5          HG1       LYS   5 -17.203  -4.386  -6.810
   74   2HG   LYS   5          HG2       LYS   5 -16.617  -6.024  -6.514
   75   1HD   LYS   5          HD1       LYS   5 -17.524  -4.666  -4.082
   76   2HD   LYS   5          HD2       LYS   5 -18.797  -4.845  -5.289
   77   1HE   LYS   5          HE1       LYS   5 -18.812  -6.763  -3.801
   78   2HE   LYS   5          HE2       LYS   5 -18.300  -7.270  -5.410
   79   1HZ   LYS   5          HZ1       LYS   5 -16.992  -8.019  -3.295
   80   2HZ   LYS   5          HZ2       LYS   5 -16.256  -6.499  -3.453
   81   3HZ   LYS   5          HZ3       LYS   5 -16.167  -7.618  -4.720
   82    H    GLY   6           HN       GLY   6 -12.647  -4.839  -5.493
   83   1HA   GLY   6          HA1       GLY   6 -11.547  -2.763  -3.976
   84   2HA   GLY   6          HA2       GLY   6 -10.658  -4.159  -4.562
   85    H    ALA   7           HN       ALA   7 -11.134  -3.474  -7.411
   86    HA   ALA   7           HA       ALA   7  -8.913  -1.868  -7.948
   87   1HB   ALA   7          HB1       ALA   7  -9.944  -3.583  -9.475
   88   2HB   ALA   7          HB2       ALA   7  -9.477  -2.066 -10.245
   89   3HB   ALA   7          HB3       ALA   7 -11.171  -2.379  -9.873
   90    H    THR   8           HN       THR   8 -12.424  -0.936  -8.226
   91    HA   THR   8           HA       THR   8 -12.065   1.668  -9.049
   92    HB   THR   8           HB       THR   8 -14.133   1.994  -7.278
   93    HG1  THR   8           HG1      THR   8 -13.994  -0.256  -6.757
   94   1HG2  THR   8          HG21      THR   8 -14.444   0.748 -10.003
   95   2HG2  THR   8          HG22      THR   8 -14.013   2.443  -9.768
   96   3HG2  THR   8          HG23      THR   8 -15.557   1.835  -9.168
   97    H    LEU   9           HN       LEU   9 -11.589   0.473  -5.766
   98    HA   LEU   9           HA       LEU   9 -11.400   2.964  -4.452
   99   1HB   LEU   9          HB1       LEU   9 -10.818   0.127  -3.796
  100   2HB   LEU   9          HB2       LEU   9  -9.924   1.330  -2.868
  101    HG   LEU   9           HG       LEU   9 -11.880   0.930  -1.608
  102   1HD1  LEU   9          HD11      LEU   9 -13.187   3.056  -1.845
  103   2HD1  LEU   9          HD12      LEU   9 -12.269   3.388  -3.314
  104   3HD1  LEU   9          HD13      LEU   9 -11.440   3.289  -1.761
  105   1HD2  LEU   9          HD21      LEU   9 -13.437   1.210  -4.187
  106   2HD2  LEU   9          HD22      LEU   9 -14.170   1.118  -2.586
  107   3HD2  LEU   9          HD23      LEU   9 -13.257  -0.253  -3.215
  108    H    PHE  10           HN       PHE  10  -8.684   0.710  -4.679
  109    HA   PHE  10           HA       PHE  10  -6.557   2.364  -4.425
  110   1HB   PHE  10          HB1       PHE  10  -6.474  -0.100  -4.588
  111   2HB   PHE  10          HB2       PHE  10  -6.725   0.016  -6.323
  112    HD1  PHE  10           HD1      PHE  10  -4.926   1.363  -7.681
  113    HD2  PHE  10           HD2      PHE  10  -4.330  -0.205  -3.721
  114    HE1  PHE  10           HE1      PHE  10  -2.458   1.431  -8.021
  115    HE2  PHE  10           HE2      PHE  10  -1.870  -0.016  -4.015
  116    HZ   PHE  10           HZ       PHE  10  -0.928   0.777  -6.171
  117    H    LYS  11           HN       LYS  11  -8.356   1.856  -7.433
  118    HA   LYS  11           HA       LYS  11  -6.568   3.193  -9.156
  119   1HB   LYS  11          HB1       LYS  11  -8.498   1.495  -9.644
  120   2HB   LYS  11          HB2       LYS  11  -9.469   2.956  -9.834
  121   1HG   LYS  11          HG1       LYS  11  -8.287   3.680 -11.680
  122   2HG   LYS  11          HG2       LYS  11  -6.835   2.790 -11.232
  123   1HD   LYS  11          HD1       LYS  11  -9.322   1.307 -12.014
  124   2HD   LYS  11          HD2       LYS  11  -8.275   1.990 -13.259
  125   1HE   LYS  11          HE1       LYS  11  -7.614  -0.292 -12.925
  126   2HE   LYS  11          HE2       LYS  11  -6.360   0.734 -12.237
  127   1HZ   LYS  11          HZ1       LYS  11  -8.494  -0.653 -10.699
  128   2HZ   LYS  11          HZ2       LYS  11  -7.285   0.326 -10.039
  129   3HZ   LYS  11          HZ3       LYS  11  -6.868  -1.129 -10.791
  130    H    THR  12           HN       THR  12  -8.797   4.554  -6.962
  131    HA   THR  12           HA       THR  12  -8.286   7.234  -7.966
  132    HB   THR  12           HB       THR  12 -10.550   6.179  -8.710
  133    HG1  THR  12           HG1      THR  12  -9.715   8.326  -9.048
  134   1HG2  THR  12          HG21      THR  12 -11.496   5.712  -6.508
  135   2HG2  THR  12          HG22      THR  12 -12.454   6.909  -7.380
  136   3HG2  THR  12          HG23      THR  12 -11.369   7.420  -6.086
  137    H    ARG  13           HN       ARG  13  -7.379   5.560  -5.732
  138    HA   ARG  13           HA       ARG  13  -7.608   7.499  -3.551
  139   1HB   ARG  13          HB1       ARG  13  -8.023   4.522  -3.265
  140   2HB   ARG  13          HB2       ARG  13  -7.743   5.599  -1.914
  141   1HG   ARG  13          HG1       ARG  13 -10.103   5.705  -3.782
  142   2HG   ARG  13          HG2       ARG  13 -10.096   4.994  -2.177
  143   1HD   ARG  13          HD1       ARG  13 -10.617   6.973  -1.292
  144   2HD   ARG  13          HD2       ARG  13  -9.152   7.683  -1.981
  145    HE   ARG  13           HE       ARG  13 -10.285   7.704  -3.981
  146   1HH1  ARG  13          HH11      ARG  13 -12.095   7.986  -1.002
  147   2HH1  ARG  13          HH12      ARG  13 -13.216   9.214  -1.467
  148   1HH2  ARG  13          HH21      ARG  13 -12.027   9.573  -4.654
  149   2HH2  ARG  13          HH22      ARG  13 -13.199  10.061  -3.480
  150    H    CYS  14           HN       CYS  14  -5.771   5.232  -5.328
  151    HA   CYS  14           HA       CYS  14  -3.366   5.796  -3.735
  152   1HB   CYS  14          HB1       CYS  14  -3.811   3.095  -4.943
  153   2HB   CYS  14          HB2       CYS  14  -2.699   3.560  -3.676
  154    H    LEU  15           HN       LEU  15  -4.716   4.847  -6.871
  155    HA   LEU  15           HA       LEU  15  -2.535   4.610  -8.474
  156   1HB   LEU  15          HB1       LEU  15  -5.118   4.534  -8.941
  157   2HB   LEU  15          HB2       LEU  15  -4.870   6.194  -9.465
  158    HG   LEU  15           HG       LEU  15  -3.082   5.368 -11.035
  159   1HD1  LEU  15          HD11      LEU  15  -3.087   2.978 -11.619
  160   2HD1  LEU  15          HD12      LEU  15  -4.172   2.660 -10.266
  161   3HD1  LEU  15          HD13      LEU  15  -2.537   3.252  -9.965
  162   1HD2  LEU  15          HD21      LEU  15  -5.332   5.828 -11.864
  163   2HD2  LEU  15          HD22      LEU  15  -5.837   4.194 -11.433
  164   3HD2  LEU  15          HD23      LEU  15  -4.631   4.441 -12.697
  165    H    GLN  16           HN       GLN  16  -3.943   7.692  -7.426
  166    HA   GLN  16           HA       GLN  16  -2.783   9.593  -8.898
  167   1HB   GLN  16          HB1       GLN  16  -2.607  10.891  -6.633
  168   2HB   GLN  16          HB2       GLN  16  -4.169  10.419  -7.283
  169   1HG   GLN  16          HG1       GLN  16  -3.430   8.249  -5.711
  170   2HG   GLN  16          HG2       GLN  16  -2.896   9.655  -4.786
  171   1HE2  GLN  16          HE21      GLN  16  -4.500  11.147  -4.044
  172   2HE2  GLN  16          HE22      GLN  16  -6.172  10.723  -4.031
  173    H    CYS  17           HN       CYS  17  -0.966   7.739  -6.475
  174    HA   CYS  17           HA       CYS  17   1.506   9.065  -7.360
  175   1HB   CYS  17          HB1       CYS  17   1.444   7.876  -4.648
  176   2HB   CYS  17          HB2       CYS  17   2.256   9.307  -5.259
  177    H    HIS  18           HN       HIS  18   0.064   5.981  -6.429
  178    HA   HIS  18           HA       HIS  18   2.578   4.528  -6.693
  179   1HB   HIS  18          HB1       HIS  18  -0.137   3.893  -5.601
  180   2HB   HIS  18          HB2       HIS  18   1.007   2.608  -5.941
  181    HD1  HIS  18           HD1      HIS  18   3.489   3.062  -4.580
  182    HD2  HIS  18           HD2      HIS  18  -0.062   4.776  -3.172
  183    HE1  HIS  18           HE1      HIS  18   3.868   3.543  -2.119
  184    H    THR  19           HN       THR  19   2.165   2.230  -7.513
  185    HA   THR  19           HA       THR  19   0.608   2.047  -9.972
  186    HB   THR  19           HB       THR  19   2.906   0.769 -10.689
  187    HG1  THR  19           HG1      THR  19   4.438   2.642 -10.290
  188   1HG2  THR  19          HG21      THR  19   2.129   3.639 -11.199
  189   2HG2  THR  19          HG22      THR  19   1.730   2.234 -12.187
  190   3HG2  THR  19          HG23      THR  19   3.400   2.785 -12.073
  191    H    VAL  20           HN       VAL  20  -0.579   0.204  -9.908
  192    HA   VAL  20           HA       VAL  20  -0.180  -1.801  -7.902
  193    HB   VAL  20           HB       VAL  20  -2.320  -0.791  -9.117
  194   1HG1  VAL  20          HG11      VAL  20  -2.008  -1.899 -11.235
  195   2HG1  VAL  20          HG12      VAL  20  -3.469  -2.485 -10.437
  196   3HG1  VAL  20          HG13      VAL  20  -2.009  -3.476 -10.439
  197   1HG2  VAL  20          HG21      VAL  20  -2.142  -3.449  -7.723
  198   2HG2  VAL  20          HG22      VAL  20  -3.660  -2.638  -8.108
  199   3HG2  VAL  20          HG23      VAL  20  -2.505  -1.872  -7.021
  200    H    GLU  21           HN       GLU  21   0.799  -1.566 -11.155
  201    HA   GLU  21           HA       GLU  21   1.596  -4.399 -11.288
  202   1HB   GLU  21          HB1       GLU  21   1.730  -3.677 -13.866
  203   2HB   GLU  21          HB2       GLU  21   0.247  -4.285 -13.156
  204   1HG   GLU  21          HG1       GLU  21  -0.035  -2.281 -14.631
  205   2HG   GLU  21          HG2       GLU  21  -0.685  -2.090 -13.005
  206    H    LYS  22           HN       LYS  22   3.645  -4.421 -13.084
  207    HA   LYS  22           HA       LYS  22   5.493  -2.438 -12.003
  208   1HB   LYS  22          HB1       LYS  22   5.717  -5.219 -12.487
  209   2HB   LYS  22          HB2       LYS  22   6.931  -4.385 -13.469
  210   1HG   LYS  22          HG1       LYS  22   8.033  -3.542 -11.664
  211   2HG   LYS  22          HG2       LYS  22   6.555  -3.359 -10.719
  212   1HD   LYS  22          HD1       LYS  22   6.525  -5.714 -10.223
  213   2HD   LYS  22          HD2       LYS  22   7.903  -5.992 -11.289
  214   1HE   LYS  22          HE1       LYS  22   8.691  -5.991  -9.013
  215   2HE   LYS  22          HE2       LYS  22   9.293  -4.552  -9.815
  216   1HZ   LYS  22          HZ1       LYS  22   7.302  -3.396  -8.686
  217   2HZ   LYS  22          HZ2       LYS  22   8.629  -3.806  -7.727
  218   3HZ   LYS  22          HZ3       LYS  22   7.240  -4.764  -7.691
  219    H    GLY  23           HN       GLY  23   3.684  -1.871 -14.407
  220   1HA   GLY  23          HA1       GLY  23   5.716  -1.393 -16.481
  221   2HA   GLY  23          HA2       GLY  23   3.978  -1.266 -16.695
  222    H    GLY  24           HN       GLY  24   3.829   0.367 -14.144
  223   1HA   GLY  24          HA1       GLY  24   4.212   2.977 -15.333
  224   2HA   GLY  24          HA2       GLY  24   3.366   2.608 -13.839
  225    HA   PRO  25           HA       PRO  25   8.128   3.622 -13.210
  226   1HB   PRO  25          HB1       PRO  25   8.171   6.361 -13.530
  227   2HB   PRO  25          HB2       PRO  25   8.733   5.204 -14.741
  228   1HG   PRO  25          HG1       PRO  25   6.119   6.643 -14.561
  229   2HG   PRO  25          HG2       PRO  25   7.112   6.294 -15.989
  230   1HD   PRO  25          HD1       PRO  25   4.914   4.858 -15.406
  231   2HD   PRO  25          HD2       PRO  25   6.350   4.112 -16.139
  232    H    HIS  26           HN       HIS  26   8.840   4.611 -11.243
  233    HA   HIS  26           HA       HIS  26   6.921   4.762  -9.191
  234   1HB   HIS  26          HB1       HIS  26   9.802   5.688  -9.300
  235   2HB   HIS  26          HB2       HIS  26   8.857   5.564  -7.826
  236    HD2  HIS  26           HD2      HIS  26  10.954   3.505 -10.235
  237    HE1  HIS  26           HE1      HIS  26   9.631   0.808  -7.233
  238    HE2  HIS  26           HE2      HIS  26  11.211   1.123  -9.195
  239    H    LYS  27           HN       LYS  27   5.443   6.403  -9.075
  240    HA   LYS  27           HA       LYS  27   6.078   9.079  -9.982
  241   1HB   LYS  27          HB1       LYS  27   3.567   7.598  -9.290
  242   2HB   LYS  27          HB2       LYS  27   3.547   9.352  -9.370
  243   1HG   LYS  27          HG1       LYS  27   4.027   9.387 -11.659
  244   2HG   LYS  27          HG2       LYS  27   4.668   7.740 -11.642
  245   1HD   LYS  27          HD1       LYS  27   1.771   8.589 -11.399
  246   2HD   LYS  27          HD2       LYS  27   2.511   7.651 -12.702
  247   1HE   LYS  27          HE1       LYS  27   2.703   5.733 -11.389
  248   2HE   LYS  27          HE2       LYS  27   2.625   6.641  -9.879
  249   1HZ   LYS  27          HZ1       LYS  27   0.378   6.126 -11.750
  250   2HZ   LYS  27          HZ2       LYS  27   0.276   7.109 -10.379
  251   3HZ   LYS  27          HZ3       LYS  27   0.585   5.456 -10.205
  252    H    VAL  28           HN       VAL  28   3.979   9.936  -7.773
  253    HA   VAL  28           HA       VAL  28   5.800  11.060  -5.935
  254    HB   VAL  28           HB       VAL  28   2.839  10.641  -5.509
  255   1HG1  VAL  28          HG11      VAL  28   3.030  12.687  -4.127
  256   2HG1  VAL  28          HG12      VAL  28   4.777  12.664  -4.371
  257   3HG1  VAL  28          HG13      VAL  28   3.992  11.350  -3.494
  258   1HG2  VAL  28          HG21      VAL  28   2.475  12.862  -6.450
  259   2HG2  VAL  28          HG22      VAL  28   3.216  11.809  -7.655
  260   3HG2  VAL  28          HG23      VAL  28   4.194  13.012  -6.817
  261    H    GLY  29           HN       GLY  29   4.306   7.982  -6.121
  262   1HA   GLY  29          HA1       GLY  29   5.379   7.152  -3.503
  263   2HA   GLY  29          HA2       GLY  29   3.827   6.585  -4.097
  264    HA   PRO  30           HA       PRO  30   7.584   3.967  -5.649
  265   1HB   PRO  30          HB1       PRO  30   7.605   1.975  -3.814
  266   2HB   PRO  30          HB2       PRO  30   8.560   3.452  -3.643
  267   1HG   PRO  30          HG1       PRO  30   5.917   2.755  -2.413
  268   2HG   PRO  30          HG2       PRO  30   7.340   3.496  -1.656
  269   1HD   PRO  30          HD1       PRO  30   5.213   4.952  -2.450
  270   2HD   PRO  30          HD2       PRO  30   6.872   5.583  -2.526
  271    H    ASN  31           HN       ASN  31   7.506   1.603  -6.282
  272    HA   ASN  31           HA       ASN  31   4.864   0.954  -7.249
  273   1HB   ASN  31          HB1       ASN  31   6.929   0.811  -8.644
  274   2HB   ASN  31          HB2       ASN  31   7.512  -0.490  -7.616
  275   1HD2  ASN  31          HD21      ASN  31   5.086   0.365 -10.028
  276   2HD2  ASN  31          HD22      ASN  31   4.744  -1.275 -10.471
  277    H    LEU  32           HN       LEU  32   3.500  -0.526  -6.374
  278    HA   LEU  32           HA       LEU  32   4.134  -1.814  -3.847
  279   1HB   LEU  32          HB1       LEU  32   1.510  -1.269  -5.241
  280   2HB   LEU  32          HB2       LEU  32   1.665  -2.006  -3.659
  281    HG   LEU  32           HG       LEU  32   2.435   0.828  -4.402
  282   1HD1  LEU  32          HD11      LEU  32   0.655   1.464  -2.868
  283   2HD1  LEU  32          HD12      LEU  32   0.316  -0.233  -2.524
  284   3HD1  LEU  32          HD13      LEU  32   0.015   0.416  -4.135
  285   1HD2  LEU  32          HD21      LEU  32   2.669  -0.574  -1.733
  286   2HD2  LEU  32          HD22      LEU  32   2.903   1.152  -2.008
  287   3HD2  LEU  32          HD23      LEU  32   4.009  -0.014  -2.734
  288    H    HIS  33           HN       HIS  33   3.949  -2.769  -7.070
  289    HA   HIS  33           HA       HIS  33   2.757  -5.302  -7.041
  290   1HB   HIS  33          HB1       HIS  33   3.344  -3.771  -9.010
  291   2HB   HIS  33          HB2       HIS  33   4.979  -4.411  -8.877
  292    HD2  HIS  33           HD2      HIS  33   1.684  -6.470  -8.598
  293    HE1  HIS  33           HE1      HIS  33   3.801  -7.870 -12.007
  294    HE2  HIS  33           HE2      HIS  33   1.798  -8.270 -10.494
  295    H    GLY  34           HN       GLY  34   3.491  -6.559  -5.348
  296   1HA   GLY  34          HA1       GLY  34   4.844  -8.541  -5.018
  297   2HA   GLY  34          HA2       GLY  34   6.235  -7.618  -5.547
  298    H    ILE  35           HN       ILE  35   4.208  -5.847  -3.341
  299    HA   ILE  35           HA       ILE  35   6.294  -5.844  -1.417
  300    HB   ILE  35           HB       ILE  35   4.887  -4.544   0.051
  301   1HG1  ILE  35          HG11      ILE  35   2.673  -5.259  -1.829
  302   2HG1  ILE  35          HG12      ILE  35   2.641  -5.040  -0.081
  303   1HG2  ILE  35          HG21      ILE  35   4.829  -2.573  -1.357
  304   2HG2  ILE  35          HG22      ILE  35   4.897  -3.581  -2.802
  305   3HG2  ILE  35          HG23      ILE  35   6.262  -3.548  -1.687
  306   1HD1  ILE  35          HD11      ILE  35   2.726  -2.860  -2.172
  307   2HD1  ILE  35          HD12      ILE  35   2.843  -2.581  -0.434
  308   3HD1  ILE  35          HD13      ILE  35   1.372  -3.271  -1.118
  309    H    PHE  36           HN       PHE  36   3.420  -7.851  -1.648
  310    HA   PHE  36           HA       PHE  36   3.254  -8.754   0.976
  311   1HB   PHE  36          HB1       PHE  36   2.537 -10.186  -1.586
  312   2HB   PHE  36          HB2       PHE  36   2.084 -10.735   0.027
  313    HD1  PHE  36           HD1      PHE  36   1.192  -8.479   1.469
  314    HD2  PHE  36           HD2      PHE  36   0.700  -9.317  -2.721
  315    HE1  PHE  36           HE1      PHE  36  -0.796  -6.986   1.412
  316    HE2  PHE  36           HE2      PHE  36  -1.289  -7.824  -2.782
  317    HZ   PHE  36           HZ       PHE  36  -2.032  -6.649  -0.719
  318    H    GLY  37           HN       GLY  37   4.681  -9.657   2.166
  319   1HA   GLY  37          HA1       GLY  37   5.977 -11.484   2.902
  320   2HA   GLY  37          HA2       GLY  37   6.403 -11.836   1.238
  321    H    ARG  38           HN       ARG  38   6.771  -8.545   1.604
  322    HA   ARG  38           HA       ARG  38   9.652  -8.754   2.205
  323   1HB   ARG  38          HB1       ARG  38   8.080  -7.150   0.214
  324   2HB   ARG  38          HB2       ARG  38   9.566  -6.465   0.854
  325   1HG   ARG  38          HG1       ARG  38  10.894  -7.935  -0.267
  326   2HG   ARG  38          HG2       ARG  38   9.713  -9.243  -0.171
  327   1HD   ARG  38          HD1       ARG  38   9.678  -8.711  -2.440
  328   2HD   ARG  38          HD2       ARG  38   8.325  -7.769  -1.814
  329    HE   ARG  38           HE       ARG  38  10.378  -6.704  -1.406
  330   1HH1  ARG  38          HH21      ARG  38   8.623  -7.481  -4.267
  331   2HH1  ARG  38          HH22      ARG  38   8.807  -5.960  -4.977
  332   1HH2  ARG  38          HH11      ARG  38  11.078  -4.529  -3.106
  333   2HH2  ARG  38          HH12      ARG  38  10.646  -4.935  -4.711
  334    H    HIS  39           HN       HIS  39  10.534  -6.589   2.985
  335    HA   HIS  39           HA       HIS  39   8.919  -5.735   5.260
  336   1HB   HIS  39          HB1       HIS  39  11.807  -5.040   4.658
  337   2HB   HIS  39          HB2       HIS  39  10.978  -4.941   6.214
  338    HD2  HIS  39           HD2      HIS  39  10.399  -7.290   7.475
  339    HE1  HIS  39           HE1      HIS  39  12.877  -9.761   5.055
  340    HE2  HIS  39           HE2      HIS  39  11.440  -9.668   7.147
  341    H    SER  40           HN       SER  40   8.847  -3.390   5.815
  342    HA   SER  40           HA       SER  40   8.025  -1.781   3.674
  343   1HB   SER  40          HB1       SER  40   8.935  -0.435   6.174
  344   2HB   SER  40          HB2       SER  40   7.520  -0.117   5.182
  345    HG   SER  40           HG       SER  40   6.750  -2.215   6.024
  346    H    GLY  41           HN       GLY  41   8.997  -0.331   2.409
  347   1HA   GLY  41          HA1       GLY  41  10.630   1.189   1.717
  348   2HA   GLY  41          HA2       GLY  41  11.651   0.682   3.041
  349    H    GLN  42           HN       GLN  42  10.359  -1.495   0.451
  350    HA   GLN  42           HA       GLN  42  13.140  -1.820  -0.429
  351   1HB   GLN  42          HB1       GLN  42  11.151  -4.067  -0.232
  352   2HB   GLN  42          HB2       GLN  42  12.836  -4.198  -0.722
  353   1HG   GLN  42          HG1       GLN  42  13.565  -3.472   1.492
  354   2HG   GLN  42          HG2       GLN  42  11.889  -3.263   1.993
  355   1HE2  GLN  42          HE21      GLN  42  13.946  -5.017   3.164
  356   2HE2  GLN  42          HE22      GLN  42  13.323  -6.622   3.049
  357    H    ALA  43           HN       ALA  43  11.015  -0.178  -1.859
  358    HA   ALA  43           HA       ALA  43  10.282  -1.461  -4.245
  359   1HB   ALA  43          HB1       ALA  43  10.758   1.484  -3.843
  360   2HB   ALA  43          HB2       ALA  43   9.295   0.620  -3.373
  361   3HB   ALA  43          HB3       ALA  43   9.747   0.729  -5.073
  362    H    GLU  44           HN       GLU  44  11.154  -1.677  -6.247
  363    HA   GLU  44           HA       GLU  44  13.995  -1.528  -6.534
  364   1HB   GLU  44          HB1       GLU  44  12.188  -2.442  -8.759
  365   2HB   GLU  44          HB2       GLU  44  13.787  -3.022  -8.309
  366   1HG   GLU  44          HG1       GLU  44  12.489  -4.762  -7.554
  367   2HG   GLU  44          HG2       GLU  44  12.604  -3.786  -6.103
  368    H    GLY  45           HN       GLY  45  14.128   0.820  -6.366
  369   1HA   GLY  45          HA1       GLY  45  15.235   2.379  -7.945
  370   2HA   GLY  45          HA2       GLY  45  13.817   2.211  -8.956
  371    H    TYR  46           HN       TYR  46  13.462   2.563  -5.482
  372    HA   TYR  46           HA       TYR  46  13.027   5.417  -5.591
  373   1HB   TYR  46          HB1       TYR  46  10.907   4.507  -6.328
  374   2HB   TYR  46          HB2       TYR  46  10.803   3.515  -4.880
  375    HD1  TYR  46           HD1      TYR  46  10.238   6.805  -6.329
  376    HD2  TYR  46           HD2      TYR  46  10.536   4.612  -2.647
  377    HE1  TYR  46           HE1      TYR  46   8.952   8.598  -5.173
  378    HE2  TYR  46           HE2      TYR  46   9.156   6.339  -1.497
  379    HH   TYR  46           HH       TYR  46   7.486   8.825  -3.256
  380    H    SER  47           HN       SER  47  13.377   6.488  -3.724
  381    HA   SER  47           HA       SER  47  14.459   5.020  -1.463
  382   1HB   SER  47          HB1       SER  47  14.581   7.838  -1.043
  383   2HB   SER  47          HB2       SER  47  15.903   6.715  -1.372
  384    HG   SER  47           HG       SER  47  15.872   7.246  -3.438
  385    H    TYR  48           HN       TYR  48  13.715   5.016   0.534
  386    HA   TYR  48           HA       TYR  48  11.118   6.132   1.267
  387   1HB   TYR  48          HB1       TYR  48  12.734   3.758   2.197
  388   2HB   TYR  48          HB2       TYR  48  11.271   4.295   3.019
  389    HD1  TYR  48           HD1      TYR  48   9.102   3.936   2.099
  390    HD2  TYR  48           HD2      TYR  48  12.609   2.864  -0.145
  391    HE1  TYR  48           HE1      TYR  48   7.703   2.527   0.603
  392    HE2  TYR  48           HE2      TYR  48  11.221   1.452  -1.649
  393    HH   TYR  48           HH       TYR  48   8.345   0.262  -0.813
  394    H    THR  49           HN       THR  49  10.854   6.866   3.605
  395    HA   THR  49           HA       THR  49  12.846   8.755   4.401
  396    HB   THR  49           HB       THR  49  11.316   8.929   6.491
  397    HG1  THR  49           HG1      THR  49   9.335   7.907   4.828
  398   1HG2  THR  49          HG21      THR  49  11.399  10.646   4.826
  399   2HG2  THR  49          HG22      THR  49   9.714  10.333   5.242
  400   3HG2  THR  49          HG23      THR  49  10.384   9.699   3.737
  401    H    ASP  50           HN       ASP  50  13.579   8.988   6.683
  402    HA   ASP  50           HA       ASP  50  15.216   6.924   7.536
  403   1HB   ASP  50          HB1       ASP  50  15.634   9.244   8.064
  404   2HB   ASP  50          HB2       ASP  50  14.145   9.345   9.001
  405    H    ALA  51           HN       ALA  51  11.926   7.688   8.551
  406    HA   ALA  51           HA       ALA  51  11.891   5.818  10.734
  407   1HB   ALA  51          HB1       ALA  51   9.652   6.667  11.127
  408   2HB   ALA  51          HB2       ALA  51   9.675   7.506   9.576
  409   3HB   ALA  51          HB3       ALA  51  10.776   8.001  10.861
  410    H    ASN  52           HN       ASN  52  10.656   5.772   7.372
  411    HA   ASN  52           HA       ASN  52   8.966   3.507   7.776
  412   1HB   ASN  52          HB1       ASN  52   8.258   4.754   5.984
  413   2HB   ASN  52          HB2       ASN  52   9.892   5.114   5.443
  414   1HD2  ASN  52          HD21      ASN  52   7.156   3.173   4.856
  415   2HD2  ASN  52          HD22      ASN  52   7.910   2.201   3.645
  416    H    ILE  53           HN       ILE  53  12.310   3.869   6.674
  417    HA   ILE  53           HA       ILE  53  12.758   1.160   6.015
  418    HB   ILE  53           HB       ILE  53  14.660   3.360   6.761
  419   1HG1  ILE  53          HG11      ILE  53  14.012   2.193   4.033
  420   2HG1  ILE  53          HG12      ILE  53  13.259   3.650   4.677
  421   1HG2  ILE  53          HG21      ILE  53  15.756   1.198   7.150
  422   2HG2  ILE  53          HG22      ILE  53  16.448   2.001   5.740
  423   3HG2  ILE  53          HG23      ILE  53  15.312   0.671   5.525
  424   1HD1  ILE  53          HD11      ILE  53  16.191   3.266   4.053
  425   2HD1  ILE  53          HD12      ILE  53  15.505   4.706   4.806
  426   3HD1  ILE  53          HD13      ILE  53  15.039   4.264   3.164
  427    H    LYS  54           HN       LYS  54  14.219   2.819   8.869
  428    HA   LYS  54           HA       LYS  54  14.790   0.820  10.536
  429   1HB   LYS  54          HB1       LYS  54  13.384   3.400  11.210
  430   2HB   LYS  54          HB2       LYS  54  14.106   2.334  12.418
  431   1HG   LYS  54          HG1       LYS  54  16.294   2.569  11.385
  432   2HG   LYS  54          HG2       LYS  54  15.604   3.552  10.090
  433   1HD   LYS  54          HD1       LYS  54  14.907   5.229  11.798
  434   2HD   LYS  54          HD2       LYS  54  15.747   4.269  13.026
  435   1HE   LYS  54          HE1       LYS  54  17.859   4.664  12.057
  436   2HE   LYS  54          HE2       LYS  54  17.151   5.199  10.530
  437   1HZ   LYS  54          HZ1       LYS  54  17.078   6.648  13.114
  438   2HZ   LYS  54          HZ2       LYS  54  16.241   7.126  11.719
  439   3HZ   LYS  54          HZ3       LYS  54  17.933   7.088  11.717
  440    H    LYS  55           HN       LYS  55  11.596   1.352   9.434
  441    HA   LYS  55           HA       LYS  55  10.237   0.058  11.643
  442   1HB   LYS  55          HB1       LYS  55   9.167   1.924  10.645
  443   2HB   LYS  55          HB2       LYS  55   9.332   1.255   9.038
  444   1HG   LYS  55          HG1       LYS  55   7.125   0.917   9.383
  445   2HG   LYS  55          HG2       LYS  55   7.751  -0.607   9.986
  446   1HD   LYS  55          HD1       LYS  55   7.012   1.755  11.721
  447   2HD   LYS  55          HD2       LYS  55   5.953   0.386  11.390
  448   1HE   LYS  55          HE1       LYS  55   8.639   0.258  12.778
  449   2HE   LYS  55          HE2       LYS  55   7.063   0.149  13.565
  450   1HZ   LYS  55          HZ1       LYS  55   8.319  -1.801  11.718
  451   2HZ   LYS  55          HZ2       LYS  55   6.667  -1.831  12.066
  452   3HZ   LYS  55          HZ3       LYS  55   7.789  -2.048  13.309
  453    H    ASN  56           HN       ASN  56  11.191  -0.839   8.398
  454    HA   ASN  56           HA       ASN  56  10.770  -2.624   7.051
  455   1HB   ASN  56          HB1       ASN  56  12.702  -3.098   9.158
  456   2HB   ASN  56          HB2       ASN  56  12.073  -4.600   8.517
  457   1HD2  ASN  56          HD21      ASN  56  12.434  -1.822   6.347
  458   2HD2  ASN  56          HD22      ASN  56  13.581  -2.765   5.500
  459    H    VAL  57           HN       VAL  57   8.311  -2.429   8.092
  460    HA   VAL  57           HA       VAL  57   7.456  -4.727   9.541
  461    HB   VAL  57           HB       VAL  57   6.322  -2.292   8.880
  462   1HG1  VAL  57          HG11      VAL  57   4.551  -4.448   7.730
  463   2HG1  VAL  57          HG12      VAL  57   5.290  -3.131   6.819
  464   3HG1  VAL  57          HG13      VAL  57   4.082  -2.778   8.055
  465   1HG2  VAL  57          HG21      VAL  57   6.157  -3.452  10.969
  466   2HG2  VAL  57          HG22      VAL  57   5.186  -4.726  10.231
  467   3HG2  VAL  57          HG23      VAL  57   4.535  -3.095  10.377
  468    H    LEU  58           HN       LEU  58   6.705  -6.681   8.835
  469    HA   LEU  58           HA       LEU  58   7.284  -7.329   6.080
  470   1HB   LEU  58          HB1       LEU  58   8.014  -8.824   7.908
  471   2HB   LEU  58          HB2       LEU  58   6.331  -9.124   8.321
  472    HG   LEU  58           HG       LEU  58   6.042  -9.975   5.912
  473   1HD1  LEU  58          HD11      LEU  58   8.093 -10.759   4.813
  474   2HD1  LEU  58          HD12      LEU  58   9.060 -10.015   6.086
  475   3HD1  LEU  58          HD13      LEU  58   8.100  -9.005   5.005
  476   1HD2  LEU  58          HD21      LEU  58   6.183 -11.524   7.848
  477   2HD2  LEU  58          HD22      LEU  58   7.936 -11.554   7.666
  478   3HD2  LEU  58          HD23      LEU  58   6.907 -12.196   6.387
  479    H    TRP  59           HN       TRP  59   5.820  -6.558   4.718
  480    HA   TRP  59           HA       TRP  59   3.093  -6.154   5.183
  481   1HB   TRP  59          HB1       TRP  59   4.552  -6.545   2.570
  482   2HB   TRP  59          HB2       TRP  59   2.934  -5.890   2.734
  483    HD1  TRP  59           HD1      TRP  59   6.252  -4.770   2.100
  484    HE1  TRP  59           HE1      TRP  59   6.575  -2.290   2.731
  485    HE3  TRP  59           HE3      TRP  59   2.040  -4.018   4.902
  486    HZ2  TRP  59           HZ2      TRP  59   5.314  -0.298   4.350
  487    HZ3  TRP  59           HZ3      TRP  59   1.616  -1.823   5.941
  488    HH2  TRP  59           HH2      TRP  59   3.219   0.035   5.680
  489    H    ASP  60           HN       ASP  60   1.678  -7.619   5.593
  490    HA   ASP  60           HA       ASP  60   1.506 -10.183   4.192
  491   1HB   ASP  60          HB1       ASP  60   1.887 -11.120   6.190
  492   2HB   ASP  60          HB2       ASP  60   1.820  -9.562   6.993
  493    H    GLU  61           HN       GLU  61  -0.934 -11.022   4.975
  494    HA   GLU  61           HA       GLU  61  -2.707  -9.521   3.348
  495   1HB   GLU  61          HB1       GLU  61  -2.669 -12.106   4.045
  496   2HB   GLU  61          HB2       GLU  61  -3.810 -11.534   5.257
  497   1HG   GLU  61          HG1       GLU  61  -5.337 -11.950   3.643
  498   2HG   GLU  61          HG2       GLU  61  -4.842 -10.364   3.045
  499    H    ASN  62           HN       ASN  62  -2.693 -10.095   6.885
  500    HA   ASN  62           HA       ASN  62  -4.701  -8.108   7.376
  501   1HB   ASN  62          HB1       ASN  62  -4.576 -10.103   8.732
  502   2HB   ASN  62          HB2       ASN  62  -2.929  -9.731   9.211
  503   1HD2  ASN  62          HD21      ASN  62  -2.590  -7.984  10.665
  504   2HD2  ASN  62          HD22      ASN  62  -3.873  -7.419  11.675
  505    H    ASN  63           HN       ASN  63  -1.138  -8.199   7.912
  506    HA   ASN  63           HA       ASN  63  -0.776  -5.760   9.118
  507   1HB   ASN  63          HB1       ASN  63   1.000  -7.325   8.937
  508   2HB   ASN  63          HB2       ASN  63   0.961  -7.283   7.186
  509   1HD2  ASN  63          HD21      ASN  63   1.849  -5.358  10.056
  510   2HD2  ASN  63          HD22      ASN  63   2.751  -4.273   9.057
  511    H    MET  64           HN       MET  64  -1.144  -6.177   5.541
  512    HA   MET  64           HA       MET  64  -0.537  -3.578   4.787
  513   1HB   MET  64          HB1       MET  64  -0.870  -5.276   3.144
  514   2HB   MET  64          HB2       MET  64  -2.541  -5.510   3.636
  515   1HG   MET  64          HG1       MET  64  -2.161  -2.779   2.916
  516   2HG   MET  64          HG2       MET  64  -1.503  -3.791   1.645
  517   1HE   MET  64          HE1       MET  64  -3.015  -5.600   0.261
  518   2HE   MET  64          HE2       MET  64  -4.693  -5.933   0.692
  519   3HE   MET  64          HE3       MET  64  -3.399  -6.314   1.829
  520    H    SER  65           HN       SER  65  -3.611  -4.724   6.172
  521    HA   SER  65           HA       SER  65  -4.990  -2.252   5.913
  522   1HB   SER  65          HB1       SER  65  -5.561  -4.515   7.829
  523   2HB   SER  65          HB2       SER  65  -6.663  -3.216   7.395
  524    HG   SER  65           HG       SER  65  -5.881  -5.462   5.950
  525    H    GLU  66           HN       GLU  66  -3.030  -3.608   8.532
  526    HA   GLU  66           HA       GLU  66  -3.541  -1.943  10.635
  527   1HB   GLU  66          HB1       GLU  66  -0.838  -2.955   9.704
  528   2HB   GLU  66          HB2       GLU  66  -1.208  -2.386  11.330
  529   1HG   GLU  66          HG1       GLU  66  -2.720  -4.210  11.704
  530   2HG   GLU  66          HG2       GLU  66  -2.601  -4.718  10.019
  531    H    TYR  67           HN       TYR  67  -1.007  -1.342   8.216
  532    HA   TYR  67           HA       TYR  67  -0.433   1.330   8.869
  533   1HB   TYR  67          HB1       TYR  67   1.217   0.067   7.787
  534   2HB   TYR  67          HB2       TYR  67   0.121  -0.448   6.519
  535    HD1  TYR  67           HD1      TYR  67  -0.073   0.777   4.484
  536    HD2  TYR  67           HD2      TYR  67   2.037   2.441   7.835
  537    HE1  TYR  67           HE1      TYR  67   0.941   2.489   2.987
  538    HE2  TYR  67           HE2      TYR  67   3.102   4.126   6.350
  539    HH   TYR  67           HH       TYR  67   2.164   4.513   3.000
  540    H    LEU  68           HN       LEU  68  -2.672   0.000   6.372
  541    HA   LEU  68           HA       LEU  68  -3.179   2.439   5.093
  542   1HB   LEU  68          HB1       LEU  68  -4.799  -0.064   5.390
  543   2HB   LEU  68          HB2       LEU  68  -5.418   1.323   4.512
  544    HG   LEU  68           HG       LEU  68  -3.067  -0.426   3.810
  545   1HD1  LEU  68          HD11      LEU  68  -5.508   0.529   2.295
  546   2HD1  LEU  68          HD12      LEU  68  -5.389  -1.015   3.140
  547   3HD1  LEU  68          HD13      LEU  68  -4.345  -0.683   1.757
  548   1HD2  LEU  68          HD21      LEU  68  -3.778   2.217   2.496
  549   2HD2  LEU  68          HD22      LEU  68  -2.540   1.081   1.961
  550   3HD2  LEU  68          HD23      LEU  68  -2.344   1.943   3.486
  551    H    THR  69           HN       THR  69  -4.782   1.135   8.015
  552    HA   THR  69           HA       THR  69  -6.876   2.992   8.156
  553    HB   THR  69           HB       THR  69  -5.626   1.981  10.666
  554    HG1  THR  69           HG1      THR  69  -5.586   0.187   9.348
  555   1HG2  THR  69          HG21      THR  69  -8.473   2.267   9.682
  556   2HG2  THR  69          HG22      THR  69  -7.684   3.232  10.929
  557   3HG2  THR  69          HG23      THR  69  -8.019   1.525  11.216
  558    H    ASN  70           HN       ASN  70  -3.516   3.315   9.227
  559    HA   ASN  70           HA       ASN  70  -3.748   6.160   9.300
  560   1HB   ASN  70          HB1       ASN  70  -4.655   5.371  11.562
  561   2HB   ASN  70          HB2       ASN  70  -2.998   4.914  11.943
  562   1HD2  ASN  70          HD21      ASN  70  -4.693   6.948  13.210
  563   2HD2  ASN  70          HD22      ASN  70  -3.611   8.293  13.161
  564    HA   PRO  71           HA       PRO  71   0.414   4.663   7.950
  565   1HB   PRO  71          HB1       PRO  71   0.831   6.875   6.358
  566   2HB   PRO  71          HB2       PRO  71   0.079   5.373   5.813
  567   1HG   PRO  71          HG1       PRO  71  -1.202   7.935   6.666
  568   2HG   PRO  71          HG2       PRO  71  -1.641   6.850   5.334
  569   1HD   PRO  71          HD1       PRO  71  -3.009   6.873   7.647
  570   2HD   PRO  71          HD2       PRO  71  -2.744   5.372   6.734
  571    H    LYS  72           HN       LYS  72  -0.528   7.947   8.922
  572    HA   LYS  72           HA       LYS  72   2.026   8.911   9.609
  573   1HB   LYS  72          HB1       LYS  72  -0.343  10.111   9.312
  574   2HB   LYS  72          HB2       LYS  72  -0.346   9.959  11.061
  575   1HG   LYS  72          HG1       LYS  72   1.883  11.125  11.069
  576   2HG   LYS  72          HG2       LYS  72   1.650  11.433   9.353
  577   1HD   LYS  72          HD1       LYS  72   1.017  13.387  10.651
  578   2HD   LYS  72          HD2       LYS  72  -0.411  12.692   9.883
  579   1HE   LYS  72          HE1       LYS  72   0.177  11.674  12.581
  580   2HE   LYS  72          HE2       LYS  72  -0.234  13.381  12.515
  581   1HZ   LYS  72          HZ1       LYS  72  -2.286  12.744  11.332
  582   2HZ   LYS  72          HZ2       LYS  72  -2.195  12.105  12.892
  583   3HZ   LYS  72          HZ3       LYS  72  -1.885  11.111  11.564
  584    H    LYS  73           HN       LYS  73  -0.358   7.118  11.491
  585    HA   LYS  73           HA       LYS  73   1.164   7.423  13.930
  586   1HB   LYS  73          HB1       LYS  73  -1.260   7.335  14.075
  587   2HB   LYS  73          HB2       LYS  73  -1.271   5.733  13.352
  588   1HG   LYS  73          HG1       LYS  73  -1.594   5.482  15.708
  589   2HG   LYS  73          HG2       LYS  73   0.016   4.892  15.318
  590   1HD   LYS  73          HD1       LYS  73   0.558   7.487  15.954
  591   2HD   LYS  73          HD2       LYS  73  -0.817   7.167  17.008
  592   1HE   LYS  73          HE1       LYS  73   1.104   6.633  18.280
  593   2HE   LYS  73          HE2       LYS  73   0.426   5.088  17.776
  594   1HZ   LYS  73          HZ1       LYS  73   2.821   6.461  16.725
  595   2HZ   LYS  73          HZ2       LYS  73   2.073   5.201  15.885
  596   3HZ   LYS  73          HZ3       LYS  73   2.712   4.921  17.424
  597    H    TYR  74           HN       TYR  74   0.701   4.848  11.541
  598    HA   TYR  74           HA       TYR  74   2.196   2.862  12.900
  599   1HB   TYR  74          HB1       TYR  74   0.509   2.742  10.891
  600   2HB   TYR  74          HB2       TYR  74   1.975   2.913   9.923
  601    HD1  TYR  74           HD1      TYR  74   3.382   1.009   9.513
  602    HD2  TYR  74           HD2      TYR  74   0.427   0.943  12.635
  603    HE1  TYR  74           HE1      TYR  74   3.766  -1.439   9.823
  604    HE2  TYR  74           HE2      TYR  74   0.792  -1.489  12.951
  605    HH   TYR  74           HH       TYR  74   1.593  -3.409  11.567
  606    H    ILE  75           HN       ILE  75   3.111   5.215  10.449
  607    HA   ILE  75           HA       ILE  75   5.954   4.775  11.012
  608    HB   ILE  75           HB       ILE  75   4.797   5.223   8.248
  609   1HG1  ILE  75          HG11      ILE  75   6.032   2.754   9.520
  610   2HG1  ILE  75          HG12      ILE  75   4.390   2.911   8.914
  611   1HG2  ILE  75          HG21      ILE  75   6.979   6.303   8.630
  612   2HG2  ILE  75          HG22      ILE  75   7.125   4.959   7.498
  613   3HG2  ILE  75          HG23      ILE  75   7.649   4.762   9.169
  614   1HD1  ILE  75          HD11      ILE  75   5.205   3.016   6.629
  615   2HD1  ILE  75          HD12      ILE  75   5.852   1.583   7.427
  616   3HD1  ILE  75          HD13      ILE  75   6.876   2.999   7.195
  617    HA   PRO  76           HA       PRO  76   4.825   9.150  11.860
  618   1HB   PRO  76          HB1       PRO  76   6.737   9.478  13.773
  619   2HB   PRO  76          HB2       PRO  76   5.138   8.802  14.101
  620   1HG   PRO  76          HG1       PRO  76   7.743   7.394  13.682
  621   2HG   PRO  76          HG2       PRO  76   6.463   7.056  14.862
  622   1HD   PRO  76          HD1       PRO  76   6.769   5.620  12.586
  623   2HD   PRO  76          HD2       PRO  76   5.184   5.906  13.331
  624    H    GLY  77           HN       GLY  77   5.551  10.147  10.016
  625   1HA   GLY  77          HA1       GLY  77   7.195  11.846   9.387
  626   2HA   GLY  77          HA2       GLY  77   8.444  10.690   9.805
  627    H    THR  78           HN       THR  78   5.968   9.070   8.198
  628    HA   THR  78           HA       THR  78   7.492   8.578   5.843
  629    HB   THR  78           HB       THR  78   5.605   7.209   7.188
  630    HG1  THR  78           HG1      THR  78   7.040   6.861   4.994
  631   1HG2  THR  78          HG21      THR  78   3.702   6.748   5.737
  632   2HG2  THR  78          HG22      THR  78   4.199   8.045   4.650
  633   3HG2  THR  78          HG23      THR  78   3.679   8.422   6.293
  634    H    LYS  79           HN       LYS  79   6.960   8.955   3.677
  635    HA   LYS  79           HA       LYS  79   5.896  11.572   3.128
  636   1HB   LYS  79          HB1       LYS  79   6.708   9.463   1.132
  637   2HB   LYS  79          HB2       LYS  79   6.623  11.198   0.877
  638   1HG   LYS  79          HG1       LYS  79   8.490  11.430   2.565
  639   2HG   LYS  79          HG2       LYS  79   8.652   9.668   2.498
  640   1HD   LYS  79          HD1       LYS  79   8.523  10.497  -0.183
  641   2HD   LYS  79          HD2       LYS  79   9.591  11.661   0.610
  642   1HE   LYS  79          HE1       LYS  79  11.060   9.959  -0.025
  643   2HE   LYS  79          HE2       LYS  79  10.710   9.574   1.660
  644   1HZ   LYS  79          HZ1       LYS  79   9.404   7.794   1.074
  645   2HZ   LYS  79          HZ2       LYS  79  10.592   7.731  -0.125
  646   3HZ   LYS  79          HZ3       LYS  79   9.080   8.390  -0.480
  647    H    MET  80           HN       MET  80   4.216   8.668   3.533
  648    HA   MET  80           HA       MET  80   2.369   9.057   1.357
  649   1HB   MET  80          HB1       MET  80   2.672   6.803   1.694
  650   2HB   MET  80          HB2       MET  80   2.712   6.958   3.454
  651   1HG   MET  80          HG1       MET  80   0.434   7.082   3.646
  652   2HG   MET  80          HG2       MET  80   0.216   7.694   2.018
  653   1HE   MET  80          HE1       MET  80  -1.962   6.175   2.207
  654   2HE   MET  80          HE2       MET  80  -1.497   5.343   3.691
  655   3HE   MET  80          HE3       MET  80  -1.944   4.412   2.263
  656    H    ALA  81           HN       ALA  81   1.655  11.110   1.783
  657    HA   ALA  81           HA       ALA  81   0.117  11.728   4.129
  658   1HB   ALA  81          HB1       ALA  81   0.117  13.976   3.330
  659   2HB   ALA  81          HB2       ALA  81   0.680  13.461   1.741
  660   3HB   ALA  81          HB3       ALA  81   1.735  13.296   3.143
  661    H    PHE  82           HN       PHE  82  -1.163   9.780   2.907
  662    HA   PHE  82           HA       PHE  82  -3.472  10.634   1.429
  663   1HB   PHE  82          HB1       PHE  82  -2.514   8.680   0.592
  664   2HB   PHE  82          HB2       PHE  82  -2.329   7.970   2.191
  665    HD1  PHE  82           HD1      PHE  82  -4.868   8.933  -0.376
  666    HD2  PHE  82           HD2      PHE  82  -3.980   6.556   3.099
  667    HE1  PHE  82           HE1      PHE  82  -7.078   7.806  -0.580
  668    HE2  PHE  82           HE2      PHE  82  -6.191   5.441   2.904
  669    HZ   PHE  82           HZ       PHE  82  -7.749   6.081   1.077
  670    H    GLY  83           HN       GLY  83  -2.829  10.349   4.777
  671   1HA   GLY  83          HA1       GLY  83  -4.345  10.890   6.482
  672   2HA   GLY  83          HA2       GLY  83  -5.665  10.678   5.353
  673    H    GLY  84           HN       GLY  84  -5.390   8.049   4.576
  674   1HA   GLY  84          HA1       GLY  84  -5.066   5.809   5.386
  675   2HA   GLY  84          HA2       GLY  84  -5.314   6.403   7.017
  676    H    LEU  85           HN       LEU  85  -6.660   4.469   4.880
  677    HA   LEU  85           HA       LEU  85  -9.435   5.241   4.964
  678   1HB   LEU  85          HB1       LEU  85  -7.951   2.868   3.866
  679   2HB   LEU  85          HB2       LEU  85  -9.699   2.877   3.963
  680    HG   LEU  85           HG       LEU  85  -8.008   4.816   2.361
  681   1HD1  LEU  85          HD11      LEU  85  -8.040   2.620   1.359
  682   2HD1  LEU  85          HD12      LEU  85  -9.131   3.664   0.447
  683   3HD1  LEU  85          HD13      LEU  85  -9.784   2.491   1.591
  684   1HD2  LEU  85          HD21      LEU  85 -11.023   4.533   2.494
  685   2HD2  LEU  85          HD22      LEU  85 -10.132   5.565   1.375
  686   3HD2  LEU  85          HD23      LEU  85 -10.092   5.901   3.106
  687    H    LYS  86           HN       LYS  86 -10.056   5.323   6.982
  688    HA   LYS  86           HA       LYS  86  -9.559   3.600   9.125
  689   1HB   LYS  86          HB1       LYS  86 -11.928   5.449   8.894
  690   2HB   LYS  86          HB2       LYS  86 -11.064   4.966  10.347
  691   1HG   LYS  86          HG1       LYS  86  -9.568   6.441   8.220
  692   2HG   LYS  86          HG2       LYS  86 -10.672   7.337   9.267
  693   1HD   LYS  86          HD1       LYS  86  -9.478   6.557  11.245
  694   2HD   LYS  86          HD2       LYS  86  -8.422   5.560  10.247
  695   1HE   LYS  86          HE1       LYS  86  -8.600   8.569  10.021
  696   2HE   LYS  86          HE2       LYS  86  -7.412   7.733  11.018
  697   1HZ   LYS  86          HZ1       LYS  86  -7.705   7.491   8.073
  698   2HZ   LYS  86          HZ2       LYS  86  -6.592   6.634   9.013
  699   3HZ   LYS  86          HZ3       LYS  86  -6.473   8.315   8.896
  700    H    LYS  87           HN       LYS  87 -12.014   3.412   6.662
  701    HA   LYS  87           HA       LYS  87 -13.840   1.682   8.045
  702   1HB   LYS  87          HB1       LYS  87 -13.503   2.262   5.110
  703   2HB   LYS  87          HB2       LYS  87 -14.840   1.392   5.812
  704   1HG   LYS  87          HG1       LYS  87 -15.436   3.602   7.010
  705   2HG   LYS  87          HG2       LYS  87 -14.301   4.358   5.850
  706   1HD   LYS  87          HD1       LYS  87 -15.527   2.537   4.294
  707   2HD   LYS  87          HD2       LYS  87 -16.830   2.899   5.374
  708   1HE   LYS  87          HE1       LYS  87 -17.191   4.971   4.392
  709   2HE   LYS  87          HE2       LYS  87 -15.562   5.022   3.682
  710   1HZ   LYS  87          HZ1       LYS  87 -17.640   3.004   3.004
  711   2HZ   LYS  87          HZ2       LYS  87 -16.106   3.114   2.311
  712   3HZ   LYS  87          HZ3       LYS  87 -17.246   4.339   2.034
  713    H    GLU  88           HN       GLU  88 -13.174  -0.337   8.556
  714    HA   GLU  88           HA       GLU  88 -11.290  -1.943   7.299
  715   1HB   GLU  88          HB1       GLU  88 -12.306  -2.152   9.610
  716   2HB   GLU  88          HB2       GLU  88 -13.657  -2.979   8.838
  717   1HG   GLU  88          HG1       GLU  88 -11.821  -4.519   7.815
  718   2HG   GLU  88          HG2       GLU  88 -10.809  -3.881   9.119
  719    H    LYS  89           HN       LYS  89 -14.838  -2.038   6.783
  720    HA   LYS  89           HA       LYS  89 -14.945  -4.286   5.158
  721   1HB   LYS  89          HB1       LYS  89 -16.790  -1.969   4.701
  722   2HB   LYS  89          HB2       LYS  89 -17.145  -3.695   4.724
  723   1HG   LYS  89          HG1       LYS  89 -16.178  -2.351   7.215
  724   2HG   LYS  89          HG2       LYS  89 -17.861  -2.187   6.735
  725   1HD   LYS  89          HD1       LYS  89 -17.899  -4.014   8.195
  726   2HD   LYS  89          HD2       LYS  89 -17.815  -4.792   6.606
  727   1HE   LYS  89          HE1       LYS  89 -15.608  -5.411   6.865
  728   2HE   LYS  89          HE2       LYS  89 -15.253  -4.080   7.965
  729   1HZ   LYS  89          HZ1       LYS  89 -15.225  -5.896   9.349
  730   2HZ   LYS  89          HZ2       LYS  89 -16.487  -6.685   8.547
  731   3HZ   LYS  89          HZ3       LYS  89 -16.822  -5.361   9.542
  732    H    ASP  90           HN       ASP  90 -14.368  -0.982   4.333
  733    HA   ASP  90           HA       ASP  90 -14.247  -1.081   1.562
  734   1HB   ASP  90          HB1       ASP  90 -13.377   0.725   3.765
  735   2HB   ASP  90          HB2       ASP  90 -12.741   1.035   2.160
  736    H    ARG  91           HN       ARG  91 -11.572  -1.429   3.987
  737    HA   ARG  91           HA       ARG  91  -9.585  -1.847   1.966
  738   1HB   ARG  91          HB1       ARG  91  -9.314  -2.671   4.864
  739   2HB   ARG  91          HB2       ARG  91  -8.016  -2.444   3.698
  740   1HG   ARG  91          HG1       ARG  91  -8.457  -0.071   3.603
  741   2HG   ARG  91          HG2       ARG  91  -9.855  -0.252   4.649
  742   1HD   ARG  91          HD1       ARG  91  -6.942  -0.548   5.369
  743   2HD   ARG  91          HD2       ARG  91  -8.078   0.658   5.952
  744    HE   ARG  91           HE       ARG  91  -7.797  -1.815   6.159
  745   1HH1  ARG  91          HH21      ARG  91  -9.096   1.034   7.666
  746   2HH1  ARG  91          HH22      ARG  91  -9.780   0.413   9.129
  747   1HH2  ARG  91          HH11      ARG  91  -8.848  -2.842   8.556
  748   2HH2  ARG  91          HH12      ARG  91  -9.658  -1.751   9.623
  749    H    ASN  92           HN       ASN  92 -11.571  -4.079   3.875
  750    HA   ASN  92           HA       ASN  92 -10.464  -6.496   3.401
  751   1HB   ASN  92          HB1       ASN  92 -13.349  -5.651   3.413
  752   2HB   ASN  92          HB2       ASN  92 -12.898  -7.336   3.203
  753   1HD2  ASN  92          HD21      ASN  92 -14.467  -6.575   5.290
  754   2HD2  ASN  92          HD22      ASN  92 -13.516  -6.962   6.681
  755    H    ASP  93           HN       ASP  93 -12.708  -4.970   1.040
  756    HA   ASP  93           HA       ASP  93 -12.291  -6.819  -1.033
  757   1HB   ASP  93          HB1       ASP  93 -13.997  -4.739  -0.660
  758   2HB   ASP  93          HB2       ASP  93 -12.903  -4.047  -1.847
  759    H    LEU  94           HN       LEU  94 -10.525  -3.751  -0.337
  760    HA   LEU  94           HA       LEU  94  -8.953  -3.552  -2.563
  761   1HB   LEU  94          HB1       LEU  94  -8.959  -2.547   0.183
  762   2HB   LEU  94          HB2       LEU  94  -7.382  -2.674  -0.504
  763    HG   LEU  94           HG       LEU  94  -9.582  -1.271  -1.986
  764   1HD1  LEU  94          HD11      LEU  94  -9.305  -0.340   0.322
  765   2HD1  LEU  94          HD12      LEU  94  -8.945   0.806  -0.972
  766   3HD1  LEU  94          HD13      LEU  94  -7.629   0.034  -0.089
  767   1HD2  LEU  94          HD21      LEU  94  -7.826  -0.007  -3.054
  768   2HD2  LEU  94          HD22      LEU  94  -7.468  -1.723  -3.238
  769   3HD2  LEU  94          HD23      LEU  94  -6.600  -0.766  -2.040
  770    H    ILE  95           HN       ILE  95  -8.456  -5.664   0.232
  771    HA   ILE  95           HA       ILE  95  -5.855  -6.557  -0.322
  772    HB   ILE  95           HB       ILE  95  -8.079  -8.053   1.084
  773   1HG1  ILE  95          HG11      ILE  95  -5.949  -6.267   2.303
  774   2HG1  ILE  95          HG12      ILE  95  -7.589  -5.724   1.959
  775   1HG2  ILE  95          HG21      ILE  95  -6.266  -9.573   0.646
  776   2HG2  ILE  95          HG22      ILE  95  -6.177  -9.108   2.345
  777   3HG2  ILE  95          HG23      ILE  95  -5.073  -8.385   1.175
  778   1HD1  ILE  95          HD11      ILE  95  -8.510  -7.258   3.552
  779   2HD1  ILE  95          HD12      ILE  95  -7.184  -6.399   4.338
  780   3HD1  ILE  95          HD13      ILE  95  -6.950  -8.052   3.771
  781    H    THR  96           HN       THR  96  -8.998  -8.063  -1.189
  782    HA   THR  96           HA       THR  96  -8.084 -10.210  -2.672
  783    HB   THR  96           HB       THR  96 -10.482  -8.876  -3.781
  784    HG1  THR  96           HG1      THR  96 -10.867  -8.361  -1.657
  785   1HG2  THR  96          HG21      THR  96  -9.807 -11.232  -4.289
  786   2HG2  THR  96          HG22      THR  96 -11.419 -11.095  -3.585
  787   3HG2  THR  96          HG23      THR  96 -10.063 -11.623  -2.588
  788    H    TYR  97           HN       TYR  97  -8.627  -6.870  -3.864
  789    HA   TYR  97           HA       TYR  97  -7.922  -7.450  -6.546
  790   1HB   TYR  97          HB1       TYR  97  -9.211  -5.489  -6.100
  791   2HB   TYR  97          HB2       TYR  97  -7.970  -4.846  -5.032
  792    HD1  TYR  97           HD1      TYR  97  -6.637  -3.158  -5.848
  793    HD2  TYR  97           HD2      TYR  97  -8.271  -6.034  -8.595
  794    HE1  TYR  97           HE1      TYR  97  -5.589  -1.936  -7.743
  795    HE2  TYR  97           HE2      TYR  97  -7.330  -4.754 -10.509
  796    HH   TYR  97           HH       TYR  97  -5.005  -2.846 -10.489
  797    H    LEU  98           HN       LEU  98  -5.959  -5.869  -3.982
  798    HA   LEU  98           HA       LEU  98  -3.575  -5.643  -5.423
  799   1HB   LEU  98          HB1       LEU  98  -4.429  -4.904  -2.950
  800   2HB   LEU  98          HB2       LEU  98  -3.337  -6.223  -2.535
  801    HG   LEU  98           HG       LEU  98  -1.522  -5.128  -3.829
  802   1HD1  LEU  98          HD11      LEU  98  -2.860  -3.909  -5.460
  803   2HD1  LEU  98          HD12      LEU  98  -1.850  -2.780  -4.556
  804   3HD1  LEU  98          HD13      LEU  98  -3.567  -2.925  -4.178
  805   1HD2  LEU  98          HD21      LEU  98  -1.702  -4.644  -1.439
  806   2HD2  LEU  98          HD22      LEU  98  -2.840  -3.340  -1.777
  807   3HD2  LEU  98          HD23      LEU  98  -1.168  -3.213  -2.321
  808    H    LYS  99           HN       LYS  99  -4.654  -8.179  -3.236
  809    HA   LYS  99           HA       LYS  99  -2.441  -9.866  -3.342
  810   1HB   LYS  99          HB1       LYS  99  -3.703 -10.627  -1.650
  811   2HB   LYS  99          HB2       LYS  99  -5.185  -9.998  -2.349
  812   1HG   LYS  99          HG1       LYS  99  -5.378 -11.979  -3.763
  813   2HG   LYS  99          HG2       LYS  99  -3.865 -12.601  -3.133
  814   1HD   LYS  99          HD1       LYS  99  -5.790 -12.076  -1.011
  815   2HD   LYS  99          HD2       LYS  99  -6.424 -13.194  -2.222
  816   1HE   LYS  99          HE1       LYS  99  -5.242 -14.344  -0.387
  817   2HE   LYS  99          HE2       LYS  99  -4.518 -14.641  -1.961
  818   1HZ   LYS  99          HZ1       LYS  99  -3.302 -13.674   0.341
  819   2HZ   LYS  99          HZ2       LYS  99  -3.262 -12.426  -0.803
  820   3HZ   LYS  99          HZ3       LYS  99  -2.616 -13.942  -1.194
  821    H    LYS 100           HN       LYS 100  -5.208  -9.624  -5.556
  822    HA   LYS 100           HA       LYS 100  -4.559 -11.941  -7.069
  823   1HB   LYS 100          HB1       LYS 100  -6.769 -10.345  -6.811
  824   2HB   LYS 100          HB2       LYS 100  -6.255 -10.047  -8.453
  825   1HG   LYS 100          HG1       LYS 100  -8.002 -11.824  -8.217
  826   2HG   LYS 100          HG2       LYS 100  -6.539 -12.372  -9.040
  827   1HD   LYS 100          HD1       LYS 100  -6.684 -12.686  -6.109
  828   2HD   LYS 100          HD2       LYS 100  -7.738 -13.700  -7.044
  829   1HE   LYS 100          HE1       LYS 100  -6.021 -15.125  -6.650
  830   2HE   LYS 100          HE2       LYS 100  -5.428 -14.410  -8.158
  831   1HZ   LYS 100          HZ1       LYS 100  -3.686 -13.545  -7.075
  832   2HZ   LYS 100          HZ2       LYS 100  -4.167 -14.379  -5.685
  833   3HZ   LYS 100          HZ3       LYS 100  -4.700 -12.793  -5.940
  834    H    ALA 101           HN       ALA 101  -3.680  -8.705  -7.396
  835    HA   ALA 101           HA       ALA 101  -2.522  -8.721  -9.993
  836   1HB   ALA 101          HB1       ALA 101  -2.368  -6.699  -7.754
  837   2HB   ALA 101          HB2       ALA 101  -3.604  -6.753  -9.010
  838   3HB   ALA 101          HB3       ALA 101  -1.925  -6.423  -9.439
  839    H    THR 102           HN       THR 102  -1.240  -9.030  -6.704
  840    HA   THR 102           HA       THR 102   1.536  -9.084  -7.470
  841    HB   THR 102           HB       THR 102   0.267  -9.720  -4.802
  842    HG1  THR 102           HG1      THR 102   0.160  -7.476  -5.771
  843   1HG2  THR 102          HG21      THR 102   2.538 -10.647  -5.013
  844   2HG2  THR 102          HG22      THR 102   2.489  -9.306  -3.868
  845   3HG2  THR 102          HG23      THR 102   3.137  -9.058  -5.489
  846    H    GLU 103           HN       GLU 103  -0.923 -11.501  -6.542
  847    HA   GLU 103           HA       GLU 103   0.931 -13.595  -7.481
  848   1HB   GLU 103          HB1       GLU 103  -0.590 -15.029  -5.769
  849   2HB   GLU 103          HB2       GLU 103   0.951 -14.311  -5.332
  850   1HG   GLU 103          HG1       GLU 103   0.002 -13.028  -3.803
  851   2HG   GLU 103          HG2       GLU 103  -1.180 -12.420  -4.958
  852    HHA  HEC 104           HA       HEC 104   5.258   3.394   1.384
  853    HHB  HEC 104           HB       HEC 104  -0.456   0.531   0.225
  854    HHC  HEC 104           HC       HEC 104  -2.927   6.268  -1.505
  855    HHD  HEC 104           HD       HEC 104   3.039   8.745  -1.525
  856   1HMA  HEC 104          HMA1      HEC 104   1.321  -0.845   2.078
  857   2HMA  HEC 104          HMA2      HEC 104   2.835  -1.253   1.267
  858   3HMA  HEC 104          HMA3      HEC 104   1.348  -1.093   0.332
  859   1HAA  HEC 104          HAA1      HEC 104   4.382  -0.241   2.154
  860   2HAA  HEC 104          HAA2      HEC 104   5.080   1.333   2.492
  861   1HBA  HEC 104          HBA1      HEC 104   5.947   1.415   0.166
  862   2HBA  HEC 104          HBA2      HEC 104   5.307  -0.199  -0.104
  863   1HMB  HEC 104          HMB1      HEC 104  -2.339   0.223  -0.393
  864   2HMB  HEC 104          HMB2      HEC 104  -3.253   0.796  -1.788
  865   3HMB  HEC 104          HMB3      HEC 104  -3.915   0.983  -0.165
  866    HAB  HEC 104           HAB      HEC 104  -4.347   4.955  -1.519
  867   1HBB  HEC 104          HBB1      HEC 104  -4.692   3.797   0.799
  868   2HBB  HEC 104          HBB2      HEC 104  -5.701   2.712  -0.158
  869   3HBB  HEC 104          HBB3      HEC 104  -6.035   4.444  -0.143
  870   1HMC  HEC 104          HMC1      HEC 104  -2.954   8.831  -1.733
  871   2HMC  HEC 104          HMC2      HEC 104  -2.623   8.061  -3.285
  872   3HMC  HEC 104          HMC3      HEC 104  -1.997   9.675  -2.950
  873    HAC  HEC 104           HAC      HEC 104   1.853   9.775  -2.829
  874   1HBC  HEC 104          HBC1      HEC 104   1.075  11.216  -1.194
  875   2HBC  HEC 104          HBC2      HEC 104  -0.586  11.149  -1.783
  876   3HBC  HEC 104          HBC3      HEC 104   0.654  11.972  -2.731
  877   1HMD  HEC 104          HMD1      HEC 104   5.176   9.144  -0.623
  878   2HMD  HEC 104          HMD2      HEC 104   5.617   8.118  -1.988
  879   3HMD  HEC 104          HMD3      HEC 104   6.638   8.159  -0.550
  880   1HAD  HEC 104          HAD1      HEC 104   7.421   6.299   0.277
  881   2HAD  HEC 104          HAD2      HEC 104   6.951   4.780   1.033
  882   1HBD  HEC 104          HBD1      HEC 104   6.444   5.787   3.057
  883   2HBD  HEC 104          HBD2      HEC 104   6.141   7.348   2.326
  884    H2   4NL 105           H2       4NL 105   0.580 -13.286  -1.455
  885    H6   4NL 105           H6       4NL 105   3.011 -12.601   2.971
  886    H3   4NL 105           H3       4NL 105  -1.542 -10.666   1.283
  887    H5   4NL 105           H5       4NL 105  -1.204 -12.061  -2.048
  888    H4   4NL 105           H4       4NL 105   0.023 -11.329   3.129
  889    H1   4NL 105           H1       4NL 105   2.145 -13.948   0.390
  890    H7   4NL 105           H7       4NL 105   1.805 -13.746   3.606