*HEADER    HYDROLASE                               10-JAN-02   1KS0              
*TITLE     THE FIRST FIBRONECTIN TYPE II MODULE FROM HUMAN MATRIX                
*TITLE    2 METALLOPROTEINASE 2                                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MATRIX METALLOPROTEINASE 2;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: FIRST FIBRONECTIN TYPE II MODULE;                          
*COMPND   5 SYNONYM: 72 KDA TYPE IV COLLAGENASE, MMP-2;                          
*COMPND   6 EC: 3.4.24.24;                                                       
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    BETA SHEET, ALPHA HELIX, 3/1 HELIX                                    
*EXPDTA    NMR, 50 STRUCTURES                                                    
*AUTHOR    M.GEHRMANN, K.BRIKNAROVA, L.BANYAI, L.PATTHY, M.LLINAS                
*REVDAT   1   20-FEB-02 1KS0    0                                                
ASSIGN (RESID   1 AND NAME HN   ) (RESID   1 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID   1 AND NAME HN   ) (RESID   1 AND NAME HB1  )    3.6   0.7   0.7
ASSIGN (RESID   1 AND NAME HN   ) (RESID   1 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID   1 AND NAME HN   ) (RESID   1 AND NAME HG*  )    3.3   0.7   0.7
ASSIGN (RESID   1 AND NAME HN   ) (RESID   2 AND NAME HG12 )    3.2   0.6   0.6
ASSIGN (RESID   1 AND NAME HA   ) (RESID   1 AND NAME HB1  )    2.7   0.5   0.5
ASSIGN (RESID   1 AND NAME HA   ) (RESID   1 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID   1 AND NAME HA   ) (RESID   1 AND NAME HG*  )    2.7   0.5   0.5
ASSIGN (RESID   1 AND NAME HA   ) (RESID   1 AND NAME HE   )    4.9   0.6   0.6
ASSIGN (RESID   1 AND NAME HG*  ) (RESID   1 AND NAME HD*  )    2.6   0.5   0.5
ASSIGN (RESID   1 AND NAME HG*  ) (RESID   1 AND NAME HE   )    2.9   0.6   0.6
ASSIGN (RESID   1 AND NAME HG*  ) (RESID  13 AND NAME HE*  )    5.5   0.8   0.8
ASSIGN (RESID   1 AND NAME HD*  ) (RESID   1 AND NAME HE   )    2.6   0.5   0.5
ASSIGN (RESID   1 AND NAME HE   ) (RESID  13 AND NAME HA   )    4.1   0.5   0.5
ASSIGN (RESID   1 AND NAME HE   ) (RESID  13 AND NAME HB1  )    4.5   0.4   0.4
ASSIGN (RESID   1 AND NAME HE   ) (RESID  13 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID   2 AND NAME HN   ) (RESID   2 AND NAME HA   )    2.3   0.5   0.5
ASSIGN (RESID   2 AND NAME HN   ) (RESID   2 AND NAME HB   )    3.6   0.4   0.4
ASSIGN (RESID   2 AND NAME HN   ) (RESID   2 AND NAME HG2* )    4.2   0.8   0.8
ASSIGN (RESID   2 AND NAME HN   ) (RESID   2 AND NAME HG21 )    3.2   0.6   0.6
ASSIGN (RESID   2 AND NAME HA   ) (RESID   2 AND NAME HB   )    2.4   0.5   0.5
ASSIGN (RESID   2 AND NAME HA   ) (RESID   2 AND NAME HG2* )    3.7   0.5   0.5
ASSIGN (RESID   2 AND NAME HA   ) (RESID   2 AND NAME HG21 )    3.7   0.5   0.5
ASSIGN (RESID   2 AND NAME HB   ) (RESID   2 AND NAME HG21 )    3.0   0.4   0.4
ASSIGN (RESID   2 AND NAME HG21 ) (RESID   3 AND NAME HG*  )    4.6   0.9   0.9
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HB2  )    2.5   0.4   0.4
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HG*  )    3.1   0.6   0.6
ASSIGN (RESID   3 AND NAME HB1  ) (RESID   3 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID   3 AND NAME HB1  ) (RESID   3 AND NAME HD*  )    3.3   0.7   0.7
ASSIGN (RESID   3 AND NAME HG*  ) (RESID   3 AND NAME HD*  )    3.0   0.6   0.6
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HA   )    2.9   0.6   0.6
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HG1* )    4.7   0.6   0.6
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HG2* )    4.2   0.5   0.5
ASSIGN (RESID   4 AND NAME HN   ) (RESID  13 AND NAME HA   )    3.9   0.5   0.5
ASSIGN (RESID   4 AND NAME HN   ) (RESID  14 AND NAME HN   )    4.8   0.6   0.6
ASSIGN (RESID   4 AND NAME HA   ) (RESID   4 AND NAME HB   )    3.6   0.4   0.4
ASSIGN (RESID   4 AND NAME HA   ) (RESID   4 AND NAME HG1* )    2.5   0.5   0.5
ASSIGN (RESID   4 AND NAME HA   ) (RESID   4 AND NAME HG2* )    2.8   0.6   0.6
ASSIGN (RESID   4 AND NAME HA   ) (RESID   5 AND NAME HB*  )    4.0   0.7   0.7
ASSIGN (RESID   4 AND NAME HA   ) (RESID  54 AND NAME HN   )    4.7   0.6   0.6
ASSIGN (RESID   4 AND NAME HB   ) (RESID   4 AND NAME HG1* )    2.5   0.5   0.5
ASSIGN (RESID   4 AND NAME HB   ) (RESID   4 AND NAME HG2* )    2.5   0.5   0.5
ASSIGN (RESID   4 AND NAME HB   ) (RESID   5 AND NAME HN   )    3.9   0.4   0.4
ASSIGN (RESID   4 AND NAME HB   ) (RESID  53 AND NAME HA1  )    4.5   0.5   0.5
ASSIGN (RESID   4 AND NAME HB   ) (RESID  53 AND NAME HA2  )    5.7   0.5   0.5
ASSIGN (RESID   4 AND NAME HB   ) (RESID  54 AND NAME HN   )    6.0   0.5   0.5
ASSIGN (RESID   4 AND NAME HG1* ) (RESID   4 AND NAME HG2* )    2.9   0.6   0.6
ASSIGN (RESID   4 AND NAME HG1* ) (RESID   5 AND NAME HN   )    3.3   0.7   0.7
ASSIGN (RESID   4 AND NAME HG1* ) (RESID   9 AND NAME HB*  )    3.7   0.7   0.7
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  14 AND NAME HN   )    6.7   0.6   0.6
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  14 AND NAME HA   )    6.1   0.7   0.7
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  53 AND NAME HA1  )    2.8   0.7   0.7
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  53 AND NAME HA2  )    3.1   0.6   0.6
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  54 AND NAME HN   )    3.5   0.7   0.7
ASSIGN (RESID   4 AND NAME HG1* ) (RESID  54 AND NAME HA   )    4.9   0.7   0.7
ASSIGN (RESID   4 AND NAME HG2* ) (RESID   5 AND NAME HN   )    4.3   0.7   0.7
ASSIGN (RESID   4 AND NAME HG2* ) (RESID   9 AND NAME HA   )    6.5   0.7   0.7
ASSIGN (RESID   4 AND NAME HG2* ) (RESID   9 AND NAME HB*  )    5.0   0.7   0.7
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  11 AND NAME HN   )    6.5   0.6   0.6
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  13 AND NAME HA   )    3.5   0.7   0.7
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  14 AND NAME HN   )    4.2   0.8   0.8
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  53 AND NAME HA1  )    5.1   0.6   0.6
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  53 AND NAME HA2  )    5.5   0.6   0.6
ASSIGN (RESID   4 AND NAME HG2* ) (RESID  54 AND NAME HN   )    5.5   0.7   0.7
ASSIGN (RESID   5 AND NAME HN   ) (RESID   5 AND NAME HB*  )    2.9   0.6   0.6
ASSIGN (RESID   5 AND NAME HN   ) (RESID  54 AND NAME HN   )    2.5   0.5   0.5
ASSIGN (RESID   5 AND NAME HN   ) (RESID  54 AND NAME HD*  )    5.6   0.7   0.7
ASSIGN (RESID   5 AND NAME HA   ) (RESID   5 AND NAME HB*  )    3.0   0.6   0.6
ASSIGN (RESID   5 AND NAME HA   ) (RESID   5 AND NAME HD*  )    3.2   0.6   0.6
ASSIGN (RESID   5 AND NAME HB*  ) (RESID   5 AND NAME HG2  )    2.3   0.4   0.4
ASSIGN (RESID   5 AND NAME HB*  ) (RESID   6 AND NAME HD*  )    4.0   0.8   0.8
ASSIGN (RESID   5 AND NAME HB*  ) (RESID   6 AND NAME HE*  )    5.3   0.8   0.8
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   5 AND NAME HG2  )    2.3   0.5   0.5
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   5 AND NAME HD*  )    2.6   0.5   0.5
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   5 AND NAME HE2  )    3.0   0.6   0.6
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   6 AND NAME HD*  )    4.9   0.7   0.7
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   6 AND NAME HE*  )    3.7   0.7   0.7
ASSIGN (RESID   5 AND NAME HG2  ) (RESID   5 AND NAME HE1  )    3.3   0.7   0.7
ASSIGN (RESID   5 AND NAME HG2  ) (RESID   5 AND NAME HE2  )    3.1   0.6   0.6
ASSIGN (RESID   5 AND NAME HG2  ) (RESID   6 AND NAME HD*  )    6.0   0.7   0.7
ASSIGN (RESID   5 AND NAME HG2  ) (RESID   6 AND NAME HE*  )    5.7   0.7   0.7
ASSIGN (RESID   5 AND NAME HD*  ) (RESID   5 AND NAME HE1  )    2.6   0.5   0.5
ASSIGN (RESID   5 AND NAME HD*  ) (RESID   5 AND NAME HE2  )    3.2   0.6   0.6
ASSIGN (RESID   5 AND NAME HD*  ) (RESID   6 AND NAME HE*  )    3.7   0.7   0.7
ASSIGN (RESID   5 AND NAME HE1  ) (RESID   6 AND NAME HE*  )    6.0   0.8   0.8
ASSIGN (RESID   5 AND NAME HE2  ) (RESID   6 AND NAME HE*  )    6.0   0.8   0.8
ASSIGN (RESID   6 AND NAME HN   ) (RESID  54 AND NAME HD*  )    4.5   0.6   0.6
ASSIGN (RESID   6 AND NAME HA   ) (RESID   6 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID   6 AND NAME HA   ) (RESID   6 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID   6 AND NAME HB1  ) (RESID   6 AND NAME HB2  )    1.9   0.4   0.4
ASSIGN (RESID   6 AND NAME HB1  ) (RESID   6 AND NAME HD*  )    2.8   0.6   0.6
ASSIGN (RESID   6 AND NAME HB1  ) (RESID   7 AND NAME HN   )    2.5   0.5   0.5
ASSIGN (RESID   6 AND NAME HB2  ) (RESID   6 AND NAME HD*  )    3.0   0.6   0.6
ASSIGN (RESID   6 AND NAME HD*  ) (RESID   6 AND NAME HE*  )    2.0   0.4   0.4
ASSIGN (RESID   6 AND NAME HD*  ) (RESID   7 AND NAME HN   )    4.0   0.6   0.6
ASSIGN (RESID   6 AND NAME HD*  ) (RESID  54 AND NAME HD*  )    6.0   0.7   0.7
ASSIGN (RESID   6 AND NAME HE*  ) (RESID  54 AND NAME HD*  )    7.7   0.8   0.8
ASSIGN (RESID   7 AND NAME HN   ) (RESID   7 AND NAME HA1  )    2.5   0.5   0.5
ASSIGN (RESID   7 AND NAME HN   ) (RESID   7 AND NAME HA2  )    2.0   0.4   0.4
ASSIGN (RESID   7 AND NAME HN   ) (RESID  52 AND NAME HE*  )    6.5   0.8   0.8
ASSIGN (RESID   7 AND NAME HN   ) (RESID  54 AND NAME HD*  )    6.5   0.6   0.6
ASSIGN (RESID   7 AND NAME HN   ) (RESID  54 AND NAME HE*  )    6.5   0.6   0.6
ASSIGN (RESID   7 AND NAME HA1  ) (RESID   8 AND NAME HN   )    1.8   0.4   0.4
ASSIGN (RESID   7 AND NAME HA1  ) (RESID   9 AND NAME HN   )    4.0   0.7   0.7
ASSIGN (RESID   7 AND NAME HA1  ) (RESID  52 AND NAME HE*  )    3.3   0.6   0.6
ASSIGN (RESID   7 AND NAME HA2  ) (RESID   8 AND NAME HN   )    2.4   0.4   0.4
ASSIGN (RESID   7 AND NAME HA2  ) (RESID   9 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID   7 AND NAME HA2  ) (RESID  52 AND NAME HE*  )    4.4   0.6   0.6
ASSIGN (RESID   8 AND NAME HN   ) (RESID   8 AND NAME HA   )    2.5   0.5   0.5
ASSIGN (RESID   8 AND NAME HN   ) (RESID   8 AND NAME HB1  )    2.9   0.6   0.6
ASSIGN (RESID   8 AND NAME HN   ) (RESID   8 AND NAME HD22 )    4.0   0.7   0.7
ASSIGN (RESID   8 AND NAME HN   ) (RESID   9 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID   8 AND NAME HN   ) (RESID   9 AND NAME HB*  )    5.1   0.7   0.7
ASSIGN (RESID   8 AND NAME HN   ) (RESID  52 AND NAME HE*  )    3.5   0.7   0.7
ASSIGN (RESID   8 AND NAME HA   ) (RESID   8 AND NAME HB1  )    2.1   0.4   0.4
ASSIGN (RESID   8 AND NAME HA   ) (RESID   8 AND NAME HB2  )    2.1   0.4   0.4
ASSIGN (RESID   8 AND NAME HA   ) (RESID   9 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID   8 AND NAME HB1  ) (RESID   8 AND NAME HB2  )    1.9   0.4   0.4
ASSIGN (RESID   8 AND NAME HB1  ) (RESID   9 AND NAME HN   )    4.4   0.6   0.6
ASSIGN (RESID   8 AND NAME HB2  ) (RESID   8 AND NAME HD22 )    3.0   0.6   0.6
ASSIGN (RESID   8 AND NAME HD21 ) (RESID   9 AND NAME HA   )    6.3   0.4   0.4
ASSIGN (RESID   8 AND NAME HD22 ) (RESID   9 AND NAME HN   )    5.4   0.4   0.4
ASSIGN (RESID   8 AND NAME HD22 ) (RESID   9 AND NAME HB*  )    6.0   0.7   0.7
ASSIGN (RESID   8 AND NAME HD22 ) (RESID  51 AND NAME HA   )    2.8   0.5   0.5
ASSIGN (RESID   8 AND NAME HD22 ) (RESID  52 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID   8 AND NAME HD22 ) (RESID  52 AND NAME HD*  )    5.5   0.6   0.6
ASSIGN (RESID   8 AND NAME HD22 ) (RESID  52 AND NAME HE*  )    5.5   0.6   0.6
ASSIGN (RESID   9 AND NAME HN   ) (RESID   9 AND NAME HA   )    2.3   0.5   0.5
ASSIGN (RESID   9 AND NAME HN   ) (RESID   9 AND NAME HB*  )    2.7   0.5   0.5
ASSIGN (RESID   9 AND NAME HA   ) (RESID   9 AND NAME HB*  )    2.2   0.4   0.4
ASSIGN (RESID   9 AND NAME HB*  ) (RESID  12 AND NAME HN   )    3.9   0.8   0.8
ASSIGN (RESID   9 AND NAME HB*  ) (RESID  52 AND NAME HN   )    3.6   0.7   0.7
ASSIGN (RESID   9 AND NAME HB*  ) (RESID  53 AND NAME HA2  )    5.4   0.7   0.7
ASSIGN (RESID  10 AND NAME HA   ) (RESID  10 AND NAME HB1  )    2.9   0.6   0.6
ASSIGN (RESID  10 AND NAME HA   ) (RESID  10 AND NAME HB2  )    3.0   0.6   0.6
ASSIGN (RESID  11 AND NAME HN   ) (RESID  11 AND NAME HA1  )    2.5   0.5   0.5
ASSIGN (RESID  11 AND NAME HN   ) (RESID  11 AND NAME HA2  )    2.3   0.5   0.5
ASSIGN (RESID  11 AND NAME HN   ) (RESID  12 AND NAME HG1  )    5.4   0.6   0.6
ASSIGN (RESID  11 AND NAME HA1  ) (RESID  11 AND NAME HA2  )    1.8   0.4   0.4
ASSIGN (RESID  12 AND NAME HN   ) (RESID  12 AND NAME HA   )    2.6   0.5   0.5
ASSIGN (RESID  12 AND NAME HN   ) (RESID  12 AND NAME HB1  )    3.0   0.6   0.6
ASSIGN (RESID  12 AND NAME HA   ) (RESID  12 AND NAME HB1  )    2.8   0.6   0.6
ASSIGN (RESID  12 AND NAME HB2  ) (RESID  12 AND NAME HG2  )    2.9   0.6   0.6
ASSIGN (RESID  12 AND NAME HG1  ) (RESID  42 AND NAME HG2* )    3.5   0.7   0.7
ASSIGN (RESID  12 AND NAME HG2  ) (RESID  42 AND NAME HG2* )    3.4   0.8   0.8
ASSIGN (RESID  13 AND NAME HN   ) (RESID  13 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  13 AND NAME HN   ) (RESID  13 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID  13 AND NAME HN   ) (RESID  13 AND NAME HE*  )    4.7   0.8   0.8
ASSIGN (RESID  13 AND NAME HN   ) (RESID  14 AND NAME HN   )    4.6   0.7   0.7
ASSIGN (RESID  13 AND NAME HA   ) (RESID  13 AND NAME HB1  )    2.3   0.5   0.5
ASSIGN (RESID  13 AND NAME HA   ) (RESID  13 AND NAME HB2  )    2.8   0.5   0.5
ASSIGN (RESID  13 AND NAME HA   ) (RESID  13 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HN   )    2.1   0.4   0.4
ASSIGN (RESID  13 AND NAME HB1  ) (RESID  13 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  13 AND NAME HB1  ) (RESID  13 AND NAME HD*  )    2.3   0.5   0.5
ASSIGN (RESID  13 AND NAME HB2  ) (RESID  13 AND NAME HE*  )    3.9   0.7   0.7
ASSIGN (RESID  13 AND NAME HD*  ) (RESID  13 AND NAME HE*  )    2.1   0.4   0.4
ASSIGN (RESID  14 AND NAME HN   ) (RESID  14 AND NAME HA   )    2.4   0.4   0.4
ASSIGN (RESID  14 AND NAME HN   ) (RESID  16 AND NAME HE*  )    4.7   0.8   0.8
ASSIGN (RESID  14 AND NAME HA   ) (RESID  14 AND NAME HB2  )    2.7   0.4   0.4
ASSIGN (RESID  14 AND NAME HA   ) (RESID  15 AND NAME HN   )    1.9   0.4   0.4
ASSIGN (RESID  14 AND NAME HA   ) (RESID  42 AND NAME HA   )    3.5   0.7   0.7
ASSIGN (RESID  14 AND NAME HA   ) (RESID  42 AND NAME HG2* )    5.6   0.8   0.8
ASSIGN (RESID  15 AND NAME HN   ) (RESID  15 AND NAME HA   )    2.6   0.5   0.5
ASSIGN (RESID  15 AND NAME HN   ) (RESID  15 AND NAME HB*  )    2.4   0.5   0.5
ASSIGN (RESID  15 AND NAME HN   ) (RESID  15 AND NAME HG*  )    4.6   0.5   0.5
ASSIGN (RESID  15 AND NAME HN   ) (RESID  16 AND NAME HZ   )    5.2   0.7   0.7
ASSIGN (RESID  15 AND NAME HN   ) (RESID  18 AND NAME HB2  )    5.0   0.6   0.6
ASSIGN (RESID  15 AND NAME HN   ) (RESID  42 AND NAME HN   )    5.0   0.7   0.7
ASSIGN (RESID  15 AND NAME HA   ) (RESID  15 AND NAME HB2  )    2.6   0.5   0.5
ASSIGN (RESID  15 AND NAME HA   ) (RESID  15 AND NAME HG*  )    2.8   0.6   0.6
ASSIGN (RESID  15 AND NAME HA   ) (RESID  16 AND NAME HN   )    2.6   0.5   0.5
ASSIGN (RESID  15 AND NAME HA   ) (RESID  16 AND NAME HD*  )    4.8   0.7   0.7
ASSIGN (RESID  15 AND NAME HA   ) (RESID  42 AND NAME HA   )    5.0   0.8   0.8
ASSIGN (RESID  15 AND NAME HB*  ) (RESID  15 AND NAME HG*  )    2.3   0.5   0.5
ASSIGN (RESID  15 AND NAME HB*  ) (RESID  42 AND NAME HA   )    3.0   0.6   0.6
ASSIGN (RESID  16 AND NAME HN   ) (RESID  16 AND NAME HB1  )    3.7   0.5   0.5
ASSIGN (RESID  16 AND NAME HN   ) (RESID  18 AND NAME HN   )    5.8   0.7   0.7
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HB1  )    2.6   0.5   0.5
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HD*  )    2.6   0.4   0.4
ASSIGN (RESID  16 AND NAME HA   ) (RESID  17 AND NAME HB2  )    4.3   0.6   0.6
ASSIGN (RESID  16 AND NAME HB1  ) (RESID  16 AND NAME HD*  )    2.6   0.5   0.5
ASSIGN (RESID  16 AND NAME HB1  ) (RESID  17 AND NAME HA   )    3.3   0.7   0.7
ASSIGN (RESID  16 AND NAME HB2  ) (RESID  26 AND NAME HD21 )    6.5   0.5   0.5
ASSIGN (RESID  16 AND NAME HD*  ) (RESID  16 AND NAME HE*  )    2.2   0.4   0.4
ASSIGN (RESID  16 AND NAME HD*  ) (RESID  17 AND NAME HA   )    4.2   0.6   0.6
ASSIGN (RESID  16 AND NAME HD*  ) (RESID  26 AND NAME HA   )    3.5   0.5   0.5
ASSIGN (RESID  16 AND NAME HE*  ) (RESID  16 AND NAME HZ   )    2.0   0.5   0.5
ASSIGN (RESID  16 AND NAME HE*  ) (RESID  28 AND NAME HN   )    3.7   0.7   0.7
ASSIGN (RESID  16 AND NAME HE*  ) (RESID  40 AND NAME HB1  )    4.0   0.5   0.5
ASSIGN (RESID  16 AND NAME HZ   ) (RESID  28 AND NAME HN   )    2.8   0.6   0.6
ASSIGN (RESID  16 AND NAME HZ   ) (RESID  40 AND NAME HB1  )    4.2   0.6   0.6
ASSIGN (RESID  16 AND NAME HZ   ) (RESID  40 AND NAME HB2  )    4.1   0.6   0.6
ASSIGN (RESID  17 AND NAME HA   ) (RESID  17 AND NAME HB1  )    2.3   0.5   0.5
ASSIGN (RESID  17 AND NAME HA   ) (RESID  17 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  17 AND NAME HA   ) (RESID  17 AND NAME HG*  )    3.5   0.7   0.7
ASSIGN (RESID  17 AND NAME HA   ) (RESID  18 AND NAME HN   )    1.9   0.4   0.4
ASSIGN (RESID  17 AND NAME HA   ) (RESID  25 AND NAME HN   )    3.4   0.7   0.7
ASSIGN (RESID  17 AND NAME HA   ) (RESID  26 AND NAME HA   )    2.3   0.5   0.5
ASSIGN (RESID  17 AND NAME HB2  ) (RESID  17 AND NAME HG*  )    3.1   0.6   0.6
ASSIGN (RESID  17 AND NAME HB2  ) (RESID  17 AND NAME HD2  )    4.1   0.6   0.6
ASSIGN (RESID  17 AND NAME HG*  ) (RESID  17 AND NAME HD1  )    2.4   0.5   0.5
ASSIGN (RESID  17 AND NAME HG*  ) (RESID  24 AND NAME HA   )    5.5   0.6   0.6
ASSIGN (RESID  18 AND NAME HN   ) (RESID  18 AND NAME HD*  )    3.4   0.7   0.7
ASSIGN (RESID  18 AND NAME HN   ) (RESID  26 AND NAME HD22 )    5.7   0.7   0.7
ASSIGN (RESID  18 AND NAME HA   ) (RESID  18 AND NAME HB1  )    2.2   0.4   0.4
ASSIGN (RESID  18 AND NAME HA   ) (RESID  18 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID  18 AND NAME HA   ) (RESID  19 AND NAME HN   )    2.1   0.4   0.4
ASSIGN (RESID  18 AND NAME HB1  ) (RESID  18 AND NAME HB2  )    2.1   0.4   0.4
ASSIGN (RESID  18 AND NAME HB1  ) (RESID  41 AND NAME HN   )    3.5   0.6   0.6
ASSIGN (RESID  18 AND NAME HD*  ) (RESID  19 AND NAME HN   )    4.2   0.6   0.6
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  18 AND NAME HZ   )    1.8   0.4   0.4
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  20 AND NAME HB1  )    4.6   0.6   0.6
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  20 AND NAME HB2  )    4.4   0.6   0.6
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  29 AND NAME HG2* )    3.4   0.7   0.7
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  39 AND NAME HZ2  )    5.0   0.8   0.8
ASSIGN (RESID  18 AND NAME HE*  ) (RESID  39 AND NAME HH2  )    4.5   0.6   0.6
ASSIGN (RESID  19 AND NAME HN   ) (RESID  19 AND NAME HA   )    2.5   0.5   0.5
ASSIGN (RESID  19 AND NAME HN   ) (RESID  19 AND NAME HB*  )    2.4   0.5   0.5
ASSIGN (RESID  19 AND NAME HN   ) (RESID  45 AND NAME HA   )    3.6   0.5   0.5
ASSIGN (RESID  19 AND NAME HA   ) (RESID  19 AND NAME HG   )    2.4   0.5   0.5
ASSIGN (RESID  19 AND NAME HA   ) (RESID  20 AND NAME HN   )    2.0   0.4   0.4
ASSIGN (RESID  19 AND NAME HA   ) (RESID  23 AND NAME HN   )    3.8   0.6   0.6
ASSIGN (RESID  19 AND NAME HA   ) (RESID  24 AND NAME HA   )    3.3   0.8   0.8
ASSIGN (RESID  19 AND NAME HA   ) (RESID  24 AND NAME HG*  )    3.2   0.6   0.6
ASSIGN (RESID  19 AND NAME HA   ) (RESID  25 AND NAME HN   )    3.6   0.6   0.6
ASSIGN (RESID  19 AND NAME HB*  ) (RESID  45 AND NAME HA   )    3.4   0.6   0.6
ASSIGN (RESID  19 AND NAME HB*  ) (RESID  45 AND NAME HD22 )    5.6   0.6   0.6
ASSIGN (RESID  19 AND NAME HB*  ) (RESID  46 AND NAME HN   )    4.1   0.7   0.7
ASSIGN (RESID  19 AND NAME HB*  ) (RESID  47 AND NAME HN   )    6.2   0.9   0.9
ASSIGN (RESID  19 AND NAME HG   ) (RESID  24 AND NAME HA   )    5.2   0.5   0.5
ASSIGN (RESID  19 AND NAME HG   ) (RESID  24 AND NAME HG*  )    5.3   0.5   0.5
ASSIGN (RESID  19 AND NAME HD2* ) (RESID  20 AND NAME HN   )    5.6   0.7   0.7
ASSIGN (RESID  19 AND NAME HD2* ) (RESID  22 AND NAME HN   )    4.0   0.8   0.8
ASSIGN (RESID  19 AND NAME HD2* ) (RESID  45 AND NAME HD21 )    4.0   0.8   0.8
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HA   )    2.6   0.5   0.5
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HB1  )    2.8   0.6   0.6
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HB2  )    3.0   0.5   0.5
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HD*  )    4.3   0.6   0.6
ASSIGN (RESID  20 AND NAME HN   ) (RESID  23 AND NAME HN   )    2.5   0.5   0.5
ASSIGN (RESID  20 AND NAME HN   ) (RESID  25 AND NAME HD*  )    4.9   0.6   0.6
ASSIGN (RESID  20 AND NAME HN   ) (RESID  25 AND NAME HE*  )    4.8   0.6   0.6
ASSIGN (RESID  20 AND NAME HA   ) (RESID  20 AND NAME HB1  )    3.0   0.4   0.4
ASSIGN (RESID  20 AND NAME HA   ) (RESID  20 AND NAME HD*  )    2.4   0.5   0.5
ASSIGN (RESID  20 AND NAME HA   ) (RESID  21 AND NAME HN   )    2.1   0.4   0.4
ASSIGN (RESID  20 AND NAME HA   ) (RESID  22 AND NAME HN   )    3.6   0.6   0.6
ASSIGN (RESID  20 AND NAME HB1  ) (RESID  20 AND NAME HB2  )    2.0   0.4   0.4
ASSIGN (RESID  20 AND NAME HB1  ) (RESID  20 AND NAME HD*  )    2.3   0.5   0.5
ASSIGN (RESID  20 AND NAME HB1  ) (RESID  25 AND NAME HE*  )    2.8   0.6   0.6
ASSIGN (RESID  20 AND NAME HB1  ) (RESID  29 AND NAME HG2* )    4.3   0.9   0.9
ASSIGN (RESID  20 AND NAME HB1  ) (RESID  25 AND NAME HD*  )    5.9   0.9   0.9
ASSIGN (RESID  20 AND NAME HB2  ) (RESID  20 AND NAME HD*  )    2.6   0.4   0.4
ASSIGN (RESID  20 AND NAME HB2  ) (RESID  25 AND NAME HE*  )    5.0   0.5   0.5
ASSIGN (RESID  20 AND NAME HB2  ) (RESID  25 AND NAME HD*  )    3.3   1.0   1.0
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  21 AND NAME HN   )    3.4   0.6   0.6
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  22 AND NAME HN   )    5.5   0.8   0.8
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  29 AND NAME HG2* )    5.8   0.8   0.8
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  31 AND NAME HB   )    5.4   0.6   0.6
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  31 AND NAME HG2* )    5.1   0.6   0.6
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  39 AND NAME HZ2  )    3.1   0.9   0.9
ASSIGN (RESID  20 AND NAME HD*  ) (RESID  39 AND NAME HH2  )    3.1   0.9   0.9
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  31 AND NAME HB*  )    3.1   0.9   0.9
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  31 AND NAME HA1  )    2.7   0.8   0.8
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  31 AND NAME HA2  )    3.6   1.1   1.1
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  32 AND NAME HA1  )    2.7   0.8   0.8
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  32 AND NAME HA2  )    3.6   1.1   1.1
ASSIGN (RESID  20 AND NAME HE*  ) (RESID  39 AND NAME HZ2  )    2.8   0.8   0.8
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HA   )    2.1   0.4   0.4
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HB1  )    3.5   0.7   0.7
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HB2  )    2.9   0.6   0.6
ASSIGN (RESID  21 AND NAME HN   ) (RESID  22 AND NAME HN   )    2.6   0.5   0.5
ASSIGN (RESID  21 AND NAME HA   ) (RESID  21 AND NAME HB1  )    2.5   0.5   0.5
ASSIGN (RESID  21 AND NAME HA   ) (RESID  22 AND NAME HN   )    3.1   0.4   0.4
ASSIGN (RESID  21 AND NAME HB1  ) (RESID  22 AND NAME HN   )    3.7   0.7   0.7
ASSIGN (RESID  21 AND NAME HB2  ) (RESID  22 AND NAME HN   )    3.9   0.8   0.8
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HA1  )    2.5   0.4   0.4
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HA2  )    2.1   0.4   0.4
ASSIGN (RESID  22 AND NAME HN   ) (RESID  23 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  22 AND NAME HA1  ) (RESID  22 AND NAME HA2  )    1.8   0.4   0.4
ASSIGN (RESID  22 AND NAME HA1  ) (RESID  23 AND NAME HN   )    3.0   0.6   0.6
ASSIGN (RESID  22 AND NAME HA2  ) (RESID  23 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HA   )    2.7   0.4   0.4
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HB2  )    2.9   0.5   0.5
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HG1  )    4.5   0.6   0.6
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HD*  )    5.3   0.7   0.7
ASSIGN (RESID  23 AND NAME HN   ) (RESID  25 AND NAME HE*  )    5.0   0.8   0.8
ASSIGN (RESID  23 AND NAME HA   ) (RESID  23 AND NAME HG1  )    3.2   0.6   0.6
ASSIGN (RESID  23 AND NAME HA   ) (RESID  23 AND NAME HG2  )    3.0   0.6   0.6
ASSIGN (RESID  23 AND NAME HA   ) (RESID  24 AND NAME HN   )    1.8   0.4   0.4
ASSIGN (RESID  23 AND NAME HB1  ) (RESID  23 AND NAME HG1  )    2.8   0.5   0.5
ASSIGN (RESID  23 AND NAME HB1  ) (RESID  23 AND NAME HG2  )    2.8   0.6   0.6
ASSIGN (RESID  23 AND NAME HB1  ) (RESID  24 AND NAME HN   )    4.2   0.5   0.5
ASSIGN (RESID  23 AND NAME HB1  ) (RESID  25 AND NAME HD*  )    4.8   0.7   0.7
ASSIGN (RESID  23 AND NAME HB1  ) (RESID  25 AND NAME HE*  )    3.0   0.6   0.6
ASSIGN (RESID  23 AND NAME HB2  ) (RESID  23 AND NAME HG1  )    2.2   0.4   0.4
ASSIGN (RESID  23 AND NAME HB2  ) (RESID  23 AND NAME HG2  )    2.8   0.5   0.5
ASSIGN (RESID  23 AND NAME HB2  ) (RESID  24 AND NAME HN   )    4.3   0.5   0.5
ASSIGN (RESID  23 AND NAME HB2  ) (RESID  25 AND NAME HD*  )    5.8   0.6   0.6
ASSIGN (RESID  23 AND NAME HB2  ) (RESID  25 AND NAME HE*  )    5.5   0.6   0.6
ASSIGN (RESID  23 AND NAME HG1  ) (RESID  23 AND NAME HG2  )    1.8   0.4   0.4
ASSIGN (RESID  23 AND NAME HG1  ) (RESID  24 AND NAME HN   )    3.5   0.7   0.7
ASSIGN (RESID  23 AND NAME HG2  ) (RESID  23 AND NAME HE*  )    3.0   0.6   0.6
ASSIGN (RESID  23 AND NAME HG2  ) (RESID  24 AND NAME HN   )    3.5   0.7   0.7
ASSIGN (RESID  23 AND NAME HD*  ) (RESID  25 AND NAME HE*  )    3.0   0.6   0.6
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HB1  )    3.6   0.5   0.5
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID  24 AND NAME HN   ) (RESID  25 AND NAME HN   )    4.5   0.6   0.6
ASSIGN (RESID  24 AND NAME HN   ) (RESID  25 AND NAME HA   )    5.4   0.6   0.6
ASSIGN (RESID  24 AND NAME HN   ) (RESID  25 AND NAME HD*  )    6.0   0.9   0.9
ASSIGN (RESID  24 AND NAME HA   ) (RESID  24 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID  24 AND NAME HA   ) (RESID  24 AND NAME HB2  )    2.8   0.5   0.5
ASSIGN (RESID  24 AND NAME HA   ) (RESID  24 AND NAME HG*  )    2.9   0.6   0.6
ASSIGN (RESID  24 AND NAME HA   ) (RESID  25 AND NAME HN   )    2.0   0.4   0.4
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  24 AND NAME HG*  )    2.2   0.4   0.4
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  25 AND NAME HN   )    3.4   0.7   0.7
ASSIGN (RESID  24 AND NAME HB2  ) (RESID  24 AND NAME HG*  )    2.1   0.4   0.4
ASSIGN (RESID  24 AND NAME HB2  ) (RESID  25 AND NAME HN   )    3.8   0.8   0.8
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HA   )    3.0   0.4   0.4
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HB2  )    2.6   0.5   0.5
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HD*  )    3.0   0.5   0.5
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HE*  )    5.2   0.7   0.7
ASSIGN (RESID  25 AND NAME HA   ) (RESID  25 AND NAME HB2  )    2.4   0.5   0.5
ASSIGN (RESID  25 AND NAME HA   ) (RESID  25 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  25 AND NAME HB1  ) (RESID  25 AND NAME HD*  )    2.4   0.5   0.5
ASSIGN (RESID  25 AND NAME HB1  ) (RESID  25 AND NAME HE*  )    4.5   0.7   0.7
ASSIGN (RESID  25 AND NAME HB1  ) (RESID  29 AND NAME HB   )    3.3   0.7   0.7
ASSIGN (RESID  25 AND NAME HB1  ) (RESID  40 AND NAME HA   )    5.3   0.6   0.6
ASSIGN (RESID  25 AND NAME HB2  ) (RESID  25 AND NAME HD*  )    2.5   0.5   0.5
ASSIGN (RESID  25 AND NAME HB2  ) (RESID  25 AND NAME HE*  )    4.2   0.7   0.7
ASSIGN (RESID  25 AND NAME HB2  ) (RESID  26 AND NAME HN   )    3.2   0.9   0.9
ASSIGN (RESID  25 AND NAME HB2  ) (RESID  29 AND NAME HG2* )    4.1   0.8   0.8
ASSIGN (RESID  25 AND NAME HD*  ) (RESID  25 AND NAME HE*  )    2.2   0.4   0.4
ASSIGN (RESID  25 AND NAME HD*  ) (RESID  29 AND NAME HB   )    3.8   0.5   0.5
ASSIGN (RESID  25 AND NAME HE*  ) (RESID  29 AND NAME HB   )    4.4   0.6   0.6
ASSIGN (RESID  25 AND NAME HE*  ) (RESID  29 AND NAME HG2* )    3.6   0.7   0.7
ASSIGN (RESID  25 AND NAME HE*  ) (RESID  31 AND NAME HG2* )    4.1   0.8   0.8
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HB1  )    3.7   0.5   0.5
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HB2  )    2.7   0.5   0.5
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HD22 )    3.8   0.8   0.8
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  26 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  26 AND NAME HD22 )    3.6   0.7   0.7
ASSIGN (RESID  26 AND NAME HD21 ) (RESID  26 AND NAME HD22 )    2.0   0.4   0.4
ASSIGN (RESID  27 AND NAME HA   ) (RESID  27 AND NAME HB1  )    2.1   0.4   0.4
ASSIGN (RESID  27 AND NAME HA   ) (RESID  28 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  27 AND NAME HB1  ) (RESID  27 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HB1  )    3.4   0.6   0.6
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HB2  )    3.1   0.6   0.6
ASSIGN (RESID  28 AND NAME HB1  ) (RESID  28 AND NAME HB2  )    1.9   0.4   0.4
ASSIGN (RESID  28 AND NAME HB1  ) (RESID  29 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID  28 AND NAME HB1  ) (RESID  39 AND NAME HN   )    3.3   0.7   0.7
ASSIGN (RESID  28 AND NAME HB2  ) (RESID  29 AND NAME HN   )    3.8   0.5   0.5
ASSIGN (RESID  28 AND NAME HB2  ) (RESID  39 AND NAME HN   )    3.9   0.6   0.6
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HA   )    2.3   0.5   0.5
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HB   )    2.6   0.5   0.5
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HG2* )    2.6   0.5   0.5
ASSIGN (RESID  29 AND NAME HN   ) (RESID  39 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  29 AND NAME HN   ) (RESID  39 AND NAME HD1  )    4.8   0.7   0.7
ASSIGN (RESID  29 AND NAME HA   ) (RESID  29 AND NAME HG2* )    3.5   0.6   0.6
ASSIGN (RESID  29 AND NAME HA   ) (RESID  30 AND NAME HN   )    2.0   0.4   0.4
ASSIGN (RESID  29 AND NAME HA   ) (RESID  31 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  29 AND NAME HB   ) (RESID  29 AND NAME HG2* )    2.4   0.5   0.5
ASSIGN (RESID  29 AND NAME HB   ) (RESID  30 AND NAME HN   )    3.9   0.6   0.6
ASSIGN (RESID  29 AND NAME HB   ) (RESID  31 AND NAME HN   )    3.7   0.7   0.7
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  30 AND NAME HN   )    4.0   0.7   0.7
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  30 AND NAME HA   )    4.8   0.7   0.7
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  31 AND NAME HN   )    2.9   0.6   0.6
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  31 AND NAME HB   )    2.9   0.6   0.6
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  31 AND NAME HG2* )    5.2   0.7   0.7
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  39 AND NAME HN   )    4.7   0.6   0.6
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  39 AND NAME HD1  )    4.9   0.7   0.7
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  39 AND NAME HE1  )    3.4   0.6   0.6
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  39 AND NAME HE3  )    5.9   0.8   0.8
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  39 AND NAME HZ2  )    3.8   0.6   0.6
ASSIGN (RESID  29 AND NAME HG2* ) (RESID  40 AND NAME HA   )    5.0   0.7   0.7
ASSIGN (RESID  30 AND NAME HN   ) (RESID  30 AND NAME HA   )    2.4   0.5   0.5
ASSIGN (RESID  30 AND NAME HN   ) (RESID  30 AND NAME HB2  )    3.4   0.6   0.6
ASSIGN (RESID  30 AND NAME HN   ) (RESID  31 AND NAME HN   )    2.1   0.4   0.4
ASSIGN (RESID  30 AND NAME HN   ) (RESID  31 AND NAME HG2* )    6.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HN   ) (RESID  39 AND NAME HN   )    4.9   0.6   0.6
ASSIGN (RESID  30 AND NAME HA   ) (RESID  30 AND NAME HB1  )    2.2   0.4   0.4
ASSIGN (RESID  30 AND NAME HA   ) (RESID  30 AND NAME HB2  )    2.1   0.4   0.4
ASSIGN (RESID  30 AND NAME HA   ) (RESID  31 AND NAME HN   )    2.6   0.5   0.5
ASSIGN (RESID  30 AND NAME HA   ) (RESID  38 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  30 AND NAME HA   ) (RESID  39 AND NAME HN   )    3.9   0.5   0.5
ASSIGN (RESID  30 AND NAME HA   ) (RESID  39 AND NAME HD1  )    2.3   0.5   0.5
ASSIGN (RESID  30 AND NAME HA   ) (RESID  39 AND NAME HE1  )    3.5   0.5   0.5
ASSIGN (RESID  30 AND NAME HB1  ) (RESID  31 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID  30 AND NAME HB2  ) (RESID  36 AND NAME HN   )    3.6   0.6   0.6
ASSIGN (RESID  31 AND NAME HN   ) (RESID  31 AND NAME HA   )    2.6   0.4   0.4
ASSIGN (RESID  31 AND NAME HN   ) (RESID  31 AND NAME HB   )    2.2   0.4   0.4
ASSIGN (RESID  31 AND NAME HN   ) (RESID  31 AND NAME HG2* )    4.3   0.6   0.6
ASSIGN (RESID  31 AND NAME HN   ) (RESID  32 AND NAME HN   )    4.7   0.6   0.6
ASSIGN (RESID  31 AND NAME HN   ) (RESID  39 AND NAME HD1  )    5.1   0.7   0.7
ASSIGN (RESID  31 AND NAME HN   ) (RESID  33 AND NAME HE1  )    3.6   0.6   0.6
ASSIGN (RESID  31 AND NAME HA   ) (RESID  39 AND NAME HE1  )    5.0   0.7   0.7
ASSIGN (RESID  31 AND NAME HA   ) (RESID  39 AND NAME HE1  )    5.0   0.7   0.7
ASSIGN (RESID  31 AND NAME HB   ) (RESID  31 AND NAME HG2* )    2.6   0.5   0.5
ASSIGN (RESID  31 AND NAME HB   ) (RESID  32 AND NAME HN   )    4.1   0.5   0.5
ASSIGN (RESID  31 AND NAME HB   ) (RESID  39 AND NAME HE1  )    4.0   0.6   0.6
ASSIGN (RESID  31 AND NAME HB   ) (RESID  39 AND NAME HZ2  )    4.4   0.6   0.6
ASSIGN (RESID  31 AND NAME HG2* ) (RESID  32 AND NAME HN   )    3.0   0.6   0.6
ASSIGN (RESID  31 AND NAME HG2* ) (RESID  32 AND NAME HA2  )    3.8   0.8   0.8
ASSIGN (RESID  31 AND NAME HG2* ) (RESID  39 AND NAME HE1  )    5.6   0.7   0.7
ASSIGN (RESID  31 AND NAME HG2* ) (RESID  39 AND NAME HZ2  )    5.1  0.6   0.6
ASSIGN (RESID  32 AND NAME HN   ) (RESID  32 AND NAME HA1  )    2.3   0.5   0.5
ASSIGN (RESID  32 AND NAME HN   ) (RESID  32 AND NAME HA2  )    2.3   0.5   0.5
ASSIGN (RESID  32 AND NAME HN   ) (RESID  33 AND NAME HN   )    3.1   0.5   0.5
ASSIGN (RESID  32 AND NAME HA1  ) (RESID  32 AND NAME HA2  )    1.8   0.4   0.4
ASSIGN (RESID  32 AND NAME HA2  ) (RESID  33 AND NAME HN   )    3.1   0.6   0.6
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HB1  )    3.6   0.5   0.5
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HB2  )    2.6   0.5   0.5
ASSIGN (RESID  33 AND NAME HN   ) (RESID  39 AND NAME HE1  )    3.0   0.6   0.6
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HG1  )    3.3   0.8   0.8
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HG2  )    3.0   0.9   0.9
ASSIGN (RESID  33 AND NAME HA   ) (RESID  33 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  33 AND NAME HA   ) (RESID  33 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  33 AND NAME HA   ) (RESID  34 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  33 AND NAME HB1  ) (RESID  33 AND NAME HG1  )    2.6   0.8   0.8
ASSIGN (RESID  33 AND NAME HB1  ) (RESID  33 AND NAME HG2  )    2.5   0.8   0.8
ASSIGN (RESID  33 AND NAME HB1  ) (RESID  33 AND NAME HE   )    2.8   0.7   0.7
ASSIGN (RESID  33 AND NAME HB1  ) (RESID  35 AND NAME HN   )    3.4   0.6   0.6
ASSIGN (RESID  33 AND NAME HB2  ) (RESID  33 AND NAME HG1  )    2.5   0.8   0.8
ASSIGN (RESID  33 AND NAME HB2  ) (RESID  33 AND NAME HG2  )    2.7   0.8   0.8
ASSIGN (RESID  33 AND NAME HB2  ) (RESID  33 AND NAME HE   )    3.2   0.6   0.6
ASSIGN (RESID  33 AND NAME HB2  ) (RESID  35 AND NAME HN   )    3.7   0.6   0.6
ASSIGN (RESID  33 AND NAME HG1  ) (RESID  33 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  33 AND NAME HG1  ) (RESID  39 AND NAME HD1  )    2.3   0.5   0.5
ASSIGN (RESID  33 AND NAME HG1  ) (RESID  39 AND NAME HE1  )    3.1   0.5   0.5
ASSIGN (RESID  33 AND NAME HG2  ) (RESID  39 AND NAME HD1  )    2.3   0.5   0.5
ASSIGN (RESID  33 AND NAME HG2  ) (RESID  39 AND NAME HE1  )    2.7   0.8   0.8
ASSIGN (RESID  33 AND NAME HD1  ) (RESID  37 AND NAME HB2  )    5.2   0.5   0.5
ASSIGN (RESID  33 AND NAME HD2  ) (RESID  37 AND NAME HB1  )    5.8   0.9   0.9
ASSIGN (RESID  33 AND NAME HD2  ) (RESID  39 AND NAME HD1  )    4.0   0.7   0.7
ASSIGN (RESID  33 AND NAME HE   ) (RESID  37 AND NAME HN   )    3.3   0.5   0.5
ASSIGN (RESID  33 AND NAME HE   ) (RESID  37 AND NAME HB1  )    3.8   0.7   0.7
ASSIGN (RESID  33 AND NAME HE   ) (RESID  54 AND NAME HE*  )    4.8   0.9   0.9
ASSIGN (RESID  33 AND NAME HH*  ) (RESID  54 AND NAME HE*  )    3.1   0.5   0.5
ASSIGN (RESID  33 AND NAME HH*  ) (RESID  54 AND NAME HZ   )    2.9   0.5   0.5
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HA   )    2.7   0.4   0.4
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HB*  )    2.9   0.6   0.6
ASSIGN (RESID  34 AND NAME HA   ) (RESID  34 AND NAME HB*  )    2.2   0.4   0.4
ASSIGN (RESID  34 AND NAME HA   ) (RESID  35 AND NAME HN   )    3.8   0.8   0.8
ASSIGN (RESID  34 AND NAME HA   ) (RESID  36 AND NAME HN   )    3.8   0.8   0.8
ASSIGN (RESID  34 AND NAME HB   ) (RESID  34 AND NAME HG2* )    3.0   0.6   0.6
ASSIGN (RESID  34 AND NAME HG2* ) (RESID  35 AND NAME HN   )    5.4   1.1   1.1
ASSIGN (RESID  35 AND NAME HN   ) (RESID  35 AND NAME HA   )    2.5   0.5   0.5
ASSIGN (RESID  35 AND NAME HN   ) (RESID  35 AND NAME HB1  )    2.8   0.6   0.6
ASSIGN (RESID  35 AND NAME HN   ) (RESID  35 AND NAME HB2  )    2.9   0.6   0.6
ASSIGN (RESID  35 AND NAME HN   ) (RESID  36 AND NAME HN   )    2.3   0.5   0.5
ASSIGN (RESID  35 AND NAME HN   ) (RESID  36 AND NAME HA1  )    5.0   0.8   0.8
ASSIGN (RESID  35 AND NAME HN   ) (RESID  36 AND NAME HA2  )    5.0   0.7   0.7
ASSIGN (RESID  35 AND NAME HA   ) (RESID  35 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID  35 AND NAME HA   ) (RESID  36 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  35 AND NAME HB1  ) (RESID  35 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  35 AND NAME HB1  ) (RESID  36 AND NAME HN   )    4.1   0.7   0.7
ASSIGN (RESID  35 AND NAME HB2  ) (RESID  36 AND NAME HN   )    3.5   0.7   0.7
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HA1  )    2.3   0.5   0.5
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HA2  )    2.1   0.4   0.4
ASSIGN (RESID  36 AND NAME HA1  ) (RESID  36 AND NAME HA2  )    1.8   0.4   0.4
ASSIGN (RESID  37 AND NAME HN   ) (RESID  37 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  37 AND NAME HN   ) (RESID  37 AND NAME HB2  )    2.7   0.5   0.5
ASSIGN (RESID  37 AND NAME HA   ) (RESID  37 AND NAME HB1  )    2.6   0.5   0.5
ASSIGN (RESID  37 AND NAME HA   ) (RESID  37 AND NAME HB2  )    2.7   0.4   0.4
ASSIGN (RESID  37 AND NAME HB1  ) (RESID  37 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  37 AND NAME HB1  ) (RESID  54 AND NAME HE*  )    4.5   0.9   0.9
ASSIGN (RESID  37 AND NAME HB2  ) (RESID  54 AND NAME HD*  )    5.1   1.1   1.1
ASSIGN (RESID  37 AND NAME HB2  ) (RESID  54 AND NAME HE*  )    4.8   0.9   0.9
ASSIGN (RESID  37 AND NAME HD*  ) (RESID  37 AND NAME HE*  )    2.5   0.8   0.8
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HA   )    3.7   0.8   0.8
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HB2  )    2.7   0.6   0.6
ASSIGN (RESID  38 AND NAME HA   ) (RESID  38 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HA   )    2.8   0.6   0.6
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HB2  )    4.0   0.6   0.6
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HD1  )    3.2   0.4   0.4
ASSIGN (RESID  39 AND NAME HA   ) (RESID  39 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  39 AND NAME HA   ) (RESID  39 AND NAME HD1  )    4.1   0.7   0.7
ASSIGN (RESID  39 AND NAME HA   ) (RESID  39 AND NAME HE3  )    4.1   0.6   0.6
ASSIGN (RESID  39 AND NAME HA   ) (RESID  54 AND NAME HA   )    2.0   0.4   0.4
ASSIGN (RESID  39 AND NAME HA   ) (RESID  54 AND NAME HD*  )    4.9   0.6   0.6
ASSIGN (RESID  39 AND NAME HA   ) (RESID  55 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  54 AND NAME HA   )    3.9   0.8   0.8
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  54 AND NAME HE*  )    4.4   0.6   0.6
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  39 AND NAME HD1  )    3.6   0.6   0.6
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  40 AND NAME HN   )    2.9   0.6   0.6
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  54 AND NAME HA   )    2.8   0.6   0.6
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  54 AND NAME HD*  )    4.9   0.6   0.6
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  54 AND NAME HE*  )    5.2   0.6   0.6
ASSIGN (RESID  39 AND NAME HD1  ) (RESID  39 AND NAME HE1  )    2.1   0.4   0.4
ASSIGN (RESID  39 AND NAME HE1  ) (RESID  39 AND NAME HZ2  )    2.6   0.4   0.4
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  39 AND NAME HZ3  )    2.7   0.4   0.4
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  40 AND NAME HN   )    2.3   0.5   0.5
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  40 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  52 AND NAME HA   )    4.1   0.5   0.5
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  52 AND NAME HB2  )    2.4   0.5   0.5
ASSIGN (RESID  39 AND NAME HE3  ) (RESID  53 AND NAME HN   )    3.8   0.4   0.4
ASSIGN (RESID  39 AND NAME HZ2  ) (RESID  39 AND NAME HZ3  )    3.6   0.6   0.6
ASSIGN (RESID  39 AND NAME HZ2  ) (RESID  39 AND NAME HH2  )    2.0   0.4   0.4
ASSIGN (RESID  39 AND NAME HZ3  ) (RESID  41 AND NAME HB*  )    3.0   0.6   0.6
ASSIGN (RESID  39 AND NAME HZ3  ) (RESID  46 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  39 AND NAME HZ3  ) (RESID  52 AND NAME HA   )    4.7   0.5   0.5
ASSIGN (RESID  39 AND NAME HZ3  ) (RESID  52 AND NAME HB1  )    3.6   0.5   0.5
ASSIGN (RESID  39 AND NAME HZ3  ) (RESID  52 AND NAME HB2  )    3.8   0.4   0.4
ASSIGN (RESID  39 AND NAME HH2  ) (RESID  46 AND NAME HD*  )    2.8   0.6   0.6
ASSIGN (RESID  40 AND NAME HN   ) (RESID  40 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  40 AND NAME HN   ) (RESID  40 AND NAME HB1  )    3.2   0.6   0.6
ASSIGN (RESID  40 AND NAME HN   ) (RESID  53 AND NAME HA2  )    4.9   0.7   0.7
ASSIGN (RESID  40 AND NAME HA   ) (RESID  40 AND NAME HB1  )    2.2   0.4   0.4
ASSIGN (RESID  40 AND NAME HA   ) (RESID  40 AND NAME HB2  )    2.4   0.5   0.5
ASSIGN (RESID  40 AND NAME HA   ) (RESID  41 AND NAME HN   )    2.1   0.4   0.4
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  41 AND NAME HN   )    3.9   0.6   0.6
ASSIGN (RESID  41 AND NAME HA   ) (RESID  42 AND NAME HN   )    3.1   0.7   0.7
ASSIGN (RESID  41 AND NAME HA   ) (RESID  52 AND NAME HA   )    2.4   0.5   0.5
ASSIGN (RESID  41 AND NAME HB*  ) (RESID  42 AND NAME HN   )    2.9   0.6   0.6
ASSIGN (RESID  42 AND NAME HN   ) (RESID  42 AND NAME HA   )    2.6   0.4   0.4
ASSIGN (RESID  42 AND NAME HN   ) (RESID  42 AND NAME HB   )    2.5   0.5   0.5
ASSIGN (RESID  42 AND NAME HN   ) (RESID  42 AND NAME HG2* )    4.3   0.6   0.6
ASSIGN (RESID  42 AND NAME HA   ) (RESID  42 AND NAME HB   )    2.6   0.5   0.5
ASSIGN (RESID  42 AND NAME HA   ) (RESID  42 AND NAME HG2* )    2.7   0.5   0.5
ASSIGN (RESID  42 AND NAME HB   ) (RESID  42 AND NAME HG2* )    2.3   0.5   0.5
ASSIGN (RESID  42 AND NAME HG2* ) (RESID  52 AND NAME HN   )    7.4   0.8   0.8
ASSIGN (RESID  42 AND NAME HG2* ) (RESID  52 AND NAME HA   )    6.6   0.7   0.7
ASSIGN (RESID  43 AND NAME HN   ) (RESID  43 AND NAME HA   )    2.6   0.4   0.4
ASSIGN (RESID  43 AND NAME HN   ) (RESID  43 AND NAME HG2* )    3.3   0.7   0.7
ASSIGN (RESID  43 AND NAME HA   ) (RESID  43 AND NAME HG2* )    2.9   0.6   0.6
ASSIGN (RESID  43 AND NAME HB   ) (RESID  43 AND NAME HG2* )    2.6   0.5   0.5
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  45 AND NAME HN   )    5.4   0.8   0.8
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  49 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  49 AND NAME HB2  )    3.2   1.0   1.0
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  51 AND NAME HB2  )    4.0   0.8   0.8
ASSIGN (RESID  44 AND NAME HN   ) (RESID  44 AND NAME HA   )    2.4   0.5   0.5
ASSIGN (RESID  44 AND NAME HN   ) (RESID  44 AND NAME HB2  )    2.7   0.5   0.5
ASSIGN (RESID  44 AND NAME HA   ) (RESID  44 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  44 AND NAME HA   ) (RESID  45 AND NAME HN   )    3.2   0.7   0.7
ASSIGN (RESID  44 AND NAME HB1  ) (RESID  44 AND NAME HD*  )    3.1   0.7   0.7
ASSIGN (RESID  44 AND NAME HD*  ) (RESID  44 AND NAME HE*  )    3.1   0.6   0.6
ASSIGN (RESID  45 AND NAME HN   ) (RESID  45 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID  45 AND NAME HN   ) (RESID  45 AND NAME HB2  )    2.6   0.5   0.5
ASSIGN (RESID  45 AND NAME HA   ) (RESID  45 AND NAME HB1  )    2.8   0.5   0.5
ASSIGN (RESID  45 AND NAME HA   ) (RESID  45 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID  45 AND NAME HA   ) (RESID  45 AND NAME HD21 )    3.1   0.6   0.6
ASSIGN (RESID  45 AND NAME HA   ) (RESID  45 AND NAME HD22 )    3.2   0.6   0.6
ASSIGN (RESID  45 AND NAME HB1  ) (RESID  45 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  45 AND NAME HB1  ) (RESID  45 AND NAME HD21 )    3.7   0.5   0.5
ASSIGN (RESID  45 AND NAME HB1  ) (RESID  45 AND NAME HD22 )    2.8   0.6   0.6
ASSIGN (RESID  45 AND NAME HB1  ) (RESID  48 AND NAME HN   )    3.3   0.7   0.7
ASSIGN (RESID  45 AND NAME HB2  ) (RESID  45 AND NAME HD21 )    4.1   0.5   0.5
ASSIGN (RESID  45 AND NAME HB2  ) (RESID  45 AND NAME HD22 )    2.9   0.6   0.6
ASSIGN (RESID  45 AND NAME HB2  ) (RESID  48 AND NAME HN   )    4.8   0.6   0.6
ASSIGN (RESID  45 AND NAME HD21 ) (RESID  45 AND NAME HD22 )    1.8   0.4   0.4
ASSIGN (RESID  45 AND NAME HD22 ) (RESID  46 AND NAME HN   )    3.3   0.7   0.7
ASSIGN (RESID  45 AND NAME HD22 ) (RESID  48 AND NAME HD*  )    6.2   0.5   0.5
ASSIGN (RESID  46 AND NAME HA   ) (RESID  46 AND NAME HB1  )    3.3   0.7   0.7
ASSIGN (RESID  46 AND NAME HA   ) (RESID  46 AND NAME HB2  )    3.0   0.6   0.6
ASSIGN (RESID  46 AND NAME HA   ) (RESID  46 AND NAME HD*  )    2.4   0.5   0.5
ASSIGN (RESID  46 AND NAME HA   ) (RESID  47 AND NAME HN   )    3.1   0.5   0.5
ASSIGN (RESID  46 AND NAME HA   ) (RESID  49 AND NAME HN   )    3.9   0.5   0.5
ASSIGN (RESID  46 AND NAME HB1  ) (RESID  46 AND NAME HB2  )    2.5   0.6   0.6
ASSIGN (RESID  46 AND NAME HB1  ) (RESID  46 AND NAME HD*  )    3.2   0.7   0.7
ASSIGN (RESID  46 AND NAME HD*  ) (RESID  47 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID  46 AND NAME HD*  ) (RESID  47 AND NAME HA   )    4.7   0.6   0.6
ASSIGN (RESID  46 AND NAME HD*  ) (RESID  50 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID  46 AND NAME HD*  ) (RESID  51 AND NAME HN   )    4.9   0.6   0.6
ASSIGN (RESID  46 AND NAME HD*  ) (RESID  52 AND NAME HA   )    6.2   0.7   0.7
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HA   )    2.6   0.4   0.4
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HG1  )    4.0   0.6   0.6
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HG2  )    4.4   0.6   0.6
ASSIGN (RESID  47 AND NAME HN   ) (RESID  48 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HB1  )    2.8   0.4   0.4
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HB2  )    2.1   0.9   0.9
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HG1  )    2.5   0.5   0.5
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HG2  )    2.5   0.9   0.9
ASSIGN (RESID  47 AND NAME HA   ) (RESID  48 AND NAME HN   )    3.5   0.5   0.5
ASSIGN (RESID  47 AND NAME HA   ) (RESID  49 AND NAME HN   )    5.3   0.7   0.7
ASSIGN (RESID  47 AND NAME HB1  ) (RESID  48 AND NAME HN   )    2.9   0.6   0.6
ASSIGN (RESID  47 AND NAME HB2  ) (RESID  48 AND NAME HN   )    3.1   0.5   0.5
ASSIGN (RESID  48 AND NAME HN   ) (RESID  48 AND NAME HA   )    2.3   0.5   0.5
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HB2  )    2.1   0.4   0.4
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HG1  )    3.5   0.4   0.4
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HG2  )    4.0   0.5   0.5
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HD*  )    4.2   0.9   0.9
ASSIGN (RESID  48 AND NAME HB1  ) (RESID  48 AND NAME HG2  )    2.1   0.4   0.4
ASSIGN (RESID  48 AND NAME HB2  ) (RESID  48 AND NAME HD*  )    2.9   0.6   0.6
ASSIGN (RESID  48 AND NAME HG1  ) (RESID  48 AND NAME HG2  )    1.8   0.4   0.4
ASSIGN (RESID  48 AND NAME HG1  ) (RESID  48 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  48 AND NAME HG2  ) (RESID  48 AND NAME HD*  )    2.6   0.5   0.5
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HA   )    2.4   0.5   0.5
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HB1  )    3.6   0.5   0.5
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID  49 AND NAME HN   ) (RESID  50 AND NAME HN   )    2.2   0.4   0.4
ASSIGN (RESID  49 AND NAME HA   ) (RESID  49 AND NAME HB1  )    2.5   0.5   0.5
ASSIGN (RESID  49 AND NAME HA   ) (RESID  49 AND NAME HB2  )    2.8   0.6   0.6
ASSIGN (RESID  49 AND NAME HB1  ) (RESID  49 AND NAME HB2  )    2.0   0.4   0.4
ASSIGN (RESID  49 AND NAME HB1  ) (RESID  50 AND NAME HN   )    3.0   0.6   0.6
ASSIGN (RESID  49 AND NAME HB2  ) (RESID  50 AND NAME HN   )    3.0   0.6   0.6
ASSIGN (RESID  49 AND NAME HB2  ) (RESID  51 AND NAME HN   )    3.0   0.6   0.6
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HA1  )    2.3   0.5   0.5
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HA2  )    2.2   0.4   0.4
ASSIGN (RESID  50 AND NAME HN   ) (RESID  51 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID  50 AND NAME HA1  ) (RESID  50 AND NAME HA2  )    1.8   0.4   0.4
ASSIGN (RESID  50 AND NAME HA1  ) (RESID  51 AND NAME HN   )    3.0   0.5   0.5
ASSIGN (RESID  50 AND NAME HA2  ) (RESID  51 AND NAME HN   )    3.1   0.6   0.6
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HB1  )    3.7   0.5   0.5
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HG*  )    3.2   0.6   0.6
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HD*  )    3.3   0.7   0.7
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HB1  )    2.5   0.5   0.5
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HG*  )    2.7   0.5   0.5
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HD*  )    3.5   0.6   0.6
ASSIGN (RESID  51 AND NAME HA   ) (RESID  52 AND NAME HN   )    2.0   0.4   0.4
ASSIGN (RESID  51 AND NAME HB1  ) (RESID  51 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  51 AND NAME HB1  ) (RESID  51 AND NAME HG*  )    2.2   0.4   0.4
ASSIGN (RESID  51 AND NAME HB2  ) (RESID  51 AND NAME HG*  )    2.1   0.4   0.4
ASSIGN (RESID  51 AND NAME HG*  ) (RESID  52 AND NAME HN   )    4.2   0.7   0.7
ASSIGN (RESID  51 AND NAME HD*  ) (RESID  52 AND NAME HN   )    5.7   0.7   0.7
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HA   )    2.8   0.6   0.6
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HD*  )    2.6   0.5   0.5
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HE*  )    4.6   0.7   0.7
ASSIGN (RESID  52 AND NAME HN   ) (RESID  53 AND NAME HN   )    4.3   0.6   0.6
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HB1  )    2.4   0.5   0.5
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HB2  )    2.4   0.5   0.5
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HE*  )    5.9   0.9   0.9
ASSIGN (RESID  52 AND NAME HA   ) (RESID  53 AND NAME HN   )    2.2   0.4   0.4
ASSIGN (RESID  52 AND NAME HB1  ) (RESID  52 AND NAME HD*  )    2.2   0.4   0.4
ASSIGN (RESID  52 AND NAME HB1  ) (RESID  53 AND NAME HN   )    3.7   0.5   0.5
ASSIGN (RESID  52 AND NAME HB2  ) (RESID  52 AND NAME HE*  )    4.6   0.7   0.7
ASSIGN (RESID  52 AND NAME HB2  ) (RESID  53 AND NAME HN   )    2.7   0.5   0.5
ASSIGN (RESID  52 AND NAME HD*  ) (RESID  52 AND NAME HE*  )    2.3   0.5   0.5
ASSIGN (RESID  52 AND NAME HD*  ) (RESID  54 AND NAME HE*  )    5.9   0.7   0.7
ASSIGN (RESID  52 AND NAME HE*  ) (RESID  54 AND NAME HD*  )    6.4   0.9   0.9
ASSIGN (RESID  52 AND NAME HE*  ) (RESID  54 AND NAME HE*  )    5.0   0.5   0.5
ASSIGN (RESID  52 AND NAME HE*  ) (RESID  54 AND NAME HZ   )    4.7   0.5   0.5
ASSIGN (RESID  53 AND NAME HN   ) (RESID  53 AND NAME HA1  )    2.7   0.5   0.5
ASSIGN (RESID  53 AND NAME HN   ) (RESID  53 AND NAME HA2  )    2.8   0.6   0.6
ASSIGN (RESID  53 AND NAME HA1  ) (RESID  53 AND NAME HA2  )    1.9   0.4   0.4
ASSIGN (RESID  53 AND NAME HA1  ) (RESID  54 AND NAME HN   )    2.4   0.5   0.5
ASSIGN (RESID  53 AND NAME HA2  ) (RESID  54 AND NAME HN   )    2.5   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HA   )    2.7   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HB1  )    3.2   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HB2  )    2.6   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HE*  )    4.1   0.8   0.8
ASSIGN (RESID  54 AND NAME HA   ) (RESID  54 AND NAME HB2  )    2.4   0.5   0.5
ASSIGN (RESID  54 AND NAME HA   ) (RESID  54 AND NAME HD*  )    2.7   0.5   0.5
ASSIGN (RESID  54 AND NAME HA   ) (RESID  54 AND NAME HE*  )    4.0   0.8   0.8
ASSIGN (RESID  54 AND NAME HA   ) (RESID  55 AND NAME HN   )    2.2   0.4   0.4
ASSIGN (RESID  54 AND NAME HB1  ) (RESID  54 AND NAME HB2  )    1.8   0.4   0.4
ASSIGN (RESID  54 AND NAME HB1  ) (RESID  54 AND NAME HD*  )    2.4   0.5   0.5
ASSIGN (RESID  54 AND NAME HB1  ) (RESID  55 AND NAME HN   )    2.9   0.6   0.6
ASSIGN (RESID  54 AND NAME HB2  ) (RESID  54 AND NAME HD*  )    2.2   0.4   0.4
ASSIGN (RESID  54 AND NAME HB2  ) (RESID  55 AND NAME HN   )    4.2   0.5   0.5
ASSIGN (RESID  54 AND NAME HD*  ) (RESID  54 AND NAME HE*  )    2.2   0.4   0.4
ASSIGN (RESID  54 AND NAME HD*  ) (RESID  54 AND NAME HZ   )    3.9   0.8   0.8
ASSIGN (RESID  54 AND NAME HD*  ) (RESID  55 AND NAME HN   )    4.2   0.7   0.7
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HB1  )    3.2  0.5   0.5
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HB1  )    2.6   0.5   0.5
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HB2  )    3.0   0.4   0.4
ASSIGN (RESID  56 AND NAME HA   ) (RESID  56 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID  56 AND NAME HG*  ) (RESID  56 AND NAME HD2  )    2.3   0.5   0.5
ASSIGN (RESID  56 AND NAME HD2  ) (RESID  56 AND NAME HD1  )    1.8   0.4   0.4
ASSIGN (RESID  57 AND NAME HA   ) (RESID  57 AND NAME HB1  )    2.6   0.5   0.5
ASSIGN (RESID  57 AND NAME HA   ) (RESID  57 AND NAME HB2  )    2.2   0.4   0.4
ASSIGN (RESID  58 AND NAME HN   ) (RESID  58 AND NAME HB1  )    2.8   0.6   0.6
ASSIGN (RESID  58 AND NAME HN   ) (RESID  58 AND NAME HB2  )    3.0   0.6   0.6
ASSIGN (RESID  58 AND NAME HN   ) (RESID  58 AND NAME HG*  )    3.3   0.7   0.7
ASSIGN (RESID  58 AND NAME HA   ) (RESID  58 AND NAME HB1  )    2.3   0.5   0.5
ASSIGN (RESID  58 AND NAME HA   ) (RESID  58 AND NAME HB2  )    2.3   0.5   0.5
ASSIGN (RESID  58 AND NAME HA   ) (RESID  58 AND NAME HG*  )    3.8   0.5   0.5
ASSIGN (RESID  59 AND NAME HN   ) (RESID  59 AND NAME HA   )    2.5   0.4   0.4
ASSIGN (RESID  59 AND NAME HA   ) (RESID  59 AND NAME HB*  )    2.2   0.4   0.4

restraints
  dihedral
  reset

! backbone phi from hnha

assign (resid 7 and name c) (resid 8 and name n)
       (resid 8 and name ca) (resid 8 and name c) 1 -120.0 50.0 2
assign (resid 11 and name c) (resid 12 and name n)
       (resid 12 and name ca) (resid 12 and name c) 1 -60.0 30.0 2
assign (resid 13 and name c) (resid 14 and name n)
       (resid 14 and name ca) (resid 14 and name c) 1 -60.0 30.0 2
assign (resid 14 and name c) (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 1 -120.0 40.0 2
assign (resid 15 and name c) (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 1 -120.0 60.0 2
assign (resid 22 and name c) (resid 23 and name n)
       (resid 23 and name ca) (resid 23 and name c) 1 -120.0 50.0 2
assign (resid 23 and name c) (resid 24 and name n)
       (resid 24 and name ca) (resid 24 and name c) 1 -120.0 50.0 2
assign (resid 24 and name c) (resid 25 and name n)
       (resid 25 and name ca) (resid 25 and name c) 1 -120.0 40.0 2
assign (resid 25 and name c) (resid 26 and name n)
       (resid 26 and name ca) (resid 26 and name c) 1 -120.0 40.0 2
assign (resid 27 and name c) (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1 -60.0 30.0 2
assign (resid 28 and name c) (resid 29 and name n)
       (resid 29 and name ca) (resid 29 and name c) 1 -120.0 40.0 2
assign (resid 29 and name c) (resid 30 and name n)
       (resid 30 and name ca) (resid 30 and name c) 1 -120.0 40.0 2
assign (resid 30 and name c) (resid 31 and name n)
       (resid 31 and name ca) (resid 31 and name c) 1 -60.0 30.0 2
assign (resid 32 and name c) (resid 33 and name n)
       (resid 33 and name ca) (resid 33 and name c) 1 -60.0 40.0 2
assign (resid 33 and name c) (resid 34 and name n)
       (resid 34 and name ca) (resid 34 and name c) 1 -120.0 40.0 2
assign (resid 34 and name c) (resid 35 and name n)
       (resid 35 and name ca) (resid 35 and name c) 1 -120.0 40.0 2
assign (resid 35 and name c) (resid 36 and name n)
       (resid 36 and name ca) (resid 36 and name c) 1  60.0 30.0 2
assign (resid 37 and name c) (resid 38 and name n)
       (resid 38 and name ca) (resid 38 and name c) 1 -120.0 40.0 2
assign (resid 38 and name c) (resid 39 and name n)
       (resid 39 and name ca) (resid 39 and name c) 1 -120.0 40.0 2
assign (resid 39 and name c) (resid 40 and name n)
       (resid 40 and name ca) (resid 40 and name c) 1 -120.0 50.0 2
assign (resid 42 and name c) (resid 43 and name n)
       (resid 43 and name ca) (resid 43 and name c) 1 -120.0 30.0 2
assign (resid 44 and name c) (resid 45 and name n)
       (resid 45 and name ca) (resid 45 and name c) 1 -120.0 50.0 2
assign (resid 46 and name c) (resid 47 and name n)
       (resid 47 and name ca) (resid 47 and name c) 1 -60.0 30.0 2
assign (resid 50 and name c) (resid 51 and name n)
       (resid 51 and name ca) (resid 51 and name c) 1 -120.0 40.0 2
assign (resid 53 and name c) (resid 54 and name n)
       (resid 54 and name ca) (resid 54 and name c) 1 -60.0 40.0 2

!ha cis to following n (from hnhb)
assign (resid 47 and name ha) (resid 47 and name ca)
       (resid 47 and name c) (resid 48 and name n) 1 180.0 40.0 2
assign (resid 48 and name ha) (resid 48 and name ca)
       (resid 48 and name c) (resid 49 and name n) 1 180.0 40.0 2
assign (resid 49 and name ha) (resid 49 and name ca)
       (resid 49 and name c) (resid 50 and name n) 1 180.0 40.0 2

!side chain chi1 from hnhb and ecosy
assign (resid 8 and name ha) (resid 9 and name ca)
       (resid 8 and name cb) (resid 9 and name hb1) 1 60.0 30.0 2
assign (resid 12 and name ha) (resid 12 and name ca)
       (resid 12 and name cb) (resid 12 and name hb1) 1 -60.0 30.0 2
assign (resid 14 and name ha) (resid 14 and name ca)
       (resid 14 and name cb) (resid 14 and name hb1) 1 -60.0 30.0 2
assign (resid 16 and name ha) (resid 16 and name ca)
       (resid 16 and name cb) (resid 16 and name hb1) 1 -60.0 30.0 2
assign (resid 18 and name ha) (resid 18 and name ca)
       (resid 18 and name cb) (resid 18 and name hb1) 1 60.0 40.0 2
assign (resid 20 and name ha) (resid 20 and name ca)
       (resid 20 and name cb) (resid 20 and name hb1) 1 180.0 60.0 2
assign (resid 21 and name ha) (resid 21 and name ca)
       (resid 21 and name cb) (resid 21 and name hb1) 1 -60.0 30.0 2
assign (resid 25 and name ha) (resid 25 and name ca)
       (resid 25 and name cb) (resid 25 and name hb1) 1 -60.0 30.0 2
assign (resid 27 and name ha) (resid 27 and name ca)
       (resid 27 and name cb) (resid 27 and name hb1) 1 60.0 30.0 2
assign (resid 28 and name ha) (resid 28 and name ca)
       (resid 28 and name cb) (resid 28 and name hb1) 1 -60.0 40.0 2
assign (resid 30 and name ha) (resid 30 and name ca)
       (resid 30 and name cb) (resid 30 and name hb1) 1 -60.0 40.0 2
assign (resid 31 and name ha) (resid 31 and name ca)
       (resid 31 and name cb) (resid 31 and name hb1) 1 180.0 60.0 2
assign (resid 34 and name ha) (resid 34 and name ca)
       (resid 34 and name cb) (resid 34 and name hb1) 1 -60.0 40.0 2
assign (resid 35 and name ha) (resid 35 and name ca)
       (resid 35 and name cb) (resid 35 and name hb1) 1 -60.0 40.0 2
assign (resid 39 and name ha) (resid 39 and name ca)
       (resid 39 and name cb) (resid 39 and name hb1) 1 60.0 30.0 2
assign (resid 40 and name ha) (resid 40 and name ca)
       (resid 40 and name cb) (resid 40 and name hb1) 1 60.0 30.0 2
assign (resid 45 and name ha) (resid 45 and name ca)
       (resid 45 and name cb) (resid 45 and name hb1) 1 180.0 30.0 2
assign (resid 46 and name ha) (resid 46 and name ca)
       (resid 46 and name cb) (resid 46 and name hb1) 1 180.0 60.0 2
assign (resid 49 and name ha) (resid 49 and name ca)
       (resid 49 and name cb) (resid 49 and name hb1) 1 -60.0 30.0 2
assign (resid 50 and name ha) (resid 50 and name ca)
       (resid 50 and name cb) (resid 50 and name hb1) 1 -60.0 30.0 2
assign (resid 51 and name ha) (resid 51 and name ca)
       (resid 51 and name cb) (resid 51 and name hb1) 1 -60.0 30.0 2
assign (resid 54 and name ha) (resid 54 and name ca)
       (resid 54 and name cb) (resid 54 and name hb1) 1 -60.0 30.0 2

end



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ARG   1          1H        ARG   1  10.770   3.043  10.409
    2   2H    ARG   1          2H        ARG   1  10.076   4.575  10.784
    3   3H    ARG   1          3H        ARG   1  11.172   4.423   9.473
    4    HA   ARG   1           HA       ARG   1   8.496   3.225   9.692
    5   1HB   ARG   1          1HB       ARG   1   8.931   5.769   9.239
    6   2HB   ARG   1          2HB       ARG   1   9.440   5.222   7.647
    7   1HG   ARG   1          1HG       ARG   1   7.139   5.933   7.577
    8   2HG   ARG   1          2HG       ARG   1   7.222   4.187   7.324
    9   1HD   ARG   1          1HD       ARG   1   6.619   3.830   9.679
   10   2HD   ARG   1          2HD       ARG   1   6.542   5.576   9.922
   11    HE   ARG   1           HE       ARG   1   4.801   4.916   7.827
   12   1HH1  ARG   1          1HH1      ARG   1   5.122   4.460  11.266
   13   2HH1  ARG   1          2HH1      ARG   1   3.416   4.292  11.542
   14   1HH2  ARG   1          1HH2      ARG   1   2.533   4.814   8.177
   15   2HH2  ARG   1          2HH2      ARG   1   1.936   4.547   9.786
   16    H    ILE   2           H        ILE   2  10.115   4.189   6.779
   17    HA   ILE   2           HA       ILE   2  10.441   3.052   4.817
   18    HB   ILE   2           HB       ILE   2  12.671   2.996   5.785
   19   1HG1  ILE   2          1HG1      ILE   2  11.972   0.385   4.448
   20   2HG1  ILE   2          2HG1      ILE   2  12.359   1.899   3.637
   21   1HG2  ILE   2          1HG2      ILE   2  11.525   1.037   7.523
   22   2HG2  ILE   2          2HG2      ILE   2  13.067   1.892   7.656
   23   3HG2  ILE   2          3HG2      ILE   2  12.970   0.388   6.740
   24   1HD1  ILE   2          1HD1      ILE   2  14.368   0.866   5.534
   25   2HD1  ILE   2          2HD1      ILE   2  14.580   1.662   3.974
   26   3HD1  ILE   2          3HD1      ILE   2  14.137  -0.045   4.035
   27    HA   PRO   3           HA       PRO   3   7.859  -0.708   5.571
   28   1HB   PRO   3          1HB       PRO   3   5.370   0.555   5.251
   29   2HB   PRO   3          2HB       PRO   3   6.124   0.104   6.780
   30   1HG   PRO   3          1HG       PRO   3   5.615   2.713   5.946
   31   2HG   PRO   3          2HG       PRO   3   6.730   2.243   7.239
   32   1HD   PRO   3          1HD       PRO   3   7.336   2.859   4.356
   33   2HD   PRO   3          2HD       PRO   3   8.234   3.337   5.820
   34    H    VAL   4           H        VAL   4   8.556   1.217   3.042
   35    HA   VAL   4           HA       VAL   4   6.935  -0.407   1.174
   36    HB   VAL   4           HB       VAL   4   7.567   2.549   0.769
   37   1HG1  VAL   4          1HG1      VAL   4   7.356   1.068  -1.260
   38   2HG1  VAL   4          2HG1      VAL   4   6.229   2.424  -1.185
   39   3HG1  VAL   4          3HG1      VAL   4   5.681   0.796  -0.788
   40   1HG2  VAL   4          1HG2      VAL   4   5.874   2.845   2.235
   41   2HG2  VAL   4          2HG2      VAL   4   5.250   1.205   2.021
   42   3HG2  VAL   4          3HG2      VAL   4   4.878   2.457   0.833
   43    H    LYS   5           H        LYS   5   8.019  -1.172  -0.611
   44    HA   LYS   5           HA       LYS   5  10.672  -0.069  -1.152
   45   1HB   LYS   5          1HB       LYS   5  10.666  -2.253   0.330
   46   2HB   LYS   5          2HB       LYS   5  10.385  -3.048  -1.214
   47   1HG   LYS   5          1HG       LYS   5  12.714  -1.217  -0.613
   48   2HG   LYS   5          2HG       LYS   5  12.767  -2.984  -0.570
   49   1HD   LYS   5          1HD       LYS   5  12.504  -3.167  -2.884
   50   2HD   LYS   5          2HD       LYS   5  11.890  -1.522  -3.043
   51   1HE   LYS   5          1HE       LYS   5  14.709  -2.244  -2.261
   52   2HE   LYS   5          2HE       LYS   5  14.195  -1.792  -3.886
   53   1HZ   LYS   5          1HZ       LYS   5  13.579   0.378  -3.107
   54   2HZ   LYS   5          2HZ       LYS   5  15.177   0.058  -2.629
   55   3HZ   LYS   5          3HZ       LYS   5  13.916  -0.048  -1.492
   56    H    TYR   6           H        TYR   6   9.056  -2.980  -2.373
   57    HA   TYR   6           HA       TYR   6   9.605  -2.351  -5.071
   58   1HB   TYR   6          1HB       TYR   6   7.502  -4.291  -4.099
   59   2HB   TYR   6          2HB       TYR   6   8.385  -4.331  -5.624
   60    HD1  TYR   6           HD1      TYR   6  11.081  -4.387  -5.289
   61    HD2  TYR   6           HD2      TYR   6   8.209  -5.781  -2.464
   62    HE1  TYR   6           HE1      TYR   6  12.782  -5.820  -4.262
   63    HE2  TYR   6           HE2      TYR   6   9.904  -7.215  -1.439
   64    HH   TYR   6           HH       TYR   6  11.984  -8.235  -1.901
   65    H    GLY   7           H        GLY   7   8.152  -1.828  -6.789
   66   1HA   GLY   7          1HA       GLY   7   5.863  -1.272  -7.468
   67   2HA   GLY   7          2HA       GLY   7   5.662  -0.468  -5.919
   68    H    ASN   8           H        ASN   8   5.090   1.467  -7.042
   69    HA   ASN   8           HA       ASN   8   7.306   2.709  -8.518
   70   1HB   ASN   8          1HB       ASN   8   5.735   4.149  -9.574
   71   2HB   ASN   8          2HB       ASN   8   5.058   2.528  -9.632
   72   1HD2  ASN   8          1HD2      ASN   8   3.837   5.230  -9.760
   73   2HD2  ASN   8          2HD2      ASN   8   2.632   5.230  -8.522
   74    H    ALA   9           H        ALA   9   6.797   2.530  -5.512
   75    HA   ALA   9           HA       ALA   9   6.716   5.339  -4.772
   76   1HB   ALA   9          1HB       ALA   9   7.158   3.436  -2.621
   77   2HB   ALA   9          2HB       ALA   9   5.699   3.109  -3.562
   78   3HB   ALA   9          3HB       ALA   9   5.925   4.685  -2.802
   79    H    ASP  10           H        ASP  10   8.686   2.644  -3.581
   80    HA   ASP  10           HA       ASP  10  10.874   2.446  -3.030
   81   1HB   ASP  10          1HB       ASP  10  10.833   3.710  -5.652
   82   2HB   ASP  10          2HB       ASP  10  12.294   4.090  -4.748
   83    H    GLY  11           H        GLY  11  10.760   3.438  -1.007
   84   1HA   GLY  11          1HA       GLY  11  12.174   4.891   0.315
   85   2HA   GLY  11          2HA       GLY  11  12.018   6.105  -0.947
   86    H    GLU  12           H        GLU  12   9.050   5.297  -1.051
   87    HA   GLU  12           HA       GLU  12   8.185   7.317   0.787
   88   1HB   GLU  12          1HB       GLU  12   6.889   5.663  -1.328
   89   2HB   GLU  12          2HB       GLU  12   5.862   6.427  -0.118
   90   1HG   GLU  12          1HG       GLU  12   6.425   8.562  -0.788
   91   2HG   GLU  12          2HG       GLU  12   7.915   8.041  -1.551
   92    H    TYR  13           H        TYR  13   6.298   6.916   2.239
   93    HA   TYR  13           HA       TYR  13   6.732   4.443   3.715
   94   1HB   TYR  13          1HB       TYR  13   5.810   5.859   5.630
   95   2HB   TYR  13          2HB       TYR  13   7.449   6.187   5.075
   96    HD1  TYR  13           HD1      TYR  13   7.848   8.138   3.575
   97    HD2  TYR  13           HD2      TYR  13   4.126   7.482   5.524
   98    HE1  TYR  13           HE1      TYR  13   7.230  10.496   3.182
   99    HE2  TYR  13           HE2      TYR  13   3.496   9.833   5.141
  100    HH   TYR  13           HH       TYR  13   4.074  11.775   4.210
  101    H    CYS  14           H        CYS  14   4.860   3.645   4.990
  102    HA   CYS  14           HA       CYS  14   2.521   3.521   3.359
  103   1HB   CYS  14          1HB       CYS  14   3.235   2.357   6.047
  104   2HB   CYS  14          2HB       CYS  14   1.636   2.161   5.340
  105    H    LYS  15           H        LYS  15   1.009   5.022   3.358
  106    HA   LYS  15           HA       LYS  15   0.750   6.834   5.619
  107   1HB   LYS  15          1HB       LYS  15   0.825   7.645   3.225
  108   2HB   LYS  15          2HB       LYS  15  -0.752   6.900   2.993
  109   1HG   LYS  15          1HG       LYS  15  -1.756   8.372   4.583
  110   2HG   LYS  15          2HG       LYS  15  -0.182   9.004   5.066
  111   1HD   LYS  15          1HD       LYS  15   0.128   9.892   2.775
  112   2HD   LYS  15          2HD       LYS  15  -1.498   9.328   2.371
  113   1HE   LYS  15          1HE       LYS  15  -2.439  10.789   4.077
  114   2HE   LYS  15          2HE       LYS  15  -0.823  11.311   4.542
  115   1HZ   LYS  15          1HZ       LYS  15  -0.853  12.844   2.964
  116   2HZ   LYS  15          2HZ       LYS  15  -2.460  12.420   2.615
  117   3HZ   LYS  15          3HZ       LYS  15  -1.195  11.690   1.764
  118    H    PHE  16           H        PHE  16  -0.454   6.152   7.217
  119    HA   PHE  16           HA       PHE  16  -2.867   4.586   6.621
  120   1HB   PHE  16          1HB       PHE  16  -1.195   4.730   9.137
  121   2HB   PHE  16          2HB       PHE  16  -2.683   3.807   8.983
  122    HD1  PHE  16           HD1      PHE  16  -0.154   2.566   9.824
  123    HD2  PHE  16           HD2      PHE  16  -1.739   3.207   5.931
  124    HE1  PHE  16           HE1      PHE  16   1.141   0.657   8.989
  125    HE2  PHE  16           HE2      PHE  16  -0.458   1.302   5.086
  126    HZ   PHE  16           HZ       PHE  16   0.995  -0.009   6.606
  127    HA   PRO  17           HA       PRO  17  -4.562   4.202   6.874
  128   1HB   PRO  17          1HB       PRO  17  -7.215   4.826   6.629
  129   2HB   PRO  17          2HB       PRO  17  -6.496   4.102   8.071
  130   1HG   PRO  17          1HG       PRO  17  -7.602   6.758   7.760
  131   2HG   PRO  17          2HG       PRO  17  -7.004   5.981   9.231
  132   1HD   PRO  17          1HD       PRO  17  -5.657   7.911   7.459
  133   2HD   PRO  17          2HD       PRO  17  -5.273   7.458   9.133
  134    H    PHE  18           H        PHE  18  -4.846   3.712   4.706
  135    HA   PHE  18           HA       PHE  18  -5.166   6.035   2.945
  136   1HB   PHE  18          1HB       PHE  18  -4.154   4.753   1.164
  137   2HB   PHE  18          2HB       PHE  18  -3.110   4.709   2.575
  138    HD1  PHE  18           HD1      PHE  18  -3.081   2.620   3.986
  139    HD2  PHE  18           HD2      PHE  18  -4.958   2.796   0.171
  140    HE1  PHE  18           HE1      PHE  18  -3.018   0.167   3.842
  141    HE2  PHE  18           HE2      PHE  18  -4.905   0.353   0.019
  142    HZ   PHE  18           HZ       PHE  18  -3.921  -0.990   1.856
  143    H    LEU  19           H        LEU  19  -6.558   5.865   1.081
  144    HA   LEU  19           HA       LEU  19  -8.943   4.306   1.738
  145   1HB   LEU  19          1HB       LEU  19  -9.029   6.772   1.332
  146   2HB   LEU  19          2HB       LEU  19  -8.595   6.461  -0.339
  147    HG   LEU  19           HG       LEU  19 -10.674   5.046  -0.514
  148   1HD1  LEU  19          1HD1      LEU  19 -11.155   6.271   2.194
  149   2HD1  LEU  19          2HD1      LEU  19 -11.126   4.558   1.768
  150   3HD1  LEU  19          3HD1      LEU  19 -12.435   5.593   1.193
  151   1HD2  LEU  19          1HD2      LEU  19 -10.363   7.885  -0.528
  152   2HD2  LEU  19          2HD2      LEU  19 -11.983   7.477   0.037
  153   3HD2  LEU  19          3HD2      LEU  19 -11.412   6.877  -1.520
  154    H    PHE  20           H        PHE  20  -9.334   2.457   0.767
  155    HA   PHE  20           HA       PHE  20  -8.386   2.072  -2.002
  156   1HB   PHE  20          1HB       PHE  20  -7.234   0.629  -0.186
  157   2HB   PHE  20          2HB       PHE  20  -8.801  -0.160  -0.043
  158    HD1  PHE  20           HD1      PHE  20  -7.089   1.003  -3.140
  159    HD2  PHE  20           HD2      PHE  20  -8.521  -2.249  -0.805
  160    HE1  PHE  20           HE1      PHE  20  -6.547  -0.565  -4.966
  161    HE2  PHE  20           HE2      PHE  20  -7.983  -3.820  -2.617
  162    HZ   PHE  20           HZ       PHE  20  -6.994  -2.968  -4.715
  163    H    ASN  21           H        ASN  21 -10.216   2.455  -3.112
  164    HA   ASN  21           HA       ASN  21 -12.322   2.257  -3.919
  165   1HB   ASN  21          1HB       ASN  21 -11.920  -0.499  -2.779
  166   2HB   ASN  21          2HB       ASN  21 -13.403  -0.048  -3.608
  167   1HD2  ASN  21          1HD2      ASN  21 -13.470  -0.381  -5.697
  168   2HD2  ASN  21          2HD2      ASN  21 -12.109  -0.581  -6.742
  169    H    GLY  22           H        GLY  22 -12.005   3.329  -1.189
  170   1HA   GLY  22          1HA       GLY  22 -13.782   4.388  -0.015
  171   2HA   GLY  22          2HA       GLY  22 -14.819   3.030  -0.401
  172    H    LYS  23           H        LYS  23 -11.951   1.730   0.580
  173    HA   LYS  23           HA       LYS  23 -12.891   1.591   3.367
  174   1HB   LYS  23          1HB       LYS  23 -13.070  -0.528   2.031
  175   2HB   LYS  23          2HB       LYS  23 -11.320  -0.514   1.865
  176   1HG   LYS  23          1HG       LYS  23 -11.074  -0.732   4.275
  177   2HG   LYS  23          2HG       LYS  23 -12.831  -0.708   4.466
  178   1HD   LYS  23          1HD       LYS  23 -13.000  -2.731   3.091
  179   2HD   LYS  23          2HD       LYS  23 -11.244  -2.764   2.927
  180   1HE   LYS  23          1HE       LYS  23 -11.005  -3.073   5.326
  181   2HE   LYS  23          2HE       LYS  23 -12.750  -2.952   5.537
  182   1HZ   LYS  23          1HZ       LYS  23 -11.265  -5.101   4.115
  183   2HZ   LYS  23          2HZ       LYS  23 -12.959  -4.949   4.096
  184   3HZ   LYS  23          3HZ       LYS  23 -12.148  -5.242   5.562
  185    H    GLU  24           H        GLU  24 -11.560   2.368   4.865
  186    HA   GLU  24           HA       GLU  24  -8.883   3.193   4.094
  187   1HB   GLU  24          1HB       GLU  24 -10.485   3.636   6.617
  188   2HB   GLU  24          2HB       GLU  24  -8.848   4.224   6.381
  189   1HG   GLU  24          1HG       GLU  24  -9.633   5.570   4.483
  190   2HG   GLU  24          2HG       GLU  24 -11.275   4.998   4.782
  191    H    TYR  25           H        TYR  25  -7.081   2.115   4.614
  192    HA   TYR  25           HA       TYR  25  -7.326  -0.112   6.528
  193   1HB   TYR  25          1HB       TYR  25  -5.400   0.254   4.250
  194   2HB   TYR  25          2HB       TYR  25  -5.308  -1.056   5.412
  195    HD1  TYR  25           HD1      TYR  25  -7.438   0.434   2.782
  196    HD2  TYR  25           HD2      TYR  25  -6.587  -3.005   5.134
  197    HE1  TYR  25           HE1      TYR  25  -8.980  -0.889   1.373
  198    HE2  TYR  25           HE2      TYR  25  -8.118  -4.337   3.730
  199    HH   TYR  25           HH       TYR  25  -9.963  -2.880   1.074
  200    H    ASN  26           H        ASN  26  -6.097  -0.139   8.303
  201    HA   ASN  26           HA       ASN  26  -4.252   2.105   8.681
  202   1HB   ASN  26          1HB       ASN  26  -5.475   0.212  10.706
  203   2HB   ASN  26          2HB       ASN  26  -4.296   1.451  11.105
  204   1HD2  ASN  26          1HD2      ASN  26  -6.564   2.239   8.650
  205   2HD2  ASN  26          2HD2      ASN  26  -7.573   3.256   9.615
  206    H    SER  27           H        SER  27  -3.830  -0.534   7.208
  207    HA   SER  27           HA       SER  27  -1.116  -0.918   8.022
  208   1HB   SER  27          1HB       SER  27  -1.364  -3.365   8.503
  209   2HB   SER  27          2HB       SER  27  -2.124  -2.327   9.712
  210    HG   SER  27           HG       SER  27  -3.263  -4.273   8.404
  211    H    CYS  28           H        CYS  28  -0.404  -3.175   6.775
  212    HA   CYS  28           HA       CYS  28  -0.944  -2.553   3.991
  213   1HB   CYS  28          1HB       CYS  28   0.803  -4.745   5.136
  214   2HB   CYS  28          2HB       CYS  28   0.811  -4.151   3.483
  215    H    THR  29           H        THR  29  -2.262  -3.675   2.659
  216    HA   THR  29           HA       THR  29  -3.388  -6.192   3.669
  217    HB   THR  29           HB       THR  29  -5.030  -4.360   3.726
  218    HG1  THR  29           HG1      THR  29  -5.658  -6.551   3.111
  219   1HG2  THR  29          1HG2      THR  29  -5.812  -3.879   1.149
  220   2HG2  THR  29          2HG2      THR  29  -4.053  -3.825   1.025
  221   3HG2  THR  29          3HG2      THR  29  -4.890  -2.770   2.165
  222    H    ASP  30           H        ASP  30  -4.122  -7.707   1.953
  223    HA   ASP  30           HA       ASP  30  -2.372  -7.484  -0.382
  224   1HB   ASP  30          1HB       ASP  30  -3.631 -10.049  -0.060
  225   2HB   ASP  30          2HB       ASP  30  -1.956  -9.675  -0.325
  226    H    THR  31           H        THR  31  -5.205  -6.488   0.304
  227    HA   THR  31           HA       THR  31  -7.045  -7.766  -1.405
  228    HB   THR  31           HB       THR  31  -7.002  -4.872  -0.540
  229    HG1  THR  31           HG1      THR  31  -7.000  -5.940   1.337
  230   1HG2  THR  31          1HG2      THR  31  -8.776  -6.048  -2.243
  231   2HG2  THR  31          2HG2      THR  31  -9.100  -4.634  -1.240
  232   3HG2  THR  31          3HG2      THR  31  -9.568  -6.241  -0.682
  233    H    GLY  32           H        GLY  32  -7.524  -7.483  -3.539
  234   1HA   GLY  32          1HA       GLY  32  -7.430  -6.534  -5.660
  235   2HA   GLY  32          2HA       GLY  32  -6.327  -5.319  -5.041
  236    H    ARG  33           H        ARG  33  -4.826  -7.651  -3.779
  237    HA   ARG  33           HA       ARG  33  -3.153  -8.255  -6.108
  238   1HB   ARG  33          1HB       ARG  33  -2.553  -8.545  -3.158
  239   2HB   ARG  33          2HB       ARG  33  -1.408  -8.774  -4.466
  240   1HG   ARG  33          1HG       ARG  33  -2.736  -6.202  -3.649
  241   2HG   ARG  33          2HG       ARG  33  -1.050  -6.647  -3.397
  242   1HD   ARG  33          1HD       ARG  33  -2.426  -6.147  -6.029
  243   2HD   ARG  33          2HD       ARG  33  -1.216  -5.124  -5.256
  244    HE   ARG  33           HE       ARG  33  -0.313  -7.814  -5.803
  245   1HH1  ARG  33          1HH1      ARG  33  -0.638  -4.556  -7.025
  246   2HH1  ARG  33          2HH1      ARG  33   0.571  -4.765  -8.260
  247   1HH2  ARG  33          1HH2      ARG  33   1.191  -8.126  -7.438
  248   2HH2  ARG  33          2HH2      ARG  33   1.631  -6.815  -8.490
  249    H    SER  34           H        SER  34  -3.802 -10.153  -7.029
  250    HA   SER  34           HA       SER  34  -4.847 -12.289  -5.393
  251   1HB   SER  34          1HB       SER  34  -4.182 -12.175  -8.345
  252   2HB   SER  34          2HB       SER  34  -4.926 -13.559  -7.541
  253    HG   SER  34           HG       SER  34  -6.743 -12.419  -7.197
  254    H    ASP  35           H        ASP  35  -1.872 -11.163  -5.730
  255    HA   ASP  35           HA       ASP  35  -0.488 -13.662  -5.969
  256   1HB   ASP  35          1HB       ASP  35   1.116 -11.387  -5.259
  257   2HB   ASP  35          2HB       ASP  35   1.301 -12.476  -6.605
  258    H    GLY  36           H        GLY  36  -1.894 -11.878  -3.621
  259   1HA   GLY  36          1HA       GLY  36  -1.980 -12.160  -1.334
  260   2HA   GLY  36          2HA       GLY  36  -0.793 -13.445  -1.503
  261    H    PHE  37           H        PHE  37  -0.079 -10.333  -2.866
  262    HA   PHE  37           HA       PHE  37   2.064 -10.036  -0.912
  263   1HB   PHE  37          1HB       PHE  37   1.508  -8.758  -3.576
  264   2HB   PHE  37          2HB       PHE  37   2.685  -8.061  -2.471
  265    HD1  PHE  37           HD1      PHE  37   4.179 -10.196  -1.396
  266    HD2  PHE  37           HD2      PHE  37   2.517  -9.842  -5.297
  267    HE1  PHE  37           HE1      PHE  37   5.903 -11.720  -2.266
  268    HE2  PHE  37           HE2      PHE  37   4.233 -11.367  -6.173
  269    HZ   PHE  37           HZ       PHE  37   5.930 -12.310  -4.657
  270    H    LEU  38           H        LEU  38   2.041  -8.599   0.707
  271    HA   LEU  38           HA       LEU  38  -0.288  -6.969   1.079
  272   1HB   LEU  38          1HB       LEU  38   1.293  -6.201   3.099
  273   2HB   LEU  38          2HB       LEU  38   0.266  -7.606   3.167
  274    HG   LEU  38           HG       LEU  38   2.548  -7.933   4.117
  275   1HD1  LEU  38          1HD1      LEU  38   1.445  -9.628   1.956
  276   2HD1  LEU  38          2HD1      LEU  38   1.658  -9.968   3.674
  277   3HD1  LEU  38          3HD1      LEU  38   3.046 -10.012   2.585
  278   1HD2  LEU  38          1HD2      LEU  38   3.399  -6.689   1.776
  279   2HD2  LEU  38          2HD2      LEU  38   3.920  -8.368   1.640
  280   3HD2  LEU  38          3HD2      LEU  38   4.400  -7.410   3.040
  281    H    TRP  39           H        TRP  39  -0.479  -4.827   0.792
  282    HA   TRP  39           HA       TRP  39   1.935  -3.287   0.191
  283   1HB   TRP  39          1HB       TRP  39   0.933  -2.297  -1.808
  284   2HB   TRP  39          2HB       TRP  39   1.008  -4.046  -1.979
  285    HD1  TRP  39           HD1      TRP  39  -1.376  -5.387  -1.737
  286    HE1  TRP  39           HE1      TRP  39  -3.771  -4.619  -2.249
  287    HE3  TRP  39           HE3      TRP  39  -0.624  -0.330  -1.797
  288    HZ2  TRP  39           HZ2      TRP  39  -5.152  -2.193  -2.631
  289    HZ3  TRP  39           HZ3      TRP  39  -2.539   1.135  -2.246
  290    HH2  TRP  39           HH2      TRP  39  -4.757   0.216  -2.650
  291    H    CYS  40           H        CYS  40   1.322  -0.908  -0.096
  292    HA   CYS  40           HA       CYS  40  -1.003  -0.027   1.390
  293   1HB   CYS  40          1HB       CYS  40   0.187   1.134   3.105
  294   2HB   CYS  40          2HB       CYS  40   0.827  -0.506   3.097
  295    H    SER  41           H        SER  41  -1.018   2.460   1.361
  296    HA   SER  41           HA       SER  41   0.290   3.329  -1.125
  297   1HB   SER  41          1HB       SER  41  -2.190   3.253  -1.255
  298   2HB   SER  41          2HB       SER  41  -2.273   4.405   0.079
  299    HG   SER  41           HG       SER  41  -1.030   4.861  -2.443
  300    H    THR  42           H        THR  42   0.790   5.641  -1.218
  301    HA   THR  42           HA       THR  42   1.623   6.675   1.409
  302    HB   THR  42           HB       THR  42   2.956   7.175  -1.271
  303    HG1  THR  42           HG1      THR  42   3.782   5.439   0.821
  304   1HG2  THR  42          1HG2      THR  42   3.451   8.891   0.430
  305   2HG2  THR  42          2HG2      THR  42   4.862   7.934  -0.023
  306   3HG2  THR  42          3HG2      THR  42   4.038   7.621   1.504
  307    H    THR  43           H        THR  43  -0.747   6.923  -0.526
  308    HA   THR  43           HA       THR  43  -0.975   9.853  -0.375
  309    HB   THR  43           HB       THR  43  -2.460   9.539  -2.493
  310    HG1  THR  43           HG1      THR  43  -1.909   7.073  -2.173
  311   1HG2  THR  43          1HG2      THR  43  -0.809  10.503  -3.593
  312   2HG2  THR  43          2HG2      THR  43   0.170   9.038  -3.536
  313   3HG2  THR  43          3HG2      THR  43   0.230  10.191  -2.203
  314    H    TYR  44           H        TYR  44  -3.511  10.317  -0.894
  315    HA   TYR  44           HA       TYR  44  -4.918   9.031   1.265
  316   1HB   TYR  44          1HB       TYR  44  -5.651  11.194  -0.665
  317   2HB   TYR  44          2HB       TYR  44  -6.826  10.538   0.467
  318    HD1  TYR  44           HD1      TYR  44  -5.650  10.353   2.974
  319    HD2  TYR  44           HD2      TYR  44  -4.778  13.231  -0.039
  320    HE1  TYR  44           HE1      TYR  44  -4.855  11.907   4.696
  321    HE2  TYR  44           HE2      TYR  44  -3.984  14.793   1.685
  322    HH   TYR  44           HH       TYR  44  -4.403  14.152   5.079
  323    H    ASN  45           H        ASN  45  -6.150   9.714  -1.990
  324    HA   ASN  45           HA       ASN  45  -7.554   7.164  -1.947
  325   1HB   ASN  45          1HB       ASN  45  -8.700   9.298  -2.647
  326   2HB   ASN  45          2HB       ASN  45  -7.644   9.356  -4.039
  327   1HD2  ASN  45          1HD2      ASN  45  -8.017   6.248  -4.031
  328   2HD2  ASN  45          2HD2      ASN  45  -9.502   6.150  -4.837
  329    H    PHE  46           H        PHE  46  -6.280   5.497  -2.512
  330    HA   PHE  46           HA       PHE  46  -3.935   5.641  -4.005
  331   1HB   PHE  46          1HB       PHE  46  -4.230   3.782  -2.588
  332   2HB   PHE  46          2HB       PHE  46  -5.767   3.335  -3.368
  333    HD1  PHE  46           HD1      PHE  46  -5.716   1.631  -4.948
  334    HD2  PHE  46           HD2      PHE  46  -2.122   3.789  -4.185
  335    HE1  PHE  46           HE1      PHE  46  -4.498   0.138  -6.469
  336    HE2  PHE  46           HE2      PHE  46  -0.913   2.293  -5.700
  337    HZ   PHE  46           HZ       PHE  46  -2.096   0.464  -6.842
  338    H    GLU  47           H        GLU  47  -7.216   5.019  -5.145
  339    HA   GLU  47           HA       GLU  47  -6.552   4.040  -7.672
  340   1HB   GLU  47          1HB       GLU  47  -8.836   4.181  -6.419
  341   2HB   GLU  47          2HB       GLU  47  -8.996   5.709  -7.273
  342   1HG   GLU  47          1HG       GLU  47  -8.742   4.578  -9.403
  343   2HG   GLU  47          2HG       GLU  47  -8.524   3.036  -8.571
  344    H    LYS  48           H        LYS  48  -7.267   7.434  -6.744
  345    HA   LYS  48           HA       LYS  48  -6.956   8.393  -9.388
  346   1HB   LYS  48          1HB       LYS  48  -6.852  10.649  -8.346
  347   2HB   LYS  48          2HB       LYS  48  -8.251   9.699  -7.876
  348   1HG   LYS  48          1HG       LYS  48  -7.508   9.414  -5.722
  349   2HG   LYS  48          2HG       LYS  48  -5.818   9.674  -6.154
  350   1HD   LYS  48          1HD       LYS  48  -7.943  11.814  -6.204
  351   2HD   LYS  48          2HD       LYS  48  -6.831  11.536  -4.859
  352   1HE   LYS  48          1HE       LYS  48  -4.927  11.903  -6.399
  353   2HE   LYS  48          2HE       LYS  48  -6.069  12.281  -7.689
  354   1HZ   LYS  48          1HZ       LYS  48  -5.325  13.851  -5.328
  355   2HZ   LYS  48          2HZ       LYS  48  -6.914  14.007  -5.907
  356   3HZ   LYS  48          3HZ       LYS  48  -5.596  14.363  -6.925
  357    H    ASP  49           H        ASP  49  -4.687   8.369  -6.627
  358    HA   ASP  49           HA       ASP  49  -2.658   9.679  -8.198
  359   1HB   ASP  49          1HB       ASP  49  -2.610   8.485  -5.421
  360   2HB   ASP  49          2HB       ASP  49  -1.217   9.258  -6.171
  361    H    GLY  50           H        GLY  50  -2.858   6.460  -6.662
  362   1HA   GLY  50          1HA       GLY  50  -2.304   4.446  -7.728
  363   2HA   GLY  50          2HA       GLY  50  -1.491   5.363  -8.976
  364    H    LYS  51           H        LYS  51  -0.487   6.518  -5.986
  365    HA   LYS  51           HA       LYS  51   2.078   5.265  -6.309
  366   1HB   LYS  51          1HB       LYS  51   1.080   7.157  -4.219
  367   2HB   LYS  51          2HB       LYS  51   2.765   6.692  -4.469
  368   1HG   LYS  51          1HG       LYS  51   2.620   7.566  -6.767
  369   2HG   LYS  51          2HG       LYS  51   0.977   8.108  -6.427
  370   1HD   LYS  51          1HD       LYS  51   2.190   9.992  -6.055
  371   2HD   LYS  51          2HD       LYS  51   2.055   9.305  -4.440
  372   1HE   LYS  51          1HE       LYS  51   4.293   8.303  -4.709
  373   2HE   LYS  51          2HE       LYS  51   4.433   9.083  -6.285
  374   1HZ   LYS  51          1HZ       LYS  51   5.553  10.359  -4.577
  375   2HZ   LYS  51          2HZ       LYS  51   4.125  10.465  -3.672
  376   3HZ   LYS  51          3HZ       LYS  51   4.234  11.237  -5.186
  377    H    TYR  52           H        TYR  52   2.644   3.358  -5.437
  378    HA   TYR  52           HA       TYR  52   1.662   2.592  -2.807
  379   1HB   TYR  52          1HB       TYR  52   0.725   0.500  -3.550
  380   2HB   TYR  52          2HB       TYR  52  -0.015   1.779  -4.506
  381    HD1  TYR  52           HD1      TYR  52   2.171  -1.139  -4.583
  382    HD2  TYR  52           HD2      TYR  52   0.604   2.085  -6.877
  383    HE1  TYR  52           HE1      TYR  52   2.924  -2.249  -6.636
  384    HE2  TYR  52           HE2      TYR  52   1.347   0.977  -8.939
  385    HH   TYR  52           HH       TYR  52   3.208  -2.035  -8.857
  386    H    GLY  53           H        GLY  53   2.534   0.294  -2.369
  387   1HA   GLY  53          1HA       GLY  53   4.813  -0.645  -3.690
  388   2HA   GLY  53          2HA       GLY  53   5.299   0.336  -2.319
  389    H    PHE  54           H        PHE  54   5.887  -2.384  -2.469
  390    HA   PHE  54           HA       PHE  54   3.899  -3.664  -0.780
  391   1HB   PHE  54          1HB       PHE  54   6.388  -4.791  -2.041
  392   2HB   PHE  54          2HB       PHE  54   5.202  -5.721  -1.131
  393    HD1  PHE  54           HD1      PHE  54   2.675  -5.178  -2.004
  394    HD2  PHE  54           HD2      PHE  54   6.237  -5.004  -4.327
  395    HE1  PHE  54           HE1      PHE  54   1.349  -5.488  -4.049
  396    HE2  PHE  54           HE2      PHE  54   4.914  -5.316  -6.378
  397    HZ   PHE  54           HZ       PHE  54   2.473  -5.557  -6.244
  398    H    CYS  55           H        CYS  55   4.135  -4.092   1.304
  399    HA   CYS  55           HA       CYS  55   6.220  -2.750   2.735
  400   1HB   CYS  55          1HB       CYS  55   4.214  -4.661   3.917
  401   2HB   CYS  55          2HB       CYS  55   4.989  -3.276   4.685
  402    HA   PRO  56           HA       PRO  56   8.819  -6.413   2.703
  403   1HB   PRO  56          1HB       PRO  56  11.062  -5.232   3.545
  404   2HB   PRO  56          2HB       PRO  56  10.448  -4.999   1.905
  405   1HG   PRO  56          1HG       PRO  56  10.266  -3.179   4.267
  406   2HG   PRO  56          2HG       PRO  56  10.560  -2.779   2.566
  407   1HD   PRO  56          1HD       PRO  56   8.111  -2.556   3.828
  408   2HD   PRO  56          2HD       PRO  56   8.332  -2.722   2.076
  409    H    HIS  57           H        HIS  57   7.142  -6.729   4.661
  410    HA   HIS  57           HA       HIS  57   8.366  -6.362   7.253
  411   1HB   HIS  57          1HB       HIS  57   5.806  -6.378   6.590
  412   2HB   HIS  57          2HB       HIS  57   5.970  -8.112   6.850
  413    HD1  HIS  57           HD1      HIS  57   4.130  -7.313   8.779
  414    HD2  HIS  57           HD2      HIS  57   8.148  -6.403   9.401
  415    HE1  HIS  57           HE1      HIS  57   4.346  -6.823  11.239
  416    H    GLU  58           H        GLU  58   6.829  -9.355   6.175
  417    HA   GLU  58           HA       GLU  58   9.191 -10.804   7.105
  418   1HB   GLU  58          1HB       GLU  58   7.707 -12.806   7.047
  419   2HB   GLU  58          2HB       GLU  58   7.159 -11.551   8.143
  420   1HG   GLU  58          1HG       GLU  58   6.055 -11.742   5.364
  421   2HG   GLU  58          2HG       GLU  58   5.441 -12.771   6.658
  422    H    ALA  59           H        ALA  59   9.979 -12.627   5.807
  423    HA   ALA  59           HA       ALA  59   9.895 -11.958   2.965
  424   1HB   ALA  59          1HB       ALA  59  11.703 -13.945   3.096
  425   2HB   ALA  59          2HB       ALA  59  11.800 -13.339   4.749
  426   3HB   ALA  59          3HB       ALA  59  12.095 -12.249   3.395
  Start of MODEL    2
    1   1H    ARG   1          1H        ARG   1  10.828   2.759  10.487
    2   2H    ARG   1          2H        ARG   1  10.037   1.271  10.834
    3   3H    ARG   1          3H        ARG   1   9.385   2.748  11.419
    4    HA   ARG   1           HA       ARG   1   8.447   1.572   9.327
    5   1HB   ARG   1          1HB       ARG   1   7.802   3.752  10.466
    6   2HB   ARG   1          2HB       ARG   1   8.930   4.555   9.385
    7   1HG   ARG   1          1HG       ARG   1   7.630   3.976   7.466
    8   2HG   ARG   1          2HG       ARG   1   6.597   2.907   8.423
    9   1HD   ARG   1          1HD       ARG   1   6.345   5.274   9.756
   10   2HD   ARG   1          2HD       ARG   1   6.515   5.812   8.087
   11    HE   ARG   1           HE       ARG   1   4.455   4.934   7.610
   12   1HH1  ARG   1          1HH1      ARG   1   5.549   3.701  10.693
   13   2HH1  ARG   1          2HH1      ARG   1   4.035   2.945  11.077
   14   1HH2  ARG   1          1HH2      ARG   1   2.461   3.914   8.097
   15   2HH2  ARG   1          2HH2      ARG   1   2.290   3.050   9.599
   16    H    ILE   2           H        ILE   2   9.532   0.583   7.720
   17    HA   ILE   2           HA       ILE   2  11.880   1.651   6.528
   18    HB   ILE   2           HB       ILE   2  11.594  -0.172   4.826
   19   1HG1  ILE   2          1HG1      ILE   2   9.086  -0.768   6.405
   20   2HG1  ILE   2          2HG1      ILE   2   9.175  -0.226   4.736
   21   1HG2  ILE   2          1HG2      ILE   2  12.857  -1.234   6.432
   22   2HG2  ILE   2          2HG2      ILE   2  11.355  -2.058   6.823
   23   3HG2  ILE   2          3HG2      ILE   2  11.830  -0.633   7.737
   24   1HD1  ILE   2          1HD1      ILE   2  10.237  -2.847   5.755
   25   2HD1  ILE   2          2HD1      ILE   2  10.197  -2.311   4.075
   26   3HD1  ILE   2          3HD1      ILE   2   8.689  -2.618   4.940
   27    HA   PRO   3           HA       PRO   3  10.244   4.194   3.359
   28   1HB   PRO   3          1HB       PRO   3  12.201   4.146   1.552
   29   2HB   PRO   3          2HB       PRO   3  12.433   4.860   3.153
   30   1HG   PRO   3          1HG       PRO   3  13.259   2.159   2.147
   31   2HG   PRO   3          2HG       PRO   3  14.177   3.317   3.129
   32   1HD   PRO   3          1HD       PRO   3  12.851   1.152   4.179
   33   2HD   PRO   3          2HD       PRO   3  13.169   2.644   5.085
   34    H    VAL   4           H        VAL   4   9.373   1.337   3.194
   35    HA   VAL   4           HA       VAL   4   8.090   0.073   1.762
   36    HB   VAL   4           HB       VAL   4   8.564   2.333  -0.234
   37   1HG1  VAL   4          1HG1      VAL   4   7.806   0.434  -1.437
   38   2HG1  VAL   4          2HG1      VAL   4   6.409   1.486  -1.210
   39   3HG1  VAL   4          3HG1      VAL   4   6.598   0.049  -0.205
   40   1HG2  VAL   4          1HG2      VAL   4   7.468   3.355   1.564
   41   2HG2  VAL   4          2HG2      VAL   4   6.479   1.932   1.898
   42   3HG2  VAL   4          3HG2      VAL   4   6.153   2.914   0.471
   43    H    LYS   5           H        LYS   5   8.321  -1.370  -0.184
   44    HA   LYS   5           HA       LYS   5  11.192  -1.706  -0.718
   45   1HB   LYS   5          1HB       LYS   5   9.022  -3.549  -0.110
   46   2HB   LYS   5          2HB       LYS   5   9.947  -4.042  -1.521
   47   1HG   LYS   5          1HG       LYS   5  11.068  -3.484   1.227
   48   2HG   LYS   5          2HG       LYS   5  10.795  -5.078   0.506
   49   1HD   LYS   5          1HD       LYS   5  12.448  -4.639  -1.200
   50   2HD   LYS   5          2HD       LYS   5  12.669  -2.988  -0.616
   51   1HE   LYS   5          1HE       LYS   5  13.265  -5.494   0.968
   52   2HE   LYS   5          2HE       LYS   5  14.467  -4.522   0.123
   53   1HZ   LYS   5          1HZ       LYS   5  13.266  -2.667   1.631
   54   2HZ   LYS   5          2HZ       LYS   5  14.653  -3.520   2.108
   55   3HZ   LYS   5          3HZ       LYS   5  13.126  -4.025   2.649
   56    H    TYR   6           H        TYR   6   8.531  -3.136  -2.520
   57    HA   TYR   6           HA       TYR   6   9.717  -2.055  -4.974
   58   1HB   TYR   6          1HB       TYR   6   7.636  -4.240  -4.777
   59   2HB   TYR   6          2HB       TYR   6   8.692  -3.873  -6.138
   60    HD1  TYR   6           HD1      TYR   6   8.250  -6.539  -4.531
   61    HD2  TYR   6           HD2      TYR   6  11.279  -3.544  -4.465
   62    HE1  TYR   6           HE1      TYR   6   9.856  -8.190  -3.722
   63    HE2  TYR   6           HE2      TYR   6  12.888  -5.196  -3.644
   64    HH   TYR   6           HH       TYR   6  12.496  -8.391  -3.880
   65    H    GLY   7           H        GLY   7   8.191  -1.588  -6.771
   66   1HA   GLY   7          1HA       GLY   7   5.868  -1.065  -7.345
   67   2HA   GLY   7          2HA       GLY   7   5.716  -0.275  -5.791
   68    H    ASN   8           H        ASN   8   5.043   1.619  -6.904
   69    HA   ASN   8           HA       ASN   8   7.172   2.970  -8.423
   70   1HB   ASN   8          1HB       ASN   8   5.480   4.246  -9.542
   71   2HB   ASN   8          2HB       ASN   8   4.991   2.554  -9.578
   72   1HD2  ASN   8          1HD2      ASN   8   3.354   4.915  -9.885
   73   2HD2  ASN   8          2HD2      ASN   8   2.196   4.874  -8.600
   74    H    ALA   9           H        ALA   9   6.176   2.913  -5.371
   75    HA   ALA   9           HA       ALA   9   5.778   5.647  -4.717
   76   1HB   ALA   9          1HB       ALA   9   6.859   4.330  -2.491
   77   2HB   ALA   9          2HB       ALA   9   5.874   3.145  -3.349
   78   3HB   ALA   9          3HB       ALA   9   5.166   4.675  -2.829
   79    H    ASP  10           H        ASP  10   7.226   7.215  -4.107
   80    HA   ASP  10           HA       ASP  10   9.980   6.715  -4.875
   81   1HB   ASP  10          1HB       ASP  10   8.501   9.270  -4.258
   82   2HB   ASP  10          2HB       ASP  10  10.210   9.209  -4.670
   83    H    GLY  11           H        GLY  11  10.255   5.349  -2.898
   84   1HA   GLY  11          1HA       GLY  11  11.230   5.017  -0.851
   85   2HA   GLY  11          2HA       GLY  11  11.975   6.581  -1.115
   86    H    GLU  12           H        GLU  12   8.495   6.350  -0.838
   87    HA   GLU  12           HA       GLU  12   8.666   7.918   1.600
   88   1HB   GLU  12          1HB       GLU  12   6.332   7.174  -0.169
   89   2HB   GLU  12          2HB       GLU  12   6.161   8.082   1.325
   90   1HG   GLU  12          1HG       GLU  12   7.590   9.840   0.422
   91   2HG   GLU  12          2HG       GLU  12   7.745   8.951  -1.086
   92    H    TYR  13           H        TYR  13   6.202   7.073   2.811
   93    HA   TYR  13           HA       TYR  13   6.896   4.352   3.600
   94   1HB   TYR  13          1HB       TYR  13   6.320   4.911   5.847
   95   2HB   TYR  13          2HB       TYR  13   7.581   5.985   5.271
   96    HD1  TYR  13           HD1      TYR  13   7.048   8.305   4.726
   97    HD2  TYR  13           HD2      TYR  13   4.177   5.691   6.429
   98    HE1  TYR  13           HE1      TYR  13   5.665  10.245   5.348
   99    HE2  TYR  13           HE2      TYR  13   2.780   7.608   7.074
  100    HH   TYR  13           HH       TYR  13   3.757  10.581   7.348
  101    H    CYS  14           H        CYS  14   5.052   3.272   4.823
  102    HA   CYS  14           HA       CYS  14   2.709   3.326   3.192
  103   1HB   CYS  14          1HB       CYS  14   3.357   1.897   5.779
  104   2HB   CYS  14          2HB       CYS  14   1.870   1.649   4.872
  105    H    LYS  15           H        LYS  15   1.316   4.954   3.350
  106    HA   LYS  15           HA       LYS  15   1.073   6.427   5.822
  107   1HB   LYS  15          1HB       LYS  15   0.904   7.159   3.175
  108   2HB   LYS  15          2HB       LYS  15  -0.785   7.140   3.668
  109   1HG   LYS  15          1HG       LYS  15  -0.356   8.700   5.432
  110   2HG   LYS  15          2HG       LYS  15   1.380   8.618   5.148
  111   1HD   LYS  15          1HD       LYS  15   0.970   9.521   2.855
  112   2HD   LYS  15          2HD       LYS  15  -0.717   9.765   3.318
  113   1HE   LYS  15          1HE       LYS  15  -0.031  11.245   5.119
  114   2HE   LYS  15          2HE       LYS  15   1.665  10.962   4.736
  115   1HZ   LYS  15          1HZ       LYS  15  -0.266  12.705   3.454
  116   2HZ   LYS  15          2HZ       LYS  15   0.706  11.825   2.374
  117   3HZ   LYS  15          3HZ       LYS  15   1.425  12.832   3.543
  118    H    PHE  16           H        PHE  16  -0.274   5.904   7.348
  119    HA   PHE  16           HA       PHE  16  -2.717   4.406   6.654
  120   1HB   PHE  16          1HB       PHE  16  -1.084   4.343   9.204
  121   2HB   PHE  16          2HB       PHE  16  -2.568   3.436   8.928
  122    HD1  PHE  16           HD1      PHE  16   0.045   2.243   9.744
  123    HD2  PHE  16           HD2      PHE  16  -1.642   2.937   5.905
  124    HE1  PHE  16           HE1      PHE  16   1.375   0.396   8.835
  125    HE2  PHE  16           HE2      PHE  16  -0.325   1.089   4.980
  126    HZ   PHE  16           HZ       PHE  16   1.207  -0.204   6.441
  127    HA   PRO  17           HA       PRO  17  -4.460   4.048   7.020
  128   1HB   PRO  17          1HB       PRO  17  -7.086   4.900   6.806
  129   2HB   PRO  17          2HB       PRO  17  -6.424   3.981   8.159
  130   1HG   PRO  17          1HG       PRO  17  -7.354   6.694   8.168
  131   2HG   PRO  17          2HG       PRO  17  -6.690   5.763   9.517
  132   1HD   PRO  17          1HD       PRO  17  -5.379   7.767   7.791
  133   2HD   PRO  17          2HD       PRO  17  -4.950   7.223   9.422
  134    H    PHE  18           H        PHE  18  -4.916   3.628   4.860
  135    HA   PHE  18           HA       PHE  18  -5.031   6.008   3.139
  136   1HB   PHE  18          1HB       PHE  18  -3.957   4.734   1.393
  137   2HB   PHE  18          2HB       PHE  18  -3.011   4.592   2.861
  138    HD1  PHE  18           HD1      PHE  18  -5.548   2.770   0.825
  139    HD2  PHE  18           HD2      PHE  18  -2.359   2.527   3.629
  140    HE1  PHE  18           HE1      PHE  18  -5.548   0.327   0.596
  141    HE2  PHE  18           HE2      PHE  18  -2.352   0.083   3.412
  142    HZ   PHE  18           HZ       PHE  18  -3.937  -1.041   1.888
  143    H    LEU  19           H        LEU  19  -6.297   5.741   1.091
  144    HA   LEU  19           HA       LEU  19  -8.750   4.236   1.700
  145   1HB   LEU  19          1HB       LEU  19  -8.752   6.757   1.345
  146   2HB   LEU  19          2HB       LEU  19  -8.419   6.419  -0.342
  147    HG   LEU  19           HG       LEU  19 -10.542   5.050  -0.375
  148   1HD1  LEU  19          1HD1      LEU  19 -12.181   5.464   1.354
  149   2HD1  LEU  19          2HD1      LEU  19 -11.032   6.471   2.234
  150   3HD1  LEU  19          3HD1      LEU  19 -10.730   4.743   2.048
  151   1HD2  LEU  19          1HD2      LEU  19 -11.358   6.862  -1.358
  152   2HD2  LEU  19          2HD2      LEU  19 -10.135   7.845  -0.554
  153   3HD2  LEU  19          3HD2      LEU  19 -11.698   7.581   0.216
  154    H    PHE  20           H        PHE  20  -9.243   2.515   0.554
  155    HA   PHE  20           HA       PHE  20  -8.089   2.172  -2.145
  156   1HB   PHE  20          1HB       PHE  20  -7.110   0.614  -0.390
  157   2HB   PHE  20          2HB       PHE  20  -8.736  -0.024  -0.192
  158    HD1  PHE  20           HD1      PHE  20  -6.941   0.852  -3.334
  159    HD2  PHE  20           HD2      PHE  20  -8.703  -2.152  -0.892
  160    HE1  PHE  20           HE1      PHE  20  -6.581  -0.819  -5.116
  161    HE2  PHE  20           HE2      PHE  20  -8.350  -3.830  -2.661
  162    HZ   PHE  20           HZ       PHE  20  -7.291  -3.153  -4.790
  163    H    ASN  21           H        ASN  21  -9.802   2.715  -3.362
  164    HA   ASN  21           HA       ASN  21 -11.840   2.659  -4.359
  165   1HB   ASN  21          1HB       ASN  21 -11.709  -0.129  -3.238
  166   2HB   ASN  21          2HB       ASN  21 -13.094   0.430  -4.168
  167   1HD2  ASN  21          1HD2      ASN  21 -13.019  -0.169  -6.180
  168   2HD2  ASN  21          2HD2      ASN  21 -11.604  -0.319  -7.157
  169    H    GLY  22           H        GLY  22 -11.601   3.398  -1.380
  170   1HA   GLY  22          1HA       GLY  22 -13.471   4.646  -0.438
  171   2HA   GLY  22          2HA       GLY  22 -14.505   3.297  -0.860
  172    H    LYS  23           H        LYS  23 -11.990   1.684   0.179
  173    HA   LYS  23           HA       LYS  23 -12.963   1.656   2.946
  174   1HB   LYS  23          1HB       LYS  23 -13.048  -0.481   1.659
  175   2HB   LYS  23          2HB       LYS  23 -11.297  -0.434   1.520
  176   1HG   LYS  23          1HG       LYS  23 -11.067  -0.619   3.929
  177   2HG   LYS  23          2HG       LYS  23 -12.821  -0.584   4.114
  178   1HD   LYS  23          1HD       LYS  23 -12.997  -2.665   2.832
  179   2HD   LYS  23          2HD       LYS  23 -11.240  -2.699   2.649
  180   1HE   LYS  23          1HE       LYS  23 -12.027  -4.185   4.444
  181   2HE   LYS  23          2HE       LYS  23 -10.960  -2.913   5.047
  182   1HZ   LYS  23          1HZ       LYS  23 -13.067  -3.398   6.359
  183   2HZ   LYS  23          2HZ       LYS  23 -13.911  -2.629   5.098
  184   3HZ   LYS  23          3HZ       LYS  23 -12.748  -1.767   5.997
  185    H    GLU  24           H        GLU  24 -11.661   2.049   4.644
  186    HA   GLU  24           HA       GLU  24  -9.010   3.132   4.067
  187   1HB   GLU  24          1HB       GLU  24 -10.604   3.234   6.633
  188   2HB   GLU  24          2HB       GLU  24  -9.145   4.142   6.280
  189   1HG   GLU  24          1HG       GLU  24 -10.250   5.506   4.731
  190   2HG   GLU  24          2HG       GLU  24 -11.641   4.427   4.654
  191    H    TYR  25           H        TYR  25  -7.168   2.143   4.672
  192    HA   TYR  25           HA       TYR  25  -7.409  -0.242   6.382
  193   1HB   TYR  25          1HB       TYR  25  -5.461   0.303   4.156
  194   2HB   TYR  25          2HB       TYR  25  -5.339  -1.071   5.245
  195    HD1  TYR  25           HD1      TYR  25  -7.493   0.525   2.700
  196    HD2  TYR  25           HD2      TYR  25  -6.606  -3.023   4.869
  197    HE1  TYR  25           HE1      TYR  25  -9.039  -0.735   1.246
  198    HE2  TYR  25           HE2      TYR  25  -8.138  -4.298   3.412
  199    HH   TYR  25           HH       TYR  25  -9.599  -4.211   1.753
  200    H    ASN  26           H        ASN  26  -6.176  -0.413   8.151
  201    HA   ASN  26           HA       ASN  26  -4.512   1.895   8.840
  202   1HB   ASN  26          1HB       ASN  26  -5.648  -0.343  10.534
  203   2HB   ASN  26          2HB       ASN  26  -4.565   0.895  11.158
  204   1HD2  ASN  26          1HD2      ASN  26  -6.601   2.109   8.758
  205   2HD2  ASN  26          2HD2      ASN  26  -7.785   2.837   9.786
  206    H    SER  27           H        SER  27  -4.008  -0.897   7.320
  207    HA   SER  27           HA       SER  27  -1.209  -0.980   8.003
  208   1HB   SER  27          1HB       SER  27  -1.203  -3.418   8.511
  209   2HB   SER  27          2HB       SER  27  -2.085  -2.481   9.720
  210    HG   SER  27           HG       SER  27  -2.958  -4.552   8.388
  211    H    CYS  28           H        CYS  28  -0.403  -3.236   6.732
  212    HA   CYS  28           HA       CYS  28  -0.935  -2.601   3.973
  213   1HB   CYS  28          1HB       CYS  28   0.625  -4.943   5.088
  214   2HB   CYS  28          2HB       CYS  28   0.683  -4.332   3.443
  215    H    THR  29           H        THR  29  -2.246  -3.691   2.555
  216    HA   THR  29           HA       THR  29  -3.598  -6.057   3.617
  217    HB   THR  29           HB       THR  29  -5.083  -4.077   3.519
  218    HG1  THR  29           HG1      THR  29  -6.175  -5.933   3.302
  219   1HG2  THR  29          1HG2      THR  29  -5.924  -3.528   1.136
  220   2HG2  THR  29          2HG2      THR  29  -4.325  -4.068   0.627
  221   3HG2  THR  29          3HG2      THR  29  -4.484  -2.722   1.753
  222    H    ASP  30           H        ASP  30  -4.289  -7.637   2.031
  223    HA   ASP  30           HA       ASP  30  -2.499  -7.644  -0.282
  224   1HB   ASP  30          1HB       ASP  30  -3.894 -10.114   0.228
  225   2HB   ASP  30          2HB       ASP  30  -2.196  -9.840  -0.042
  226    H    THR  31           H        THR  31  -5.354  -6.570   0.342
  227    HA   THR  31           HA       THR  31  -7.168  -7.862  -1.386
  228    HB   THR  31           HB       THR  31  -7.135  -4.943  -0.621
  229    HG1  THR  31           HG1      THR  31  -7.090  -5.888   1.305
  230   1HG2  THR  31          1HG2      THR  31  -9.373  -4.823  -1.015
  231   2HG2  THR  31          2HG2      THR  31  -9.621  -6.558  -0.815
  232   3HG2  THR  31          3HG2      THR  31  -8.886  -5.934  -2.293
  233    H    GLY  32           H        GLY  32  -7.676  -7.514  -3.524
  234   1HA   GLY  32          1HA       GLY  32  -7.529  -6.521  -5.633
  235   2HA   GLY  32          2HA       GLY  32  -6.281  -5.452  -5.008
  236    H    ARG  33           H        ARG  33  -4.809  -7.687  -3.805
  237    HA   ARG  33           HA       ARG  33  -3.393  -8.580  -6.206
  238   1HB   ARG  33          1HB       ARG  33  -2.628  -8.773  -3.276
  239   2HB   ARG  33          2HB       ARG  33  -1.601  -9.198  -4.634
  240   1HG   ARG  33          1HG       ARG  33  -2.685  -6.427  -4.208
  241   2HG   ARG  33          2HG       ARG  33  -1.158  -6.972  -3.519
  242   1HD   ARG  33          1HD       ARG  33  -1.860  -6.888  -6.448
  243   2HD   ARG  33          2HD       ARG  33  -0.815  -5.748  -5.602
  244    HE   ARG  33           HE       ARG  33   0.093  -8.461  -5.365
  245   1HH1  ARG  33          1HH1      ARG  33   0.152  -5.600  -7.359
  246   2HH1  ARG  33          2HH1      ARG  33   1.505  -6.126  -8.308
  247   1HH2  ARG  33          1HH2      ARG  33   1.924  -9.139  -6.535
  248   2HH2  ARG  33          2HH2      ARG  33   2.595  -8.107  -7.757
  249    H    SER  34           H        SER  34  -3.337 -10.708  -6.799
  250    HA   SER  34           HA       SER  34  -5.088 -12.516  -5.326
  251   1HB   SER  34          1HB       SER  34  -3.615 -13.100  -7.901
  252   2HB   SER  34          2HB       SER  34  -5.063 -13.894  -7.275
  253    HG   SER  34           HG       SER  34  -4.814 -11.240  -8.286
  254    H    ASP  35           H        ASP  35  -1.795 -11.805  -5.586
  255    HA   ASP  35           HA       ASP  35  -0.813 -14.424  -5.018
  256   1HB   ASP  35          1HB       ASP  35   0.993 -12.215  -4.578
  257   2HB   ASP  35          2HB       ASP  35   1.189 -13.607  -5.610
  258    H    GLY  36           H        GLY  36  -2.360 -12.333  -3.145
  259   1HA   GLY  36          1HA       GLY  36  -2.590 -12.136  -0.860
  260   2HA   GLY  36          2HA       GLY  36  -1.520 -13.522  -0.712
  261    H    PHE  37           H        PHE  37  -0.390 -10.805  -2.509
  262    HA   PHE  37           HA       PHE  37   1.699 -10.380  -0.559
  263   1HB   PHE  37          1HB       PHE  37   1.190  -9.317  -3.330
  264   2HB   PHE  37          2HB       PHE  37   2.435  -8.616  -2.307
  265    HD1  PHE  37           HD1      PHE  37   3.590  -9.405  -4.585
  266    HD2  PHE  37           HD2      PHE  37   2.281 -11.970  -1.456
  267    HE1  PHE  37           HE1      PHE  37   5.174 -11.131  -5.341
  268    HE2  PHE  37           HE2      PHE  37   3.858 -13.698  -2.197
  269    HZ   PHE  37           HZ       PHE  37   5.314 -13.276  -4.150
  270    H    LEU  38           H        LEU  38   1.700  -8.868   0.949
  271    HA   LEU  38           HA       LEU  38  -0.515  -7.062   1.171
  272   1HB   LEU  38          1HB       LEU  38   1.126  -6.286   3.140
  273   2HB   LEU  38          2HB       LEU  38   0.020  -7.630   3.287
  274    HG   LEU  38           HG       LEU  38   2.846  -8.095   2.373
  275   1HD1  LEU  38          1HD1      LEU  38   2.411  -6.789   4.703
  276   2HD1  LEU  38          2HD1      LEU  38   3.748  -7.904   4.421
  277   3HD1  LEU  38          3HD1      LEU  38   2.286  -8.464   5.232
  278   1HD2  LEU  38          1HD2      LEU  38   1.695 -10.014   4.177
  279   2HD2  LEU  38          2HD2      LEU  38   2.271 -10.238   2.527
  280   3HD2  LEU  38          3HD2      LEU  38   0.610  -9.721   2.813
  281    H    TRP  39           H        TRP  39  -0.585  -4.981   0.668
  282    HA   TRP  39           HA       TRP  39   1.918  -3.582   0.042
  283   1HB   TRP  39          1HB       TRP  39   0.880  -2.531  -1.919
  284   2HB   TRP  39          2HB       TRP  39   0.933  -4.277  -2.093
  285    HD1  TRP  39           HD1      TRP  39  -1.441  -5.597  -1.915
  286    HE1  TRP  39           HE1      TRP  39  -3.832  -4.799  -2.383
  287    HE3  TRP  39           HE3      TRP  39  -0.674  -0.532  -1.760
  288    HZ2  TRP  39           HZ2      TRP  39  -5.212  -2.345  -2.651
  289    HZ3  TRP  39           HZ3      TRP  39  -2.592   0.967  -2.142
  290    HH2  TRP  39           HH2      TRP  39  -4.808   0.061  -2.575
  291    H    CYS  40           H        CYS  40   1.408  -1.138  -0.240
  292    HA   CYS  40           HA       CYS  40  -0.799  -0.244   1.442
  293   1HB   CYS  40          1HB       CYS  40   0.629   0.993   2.957
  294   2HB   CYS  40          2HB       CYS  40   1.117  -0.699   2.969
  295    H    SER  41           H        SER  41  -1.398   1.891   0.979
  296    HA   SER  41           HA       SER  41  -0.336   2.912  -1.502
  297   1HB   SER  41          1HB       SER  41  -2.507   4.048   0.284
  298   2HB   SER  41          2HB       SER  41  -2.155   4.545  -1.374
  299    HG   SER  41           HG       SER  41  -3.475   2.294  -0.424
  300    H    THR  42           H        THR  42   0.626   5.007  -1.751
  301    HA   THR  42           HA       THR  42   2.066   5.853   0.652
  302    HB   THR  42           HB       THR  42   2.423   6.898  -2.158
  303    HG1  THR  42           HG1      THR  42   2.888   4.398  -1.242
  304   1HG2  THR  42          1HG2      THR  42   4.812   7.046  -1.405
  305   2HG2  THR  42          2HG2      THR  42   4.234   6.728   0.232
  306   3HG2  THR  42          3HG2      THR  42   3.696   8.167  -0.632
  307    H    THR  43           H        THR  43  -0.530   6.779  -1.362
  308    HA   THR  43           HA       THR  43  -0.566   9.469  -0.185
  309    HB   THR  43           HB       THR  43  -2.161   9.968  -2.088
  310    HG1  THR  43           HG1      THR  43  -2.726   8.407  -3.356
  311   1HG2  THR  43          1HG2      THR  43  -0.419   9.903  -3.890
  312   2HG2  THR  43          2HG2      THR  43   0.638   9.089  -2.735
  313   3HG2  THR  43          3HG2      THR  43   0.062  10.724  -2.404
  314    H    TYR  44           H        TYR  44  -3.218  10.095  -0.589
  315    HA   TYR  44           HA       TYR  44  -4.446   8.506   1.498
  316   1HB   TYR  44          1HB       TYR  44  -5.554  10.932   0.110
  317   2HB   TYR  44          2HB       TYR  44  -6.139  10.227   1.608
  318    HD1  TYR  44           HD1      TYR  44  -3.277  12.031   0.060
  319    HD2  TYR  44           HD2      TYR  44  -5.134  10.815   3.697
  320    HE1  TYR  44           HE1      TYR  44  -1.736  13.464   1.324
  321    HE2  TYR  44           HE2      TYR  44  -3.598  12.253   4.966
  322    HH   TYR  44           HH       TYR  44  -2.073  14.637   3.984
  323    H    ASN  45           H        ASN  45  -5.317   9.617  -1.768
  324    HA   ASN  45           HA       ASN  45  -7.217   7.393  -1.921
  325   1HB   ASN  45          1HB       ASN  45  -7.964   9.764  -2.484
  326   2HB   ASN  45          2HB       ASN  45  -6.922   9.677  -3.884
  327   1HD2  ASN  45          1HD2      ASN  45  -7.812   6.697  -4.038
  328   2HD2  ASN  45          2HD2      ASN  45  -9.311   6.896  -4.810
  329    H    PHE  46           H        PHE  46  -6.291   5.586  -2.695
  330    HA   PHE  46           HA       PHE  46  -3.889   5.517  -4.168
  331   1HB   PHE  46          1HB       PHE  46  -4.708   3.674  -2.743
  332   2HB   PHE  46          2HB       PHE  46  -6.021   3.377  -3.899
  333    HD1  PHE  46           HD1      PHE  46  -5.516   1.209  -4.665
  334    HD2  PHE  46           HD2      PHE  46  -2.424   4.139  -4.612
  335    HE1  PHE  46           HE1      PHE  46  -4.055  -0.315  -5.918
  336    HE2  PHE  46           HE2      PHE  46  -0.965   2.621  -5.868
  337    HZ   PHE  46           HZ       PHE  46  -1.777   0.388  -6.526
  338    H    GLU  47           H        GLU  47  -7.262   5.421  -5.218
  339    HA   GLU  47           HA       GLU  47  -6.876   4.524  -7.825
  340   1HB   GLU  47          1HB       GLU  47  -9.056   4.944  -6.477
  341   2HB   GLU  47          2HB       GLU  47  -8.983   6.552  -7.182
  342   1HG   GLU  47          1HG       GLU  47  -8.946   5.547  -9.422
  343   2HG   GLU  47          2HG       GLU  47  -9.092   3.951  -8.688
  344    H    LYS  48           H        LYS  48  -6.990   7.916  -6.689
  345    HA   LYS  48           HA       LYS  48  -6.578   8.929  -9.317
  346   1HB   LYS  48          1HB       LYS  48  -6.380  11.134  -8.254
  347   2HB   LYS  48          2HB       LYS  48  -7.822  10.264  -7.756
  348   1HG   LYS  48          1HG       LYS  48  -6.969   9.844  -5.610
  349   2HG   LYS  48          2HG       LYS  48  -5.319  10.249  -6.096
  350   1HD   LYS  48          1HD       LYS  48  -7.619  12.209  -6.013
  351   2HD   LYS  48          2HD       LYS  48  -6.416  12.011  -4.729
  352   1HE   LYS  48          1HE       LYS  48  -4.646  12.675  -6.215
  353   2HE   LYS  48          2HE       LYS  48  -5.742  12.711  -7.593
  354   1HZ   LYS  48          1HZ       LYS  48  -5.653  14.571  -5.284
  355   2HZ   LYS  48          2HZ       LYS  48  -6.994  14.487  -6.326
  356   3HZ   LYS  48          3HZ       LYS  48  -5.467  14.924  -6.936
  357    H    ASP  49           H        ASP  49  -4.383   8.280  -6.628
  358    HA   ASP  49           HA       ASP  49  -2.238   9.618  -8.063
  359   1HB   ASP  49          1HB       ASP  49  -2.452   8.409  -5.325
  360   2HB   ASP  49          2HB       ASP  49  -0.887   8.851  -6.008
  361    H    GLY  50           H        GLY  50  -2.563   6.389  -6.578
  362   1HA   GLY  50          1HA       GLY  50  -2.129   4.365  -7.705
  363   2HA   GLY  50          2HA       GLY  50  -1.285   5.276  -8.938
  364    H    LYS  51           H        LYS  51  -0.177   6.439  -6.050
  365    HA   LYS  51           HA       LYS  51   2.288   4.980  -6.340
  366   1HB   LYS  51          1HB       LYS  51   1.419   7.238  -4.566
  367   2HB   LYS  51          2HB       LYS  51   2.911   6.373  -4.245
  368   1HG   LYS  51          1HG       LYS  51   3.635   8.145  -5.497
  369   2HG   LYS  51          2HG       LYS  51   3.456   6.880  -6.711
  370   1HD   LYS  51          1HD       LYS  51   2.501   8.760  -7.712
  371   2HD   LYS  51          2HD       LYS  51   1.110   7.868  -7.086
  372   1HE   LYS  51          1HE       LYS  51   1.027  10.325  -6.655
  373   2HE   LYS  51          2HE       LYS  51   0.922   9.331  -5.207
  374   1HZ   LYS  51          1HZ       LYS  51   2.936  10.020  -4.467
  375   2HZ   LYS  51          2HZ       LYS  51   2.531  11.403  -5.374
  376   3HZ   LYS  51          3HZ       LYS  51   3.586  10.247  -6.022
  377    H    TYR  52           H        TYR  52   2.645   3.085  -5.463
  378    HA   TYR  52           HA       TYR  52   1.637   2.507  -2.786
  379   1HB   TYR  52          1HB       TYR  52   0.703   0.381  -3.449
  380   2HB   TYR  52          2HB       TYR  52  -0.003   1.622  -4.481
  381    HD1  TYR  52           HD1      TYR  52   2.358  -1.206  -4.357
  382    HD2  TYR  52           HD2      TYR  52   0.461   1.671  -6.857
  383    HE1  TYR  52           HE1      TYR  52   3.130  -2.431  -6.343
  384    HE2  TYR  52           HE2      TYR  52   1.219   0.447  -8.843
  385    HH   TYR  52           HH       TYR  52   3.176  -1.150  -9.388
  386    H    GLY  53           H        GLY  53   2.502   0.221  -2.175
  387   1HA   GLY  53          1HA       GLY  53   4.977  -0.569  -3.385
  388   2HA   GLY  53          2HA       GLY  53   5.188   0.238  -1.845
  389    H    PHE  54           H        PHE  54   5.987  -2.390  -2.147
  390    HA   PHE  54           HA       PHE  54   3.818  -3.931  -0.925
  391   1HB   PHE  54          1HB       PHE  54   6.426  -4.871  -2.088
  392   2HB   PHE  54          2HB       PHE  54   5.173  -5.914  -1.423
  393    HD1  PHE  54           HD1      PHE  54   2.715  -5.097  -2.429
  394    HD2  PHE  54           HD2      PHE  54   6.496  -4.928  -4.371
  395    HE1  PHE  54           HE1      PHE  54   1.593  -5.119  -4.615
  396    HE2  PHE  54           HE2      PHE  54   5.385  -4.950  -6.559
  397    HZ   PHE  54           HZ       PHE  54   2.922  -5.048  -6.685
  398    H    CYS  55           H        CYS  55   3.951  -4.911   0.994
  399    HA   CYS  55           HA       CYS  55   6.074  -3.972   2.776
  400   1HB   CYS  55          1HB       CYS  55   3.514  -5.419   3.509
  401   2HB   CYS  55          2HB       CYS  55   4.582  -4.522   4.585
  402    HA   PRO  56           HA       PRO  56   7.789  -8.060   2.105
  403   1HB   PRO  56          1HB       PRO  56  10.054  -7.688   3.517
  404   2HB   PRO  56          2HB       PRO  56   9.817  -7.020   1.900
  405   1HG   PRO  56          1HG       PRO  56   9.515  -5.677   4.566
  406   2HG   PRO  56          2HG       PRO  56  10.312  -5.076   3.099
  407   1HD   PRO  56          1HD       PRO  56   7.803  -4.322   3.787
  408   2HD   PRO  56          2HD       PRO  56   8.309  -4.498   2.094
  409    H    HIS  57           H        HIS  57   9.078  -9.575   3.691
  410    HA   HIS  57           HA       HIS  57   7.240 -10.437   5.681
  411   1HB   HIS  57          1HB       HIS  57   8.846 -11.890   4.343
  412   2HB   HIS  57          2HB       HIS  57  10.136 -11.274   5.370
  413    HD1  HIS  57           HD1      HIS  57  10.324 -13.962   5.791
  414    HD2  HIS  57           HD2      HIS  57   7.104 -11.977   7.538
  415    HE1  HIS  57           HE1      HIS  57   9.473 -15.496   7.600
  416    H    GLU  58           H        GLU  58  10.330  -8.765   5.708
  417    HA   GLU  58           HA       GLU  58  10.361  -8.537   8.597
  418   1HB   GLU  58          1HB       GLU  58  12.481  -7.333   8.255
  419   2HB   GLU  58          2HB       GLU  58  12.471  -8.888   7.442
  420   1HG   GLU  58          1HG       GLU  58  12.035  -7.771   5.306
  421   2HG   GLU  58          2HG       GLU  58  12.028  -6.210   6.129
  422    H    ALA  59           H        ALA  59   8.086  -7.354   7.475
  423    HA   ALA  59           HA       ALA  59   8.595  -4.479   7.506
  424   1HB   ALA  59          1HB       ALA  59   6.642  -4.179   6.358
  425   2HB   ALA  59          2HB       ALA  59   5.859  -5.569   7.107
  426   3HB   ALA  59          3HB       ALA  59   7.049  -5.814   5.828
  Start of MODEL    3
    1   1H    ARG   1          1H        ARG   1  12.886   7.837   3.359
    2   2H    ARG   1          2H        ARG   1  11.610   7.496   2.262
    3   3H    ARG   1          3H        ARG   1  12.995   6.478   2.313
    4    HA   ARG   1           HA       ARG   1  12.067   6.535   4.858
    5   1HB   ARG   1          1HB       ARG   1  10.031   7.500   3.437
    6   2HB   ARG   1          2HB       ARG   1   9.757   5.798   3.108
    7   1HG   ARG   1          1HG       ARG   1   8.410   6.645   4.985
    8   2HG   ARG   1          2HG       ARG   1   9.497   5.343   5.473
    9   1HD   ARG   1          1HD       ARG   1  11.100   7.119   6.265
   10   2HD   ARG   1          2HD       ARG   1   9.826   8.304   5.957
   11    HE   ARG   1           HE       ARG   1   8.768   6.289   7.621
   12   1HH1  ARG   1          1HH1      ARG   1  11.065   8.937   7.680
   13   2HH1  ARG   1          2HH1      ARG   1  10.991   9.141   9.407
   14   1HH2  ARG   1          1HH2      ARG   1   8.665   6.547   9.891
   15   2HH2  ARG   1          2HH2      ARG   1   9.651   7.748  10.667
   16    H    ILE   2           H        ILE   2  10.858   4.120   5.073
   17    HA   ILE   2           HA       ILE   2  12.220   2.355   3.207
   18    HB   ILE   2           HB       ILE   2  13.680   2.741   5.216
   19   1HG1  ILE   2          1HG1      ILE   2  14.245   0.313   5.450
   20   2HG1  ILE   2          2HG1      ILE   2  12.777  -0.059   4.550
   21   1HG2  ILE   2          1HG2      ILE   2  11.414   1.306   6.558
   22   2HG2  ILE   2          2HG2      ILE   2  12.274   2.760   7.069
   23   3HG2  ILE   2          3HG2      ILE   2  13.063   1.186   7.171
   24   1HD1  ILE   2          1HD1      ILE   2  14.640   1.849   3.296
   25   2HD1  ILE   2          2HD1      ILE   2  13.677   0.556   2.580
   26   3HD1  ILE   2          3HD1      ILE   2  15.182   0.176   3.422
   27    HA   PRO   3           HA       PRO   3   8.567  -0.057   5.646
   28   1HB   PRO   3          1HB       PRO   3   6.616   2.141   5.189
   29   2HB   PRO   3          2HB       PRO   3   6.701   0.968   6.506
   30   1HG   PRO   3          1HG       PRO   3   7.469   3.466   6.915
   31   2HG   PRO   3          2HG       PRO   3   8.401   2.120   7.600
   32   1HD   PRO   3          1HD       PRO   3   9.000   3.816   5.194
   33   2HD   PRO   3          2HD       PRO   3  10.111   3.193   6.433
   34    H    VAL   4           H        VAL   4   8.560   2.040   2.866
   35    HA   VAL   4           HA       VAL   4   6.853   0.090   1.440
   36    HB   VAL   4           HB       VAL   4   7.522   2.963   0.643
   37   1HG1  VAL   4          1HG1      VAL   4   6.163   2.638  -1.269
   38   2HG1  VAL   4          2HG1      VAL   4   5.632   1.054  -0.705
   39   3HG1  VAL   4          3HG1      VAL   4   7.302   1.294  -1.224
   40   1HG2  VAL   4          1HG2      VAL   4   4.780   1.881   1.230
   41   2HG2  VAL   4          2HG2      VAL   4   5.321   3.557   1.167
   42   3HG2  VAL   4          3HG2      VAL   4   5.796   2.527   2.517
   43    H    LYS   5           H        LYS   5   7.851  -1.275   0.203
   44    HA   LYS   5           HA       LYS   5  10.650  -0.876  -0.376
   45   1HB   LYS   5          1HB       LYS   5   8.759  -3.175  -0.440
   46   2HB   LYS   5          2HB       LYS   5  10.210  -3.270  -1.425
   47   1HG   LYS   5          1HG       LYS   5  10.096  -2.904   1.563
   48   2HG   LYS   5          2HG       LYS   5  10.533  -4.371   0.688
   49   1HD   LYS   5          1HD       LYS   5  12.543  -3.428  -0.121
   50   2HD   LYS   5          2HD       LYS   5  12.063  -1.798   0.359
   51   1HE   LYS   5          1HE       LYS   5  12.670  -4.098   2.214
   52   2HE   LYS   5          2HE       LYS   5  13.727  -2.723   1.882
   53   1HZ   LYS   5          1HZ       LYS   5  11.849  -1.294   2.750
   54   2HZ   LYS   5          2HZ       LYS   5  12.636  -2.255   3.902
   55   3HZ   LYS   5          3HZ       LYS   5  11.115  -2.720   3.310
   56    H    TYR   6           H        TYR   6   8.980  -2.841  -2.557
   57    HA   TYR   6           HA       TYR   6   9.933  -1.275  -4.778
   58   1HB   TYR   6          1HB       TYR   6   8.397  -3.878  -4.872
   59   2HB   TYR   6          2HB       TYR   6   9.480  -3.216  -6.095
   60    HD1  TYR   6           HD1      TYR   6   9.734  -6.003  -4.943
   61    HD2  TYR   6           HD2      TYR   6  11.508  -2.318  -3.752
   62    HE1  TYR   6           HE1      TYR   6  11.607  -7.224  -3.936
   63    HE2  TYR   6           HE2      TYR   6  13.380  -3.536  -2.741
   64    HH   TYR   6           HH       TYR   6  14.495  -5.731  -2.982
   65    H    GLY   7           H        GLY   7   8.386  -1.429  -6.798
   66   1HA   GLY   7          1HA       GLY   7   6.072  -1.199  -7.539
   67   2HA   GLY   7          2HA       GLY   7   5.730  -0.374  -6.025
   68    H    ASN   8           H        ASN   8   4.957   1.480  -7.192
   69    HA   ASN   8           HA       ASN   8   7.009   2.858  -8.759
   70   1HB   ASN   8          1HB       ASN   8   5.311   4.267  -9.676
   71   2HB   ASN   8          2HB       ASN   8   4.752   2.604  -9.758
   72   1HD2  ASN   8          1HD2      ASN   8   3.277   5.108  -9.840
   73   2HD2  ASN   8          2HD2      ASN   8   2.110   4.996  -8.573
   74    H    ALA   9           H        ALA   9   6.281   2.712  -5.659
   75    HA   ALA   9           HA       ALA   9   6.431   5.516  -4.951
   76   1HB   ALA   9          1HB       ALA   9   6.821   3.499  -2.856
   77   2HB   ALA   9          2HB       ALA   9   5.287   3.382  -3.720
   78   3HB   ALA   9          3HB       ALA   9   5.726   4.889  -2.910
   79    H    ASP  10           H        ASP  10   8.236   2.601  -4.102
   80    HA   ASP  10           HA       ASP  10  10.382   2.220  -3.445
   81   1HB   ASP  10          1HB       ASP  10  10.455   2.408  -5.971
   82   2HB   ASP  10          2HB       ASP  10  11.088   4.035  -5.744
   83    H    GLY  11           H        GLY  11  10.252   3.357  -1.451
   84   1HA   GLY  11          1HA       GLY  11  11.915   4.629  -0.186
   85   2HA   GLY  11          2HA       GLY  11  11.879   5.819  -1.479
   86    H    GLU  12           H        GLU  12   8.743   4.914  -1.086
   87    HA   GLU  12           HA       GLU  12   8.190   7.304   0.467
   88   1HB   GLU  12          1HB       GLU  12   6.590   5.512  -1.299
   89   2HB   GLU  12          2HB       GLU  12   5.733   6.417  -0.062
   90   1HG   GLU  12          1HG       GLU  12   6.438   8.489  -0.953
   91   2HG   GLU  12          2HG       GLU  12   7.595   7.716  -2.016
   92    H    TYR  13           H        TYR  13   6.044   6.935   1.886
   93    HA   TYR  13           HA       TYR  13   6.654   4.768   3.743
   94   1HB   TYR  13          1HB       TYR  13   6.660   6.242   5.483
   95   2HB   TYR  13          2HB       TYR  13   7.240   7.273   4.189
   96    HD1  TYR  13           HD1      TYR  13   4.354   6.507   6.323
   97    HD2  TYR  13           HD2      TYR  13   6.011   9.050   3.355
   98    HE1  TYR  13           HE1      TYR  13   2.577   8.153   6.754
   99    HE2  TYR  13           HE2      TYR  13   4.248  10.705   3.764
  100    HH   TYR  13           HH       TYR  13   1.818  10.222   6.315
  101    H    CYS  14           H        CYS  14   4.858   3.825   4.841
  102    HA   CYS  14           HA       CYS  14   2.460   3.803   3.286
  103   1HB   CYS  14          1HB       CYS  14   3.207   2.469   5.888
  104   2HB   CYS  14          2HB       CYS  14   1.658   2.236   5.091
  105    H    LYS  15           H        LYS  15   0.854   5.235   3.477
  106    HA   LYS  15           HA       LYS  15   0.666   6.809   5.923
  107   1HB   LYS  15          1HB       LYS  15   0.490   7.965   3.726
  108   2HB   LYS  15          2HB       LYS  15  -0.981   7.056   3.396
  109   1HG   LYS  15          1HG       LYS  15  -2.119   8.100   5.227
  110   2HG   LYS  15          2HG       LYS  15  -0.637   8.886   5.766
  111   1HD   LYS  15          1HD       LYS  15  -0.588  10.193   3.681
  112   2HD   LYS  15          2HD       LYS  15  -2.089   9.414   3.170
  113   1HE   LYS  15          1HE       LYS  15  -3.241  10.339   5.120
  114   2HE   LYS  15          2HE       LYS  15  -1.740  11.097   5.656
  115   1HZ   LYS  15          1HZ       LYS  15  -2.136  12.825   4.347
  116   2HZ   LYS  15          2HZ       LYS  15  -3.667  12.176   3.990
  117   3HZ   LYS  15          3HZ       LYS  15  -2.346  11.839   2.974
  118    H    PHE  16           H        PHE  16  -0.523   6.118   7.524
  119    HA   PHE  16           HA       PHE  16  -2.822   4.369   6.957
  120   1HB   PHE  16          1HB       PHE  16  -1.036   4.531   9.392
  121   2HB   PHE  16          2HB       PHE  16  -2.476   3.521   9.282
  122    HD1  PHE  16           HD1      PHE  16   0.360   2.592   9.835
  123    HD2  PHE  16           HD2      PHE  16  -1.880   2.916   6.235
  124    HE1  PHE  16           HE1      PHE  16   1.717   0.813   8.839
  125    HE2  PHE  16           HE2      PHE  16  -0.536   1.134   5.226
  126    HZ   PHE  16           HZ       PHE  16   1.283   0.058   6.520
  127    HA   PRO  17           HA       PRO  17  -4.510   3.972   7.078
  128   1HB   PRO  17          1HB       PRO  17  -7.145   4.683   6.703
  129   2HB   PRO  17          2HB       PRO  17  -6.540   3.755   8.077
  130   1HG   PRO  17          1HG       PRO  17  -7.612   6.432   8.072
  131   2HG   PRO  17          2HG       PRO  17  -7.059   5.476   9.455
  132   1HD   PRO  17          1HD       PRO  17  -5.674   7.611   7.979
  133   2HD   PRO  17          2HD       PRO  17  -5.353   6.975   9.606
  134    H    PHE  18           H        PHE  18  -5.209   3.602   4.889
  135    HA   PHE  18           HA       PHE  18  -5.233   6.050   3.249
  136   1HB   PHE  18          1HB       PHE  18  -4.060   4.929   1.466
  137   2HB   PHE  18          2HB       PHE  18  -3.115   4.783   2.942
  138    HD1  PHE  18           HD1      PHE  18  -3.081   2.586   4.147
  139    HD2  PHE  18           HD2      PHE  18  -4.795   3.060   0.284
  140    HE1  PHE  18           HE1      PHE  18  -2.934   0.157   3.782
  141    HE2  PHE  18           HE2      PHE  18  -4.652   0.644  -0.099
  142    HZ   PHE  18           HZ       PHE  18  -3.708  -0.834   1.657
  143    H    LEU  19           H        LEU  19  -6.482   5.892   1.257
  144    HA   LEU  19           HA       LEU  19  -8.874   4.291   1.707
  145   1HB   LEU  19          1HB       LEU  19  -8.983   6.758   1.364
  146   2HB   LEU  19          2HB       LEU  19  -8.425   6.503  -0.279
  147    HG   LEU  19           HG       LEU  19 -10.445   5.090  -0.674
  148   1HD1  LEU  19          1HD1      LEU  19 -10.892   5.802   2.156
  149   2HD1  LEU  19          2HD1      LEU  19 -11.327   4.342   1.269
  150   3HD1  LEU  19          3HD1      LEU  19 -12.301   5.803   1.095
  151   1HD2  LEU  19          1HD2      LEU  19 -12.022   7.044  -0.724
  152   2HD2  LEU  19          2HD2      LEU  19 -10.461   7.315  -1.501
  153   3HD2  LEU  19          3HD2      LEU  19 -10.772   7.976   0.105
  154    H    PHE  20           H        PHE  20  -9.351   2.558   0.597
  155    HA   PHE  20           HA       PHE  20  -8.290   2.199  -2.132
  156   1HB   PHE  20          1HB       PHE  20  -7.074   0.761  -0.359
  157   2HB   PHE  20          2HB       PHE  20  -8.633  -0.020  -0.151
  158    HD1  PHE  20           HD1      PHE  20  -6.977   1.042  -3.314
  159    HD2  PHE  20           HD2      PHE  20  -8.430  -2.123  -0.875
  160    HE1  PHE  20           HE1      PHE  20  -6.523  -0.578  -5.119
  161    HE2  PHE  20           HE2      PHE  20  -7.979  -3.743  -2.665
  162    HZ   PHE  20           HZ       PHE  20  -7.027  -2.962  -4.805
  163    H    ASN  21           H        ASN  21 -10.160   2.446  -3.273
  164    HA   ASN  21           HA       ASN  21 -12.293   2.169  -4.006
  165   1HB   ASN  21          1HB       ASN  21 -11.787  -0.560  -2.832
  166   2HB   ASN  21          2HB       ASN  21 -13.214  -0.167  -3.784
  167   1HD2  ASN  21          1HD2      ASN  21 -13.094  -0.509  -5.868
  168   2HD2  ASN  21          2HD2      ASN  21 -11.641  -0.662  -6.794
  169    H    GLY  22           H        GLY  22 -12.180   3.506  -1.549
  170   1HA   GLY  22          1HA       GLY  22 -13.875   4.366  -0.197
  171   2HA   GLY  22          2HA       GLY  22 -14.880   2.994  -0.615
  172    H    LYS  23           H        LYS  23 -11.990   1.727   0.345
  173    HA   LYS  23           HA       LYS  23 -12.945   1.505   3.121
  174   1HB   LYS  23          1HB       LYS  23 -12.865  -0.565   1.484
  175   2HB   LYS  23          2HB       LYS  23 -11.153  -0.555   1.885
  176   1HG   LYS  23          1HG       LYS  23 -13.305  -0.642   3.986
  177   2HG   LYS  23          2HG       LYS  23 -12.642  -2.087   3.237
  178   1HD   LYS  23          1HD       LYS  23 -10.417  -1.510   4.018
  179   2HD   LYS  23          2HD       LYS  23 -11.049  -0.017   4.724
  180   1HE   LYS  23          1HE       LYS  23 -12.519  -1.378   6.180
  181   2HE   LYS  23          2HE       LYS  23 -11.773  -2.836   5.526
  182   1HZ   LYS  23          1HZ       LYS  23  -9.975  -0.809   6.600
  183   2HZ   LYS  23          2HZ       LYS  23  -9.873  -2.501   6.683
  184   3HZ   LYS  23          3HZ       LYS  23 -10.912  -1.662   7.727
  185    H    GLU  24           H        GLU  24 -11.503   1.811   4.769
  186    HA   GLU  24           HA       GLU  24  -8.878   2.861   3.949
  187   1HB   GLU  24          1HB       GLU  24 -10.541   3.402   6.410
  188   2HB   GLU  24          2HB       GLU  24  -8.888   3.966   6.211
  189   1HG   GLU  24          1HG       GLU  24  -9.510   5.313   4.347
  190   2HG   GLU  24          2HG       GLU  24 -11.131   4.620   4.329
  191    H    TYR  25           H        TYR  25  -7.063   1.918   4.570
  192    HA   TYR  25           HA       TYR  25  -7.262  -0.358   6.424
  193   1HB   TYR  25          1HB       TYR  25  -5.293   0.167   4.216
  194   2HB   TYR  25          2HB       TYR  25  -5.235  -1.222   5.290
  195    HD1  TYR  25           HD1      TYR  25  -7.354  -2.732   5.319
  196    HD2  TYR  25           HD2      TYR  25  -6.468   0.059   2.230
  197    HE1  TYR  25           HE1      TYR  25  -8.888  -3.934   3.797
  198    HE2  TYR  25           HE2      TYR  25  -7.994  -1.134   0.706
  199    HH   TYR  25           HH       TYR  25  -9.105  -4.202   1.241
  200    H    ASN  26           H        ASN  26  -6.107  -0.372   8.245
  201    HA   ASN  26           HA       ASN  26  -4.416   1.956   8.800
  202   1HB   ASN  26          1HB       ASN  26  -5.463  -0.217  10.637
  203   2HB   ASN  26          2HB       ASN  26  -4.460   1.132  11.152
  204   1HD2  ASN  26          1HD2      ASN  26  -6.489   2.182   8.734
  205   2HD2  ASN  26          2HD2      ASN  26  -7.750   2.844   9.714
  206    H    SER  27           H        SER  27  -3.920  -0.766   7.297
  207    HA   SER  27           HA       SER  27  -1.131  -0.912   7.963
  208   1HB   SER  27          1HB       SER  27  -1.344  -3.465   8.342
  209   2HB   SER  27          2HB       SER  27  -1.790  -2.399   9.678
  210    HG   SER  27           HG       SER  27  -3.329  -4.164   8.280
  211    H    CYS  28           H        CYS  28  -0.253  -3.007   6.659
  212    HA   CYS  28           HA       CYS  28  -0.949  -2.465   3.922
  213   1HB   CYS  28          1HB       CYS  28   0.918  -4.522   5.115
  214   2HB   CYS  28          2HB       CYS  28   0.755  -4.182   3.394
  215    H    THR  29           H        THR  29  -2.340  -3.528   2.675
  216    HA   THR  29           HA       THR  29  -3.478  -6.033   3.683
  217    HB   THR  29           HB       THR  29  -5.111  -4.211   3.617
  218    HG1  THR  29           HG1      THR  29  -6.023  -6.159   3.122
  219   1HG2  THR  29          1HG2      THR  29  -5.139  -4.028   0.675
  220   2HG2  THR  29          2HG2      THR  29  -3.843  -3.171   1.504
  221   3HG2  THR  29          3HG2      THR  29  -5.526  -2.819   1.897
  222    H    ASP  30           H        ASP  30  -4.311  -7.501   1.934
  223    HA   ASP  30           HA       ASP  30  -2.419  -7.491  -0.289
  224   1HB   ASP  30          1HB       ASP  30  -3.769  -9.987   0.070
  225   2HB   ASP  30          2HB       ASP  30  -2.066  -9.678  -0.058
  226    H    THR  31           H        THR  31  -5.303  -6.455   0.284
  227    HA   THR  31           HA       THR  31  -7.051  -7.739  -1.504
  228    HB   THR  31           HB       THR  31  -7.069  -4.841  -0.671
  229    HG1  THR  31           HG1      THR  31  -7.042  -6.001   1.201
  230   1HG2  THR  31          1HG2      THR  31  -9.470  -6.539  -1.187
  231   2HG2  THR  31          2HG2      THR  31  -8.698  -5.601  -2.464
  232   3HG2  THR  31          3HG2      THR  31  -9.364  -4.784  -1.049
  233    H    GLY  32           H        GLY  32  -7.458  -7.419  -3.671
  234   1HA   GLY  32          1HA       GLY  32  -7.280  -6.412  -5.767
  235   2HA   GLY  32          2HA       GLY  32  -6.155  -5.251  -5.081
  236    H    ARG  33           H        ARG  33  -4.539  -7.355  -3.848
  237    HA   ARG  33           HA       ARG  33  -2.874  -7.965  -6.137
  238   1HB   ARG  33          1HB       ARG  33  -2.517  -8.505  -3.177
  239   2HB   ARG  33          2HB       ARG  33  -1.313  -8.846  -4.403
  240   1HG   ARG  33          1HG       ARG  33  -2.384  -6.134  -3.684
  241   2HG   ARG  33          2HG       ARG  33  -0.818  -6.788  -3.213
  242   1HD   ARG  33          1HD       ARG  33  -1.763  -6.142  -6.005
  243   2HD   ARG  33          2HD       ARG  33  -0.539  -5.277  -5.078
  244    HE   ARG  33           HE       ARG  33   0.193  -8.007  -5.416
  245   1HH1  ARG  33          1HH1      ARG  33   0.037  -4.944  -7.071
  246   2HH1  ARG  33          2HH1      ARG  33   1.251  -5.374  -8.242
  247   1HH2  ARG  33          1HH2      ARG  33   1.745  -8.601  -6.975
  248   2HH2  ARG  33          2HH2      ARG  33   2.200  -7.451  -8.199
  249    H    SER  34           H        SER  34  -2.925  -9.859  -7.176
  250    HA   SER  34           HA       SER  34  -4.665 -11.955  -6.257
  251   1HB   SER  34          1HB       SER  34  -2.778 -11.983  -8.625
  252   2HB   SER  34          2HB       SER  34  -4.181 -13.022  -8.366
  253    HG   SER  34           HG       SER  34  -4.349 -11.011  -9.772
  254    H    ASP  35           H        ASP  35  -1.391 -11.177  -5.811
  255    HA   ASP  35           HA       ASP  35  -0.559 -13.898  -5.394
  256   1HB   ASP  35          1HB       ASP  35   1.340 -11.857  -4.677
  257   2HB   ASP  35          2HB       ASP  35   1.522 -13.197  -5.772
  258    H    GLY  36           H        GLY  36  -2.203 -11.867  -3.549
  259   1HA   GLY  36          1HA       GLY  36  -2.554 -11.676  -1.279
  260   2HA   GLY  36          2HA       GLY  36  -1.698 -13.206  -1.135
  261    H    PHE  37           H        PHE  37  -0.470 -10.148  -2.387
  262    HA   PHE  37           HA       PHE  37   1.677 -10.244  -0.390
  263   1HB   PHE  37          1HB       PHE  37   1.830  -9.955  -3.086
  264   2HB   PHE  37          2HB       PHE  37   1.790  -8.265  -2.591
  265    HD1  PHE  37           HD1      PHE  37   3.442 -11.400  -1.420
  266    HD2  PHE  37           HD2      PHE  37   3.850  -7.288  -2.428
  267    HE1  PHE  37           HE1      PHE  37   5.845 -11.525  -0.929
  268    HE2  PHE  37           HE2      PHE  37   6.259  -7.403  -1.931
  269    HZ   PHE  37           HZ       PHE  37   7.259  -9.521  -1.185
  270    H    LEU  38           H        LEU  38   1.995  -8.596   1.048
  271    HA   LEU  38           HA       LEU  38  -0.201  -6.802   1.471
  272   1HB   LEU  38          1HB       LEU  38   2.404  -7.087   2.917
  273   2HB   LEU  38          2HB       LEU  38   1.116  -6.027   3.426
  274    HG   LEU  38           HG       LEU  38  -0.311  -8.225   3.475
  275   1HD1  LEU  38          1HD1      LEU  38   1.598  -9.933   4.417
  276   2HD1  LEU  38          2HD1      LEU  38   2.407  -9.207   3.029
  277   3HD1  LEU  38          3HD1      LEU  38   0.854 -10.017   2.818
  278   1HD2  LEU  38          1HD2      LEU  38   0.945  -6.713   5.374
  279   2HD2  LEU  38          2HD2      LEU  38   1.584  -8.325   5.700
  280   3HD2  LEU  38          3HD2      LEU  38  -0.156  -8.048   5.705
  281    H    TRP  39           H        TRP  39  -0.388  -4.749   0.889
  282    HA   TRP  39           HA       TRP  39   2.020  -3.226   0.197
  283   1HB   TRP  39          1HB       TRP  39   1.001  -2.343  -1.836
  284   2HB   TRP  39          2HB       TRP  39   1.096  -4.095  -1.926
  285    HD1  TRP  39           HD1      TRP  39  -1.267  -5.450  -1.636
  286    HE1  TRP  39           HE1      TRP  39  -3.659  -4.741  -2.208
  287    HE3  TRP  39           HE3      TRP  39  -0.582  -0.393  -1.918
  288    HZ2  TRP  39           HZ2      TRP  39  -5.083  -2.350  -2.702
  289    HZ3  TRP  39           HZ3      TRP  39  -2.521   1.026  -2.454
  290    HH2  TRP  39           HH2      TRP  39  -4.719   0.060  -2.829
  291    H    CYS  40           H        CYS  40   1.389  -0.850  -0.179
  292    HA   CYS  40           HA       CYS  40  -0.943   0.015   1.315
  293   1HB   CYS  40          1HB       CYS  40   0.255   1.284   2.959
  294   2HB   CYS  40          2HB       CYS  40   0.937  -0.341   2.992
  295    H    SER  41           H        SER  41  -1.017   2.509   1.282
  296    HA   SER  41           HA       SER  41   0.170   3.422  -1.250
  297   1HB   SER  41          1HB       SER  41  -2.339   3.234  -1.236
  298   2HB   SER  41          2HB       SER  41  -2.369   4.486   0.000
  299    HG   SER  41           HG       SER  41  -1.101   4.850  -2.517
  300    H    THR  42           H        THR  42   0.619   5.741  -1.342
  301    HA   THR  42           HA       THR  42   1.548   6.754   1.261
  302    HB   THR  42           HB       THR  42   2.660   7.465  -1.460
  303    HG1  THR  42           HG1      THR  42   3.953   5.775  -1.379
  304   1HG2  THR  42          1HG2      THR  42   3.305   8.964   0.372
  305   2HG2  THR  42          2HG2      THR  42   4.669   8.054  -0.277
  306   3HG2  THR  42          3HG2      THR  42   3.946   7.578   1.259
  307    H    THR  43           H        THR  43  -0.265   7.421  -1.607
  308    HA   THR  43           HA       THR  43  -0.562  10.243  -0.951
  309    HB   THR  43           HB       THR  43  -1.947  10.181  -3.104
  310    HG1  THR  43           HG1      THR  43  -2.360   8.186  -3.649
  311   1HG2  THR  43          1HG2      THR  43   0.457  10.921  -2.948
  312   2HG2  THR  43          2HG2      THR  43  -0.081  10.338  -4.523
  313   3HG2  THR  43          3HG2      THR  43   0.898   9.299  -3.488
  314    H    TYR  44           H        TYR  44  -1.920   7.639   0.293
  315    HA   TYR  44           HA       TYR  44  -3.824   7.264   1.479
  316   1HB   TYR  44          1HB       TYR  44  -3.704   9.698   2.016
  317   2HB   TYR  44          2HB       TYR  44  -4.695  10.029   0.602
  318    HD1  TYR  44           HD1      TYR  44  -7.072   8.914   0.584
  319    HD2  TYR  44           HD2      TYR  44  -4.696   9.347   4.091
  320    HE1  TYR  44           HE1      TYR  44  -9.090   8.719   1.974
  321    HE2  TYR  44           HE2      TYR  44  -6.711   9.143   5.484
  322    HH   TYR  44           HH       TYR  44  -9.467   7.911   4.596
  323    H    ASN  45           H        ASN  45  -4.980   9.211  -1.300
  324    HA   ASN  45           HA       ASN  45  -6.984   7.200  -1.853
  325   1HB   ASN  45          1HB       ASN  45  -7.316   9.725  -2.099
  326   2HB   ASN  45          2HB       ASN  45  -6.314   9.635  -3.529
  327   1HD2  ASN  45          1HD2      ASN  45  -7.667   6.888  -4.024
  328   2HD2  ASN  45          2HD2      ASN  45  -9.126   7.407  -4.701
  329    H    PHE  46           H        PHE  46  -6.256   5.379  -2.779
  330    HA   PHE  46           HA       PHE  46  -3.919   5.270  -4.416
  331   1HB   PHE  46          1HB       PHE  46  -4.605   3.429  -2.927
  332   2HB   PHE  46          2HB       PHE  46  -6.055   3.170  -3.929
  333    HD1  PHE  46           HD1      PHE  46  -2.308   3.376  -4.312
  334    HD2  PHE  46           HD2      PHE  46  -5.939   1.487  -5.504
  335    HE1  PHE  46           HE1      PHE  46  -1.046   1.845  -5.759
  336    HE2  PHE  46           HE2      PHE  46  -4.675  -0.047  -6.945
  337    HZ   PHE  46           HZ       PHE  46  -2.221   0.134  -7.077
  338    H    GLU  47           H        GLU  47  -7.336   5.518  -5.078
  339    HA   GLU  47           HA       GLU  47  -7.345   4.551  -7.705
  340   1HB   GLU  47          1HB       GLU  47  -9.333   5.010  -6.233
  341   2HB   GLU  47          2HB       GLU  47  -9.147   6.710  -6.622
  342   1HG   GLU  47          1HG       GLU  47  -9.441   6.162  -9.007
  343   2HG   GLU  47          2HG       GLU  47  -9.730   4.482  -8.552
  344    H    LYS  48           H        LYS  48  -7.265   7.980  -6.652
  345    HA   LYS  48           HA       LYS  48  -6.936   8.924  -9.298
  346   1HB   LYS  48          1HB       LYS  48  -6.559  11.126  -8.311
  347   2HB   LYS  48          2HB       LYS  48  -7.950  10.328  -7.596
  348   1HG   LYS  48          1HG       LYS  48  -6.718   9.828  -5.602
  349   2HG   LYS  48          2HG       LYS  48  -5.215  10.391  -6.335
  350   1HD   LYS  48          1HD       LYS  48  -6.095  12.067  -4.813
  351   2HD   LYS  48          2HD       LYS  48  -6.137  12.658  -6.476
  352   1HE   LYS  48          1HE       LYS  48  -8.509  12.182  -6.623
  353   2HE   LYS  48          2HE       LYS  48  -8.493  11.463  -5.013
  354   1HZ   LYS  48          1HZ       LYS  48  -7.528  14.210  -5.232
  355   2HZ   LYS  48          2HZ       LYS  48  -8.441  13.468  -4.009
  356   3HZ   LYS  48          3HZ       LYS  48  -9.198  13.964  -5.446
  357    H    ASP  49           H        ASP  49  -4.554   8.403  -6.703
  358    HA   ASP  49           HA       ASP  49  -2.453   9.380  -8.466
  359   1HB   ASP  49          1HB       ASP  49  -2.662   8.772  -5.564
  360   2HB   ASP  49          2HB       ASP  49  -1.065   8.677  -6.305
  361    H    GLY  50           H        GLY  50  -2.787   6.464  -6.444
  362   1HA   GLY  50          1HA       GLY  50  -2.509   4.259  -7.222
  363   2HA   GLY  50          2HA       GLY  50  -1.790   4.906  -8.685
  364    H    LYS  51           H        LYS  51  -0.545   6.325  -5.867
  365    HA   LYS  51           HA       LYS  51   2.001   5.054  -6.294
  366   1HB   LYS  51          1HB       LYS  51   1.044   7.209  -4.434
  367   2HB   LYS  51          2HB       LYS  51   2.619   6.472  -4.214
  368   1HG   LYS  51          1HG       LYS  51   3.028   8.411  -5.425
  369   2HG   LYS  51          2HG       LYS  51   3.086   7.120  -6.619
  370   1HD   LYS  51          1HD       LYS  51   0.805   7.672  -7.315
  371   2HD   LYS  51          2HD       LYS  51   0.752   8.965  -6.114
  372   1HE   LYS  51          1HE       LYS  51   2.723  10.000  -7.250
  373   2HE   LYS  51          2HE       LYS  51   2.578   8.776  -8.511
  374   1HZ   LYS  51          1HZ       LYS  51   0.167  10.292  -7.883
  375   2HZ   LYS  51          2HZ       LYS  51   0.755   9.751  -9.384
  376   3HZ   LYS  51          3HZ       LYS  51   1.411  11.147  -8.660
  377    H    TYR  52           H        TYR  52   2.461   3.159  -5.487
  378    HA   TYR  52           HA       TYR  52   1.642   2.490  -2.771
  379   1HB   TYR  52          1HB       TYR  52   0.698   0.381  -3.394
  380   2HB   TYR  52          2HB       TYR  52  -0.059   1.583  -4.438
  381    HD1  TYR  52           HD1      TYR  52   1.199   1.972  -6.755
  382    HD2  TYR  52           HD2      TYR  52   1.543  -1.544  -4.372
  383    HE1  TYR  52           HE1      TYR  52   1.976   0.723  -8.716
  384    HE2  TYR  52           HE2      TYR  52   2.318  -2.800  -6.337
  385    HH   TYR  52           HH       TYR  52   2.617  -1.236  -9.521
  386    H    GLY  53           H        GLY  53   2.623   0.366  -2.166
  387   1HA   GLY  53          1HA       GLY  53   4.927  -0.551  -3.561
  388   2HA   GLY  53          2HA       GLY  53   5.335   0.383  -2.131
  389    H    PHE  54           H        PHE  54   6.101  -2.192  -2.159
  390    HA   PHE  54           HA       PHE  54   3.994  -3.602  -0.757
  391   1HB   PHE  54          1HB       PHE  54   6.594  -4.657  -1.833
  392   2HB   PHE  54          2HB       PHE  54   5.327  -5.630  -1.096
  393    HD1  PHE  54           HD1      PHE  54   2.906  -5.011  -2.187
  394    HD2  PHE  54           HD2      PHE  54   6.692  -4.794  -4.106
  395    HE1  PHE  54           HE1      PHE  54   1.802  -5.224  -4.367
  396    HE2  PHE  54           HE2      PHE  54   5.597  -5.005  -6.301
  397    HZ   PHE  54           HZ       PHE  54   3.149  -5.219  -6.433
  398    H    CYS  55           H        CYS  55   4.268  -4.666   1.144
  399    HA   CYS  55           HA       CYS  55   6.594  -3.968   2.794
  400   1HB   CYS  55          1HB       CYS  55   4.419  -4.115   4.552
  401   2HB   CYS  55          2HB       CYS  55   5.295  -2.659   4.090
  402    HA   PRO  56           HA       PRO  56   5.479  -8.508   2.692
  403   1HB   PRO  56          1HB       PRO  56   7.900  -9.444   2.007
  404   2HB   PRO  56          2HB       PRO  56   6.736  -8.865   0.809
  405   1HG   PRO  56          1HG       PRO  56   9.099  -7.446   1.999
  406   2HG   PRO  56          2HG       PRO  56   8.573  -7.517   0.306
  407   1HD   PRO  56          1HD       PRO  56   8.031  -5.399   1.905
  408   2HD   PRO  56          2HD       PRO  56   6.942  -5.922   0.607
  409    H    HIS  57           H        HIS  57   6.279 -10.270   3.956
  410    HA   HIS  57           HA       HIS  57   7.357  -9.367   6.487
  411   1HB   HIS  57          1HB       HIS  57   5.438 -10.926   6.449
  412   2HB   HIS  57          2HB       HIS  57   6.436 -12.120   5.620
  413    HD1  HIS  57           HD1      HIS  57   6.904 -10.076   8.817
  414    HD2  HIS  57           HD2      HIS  57   7.204 -13.985   7.413
  415    HE1  HIS  57           HE1      HIS  57   7.669 -11.452  10.783
  416    H    GLU  58           H        GLU  58   9.434  -9.477   7.002
  417    HA   GLU  58           HA       GLU  58  11.351 -10.508   5.198
  418   1HB   GLU  58          1HB       GLU  58  12.951 -10.044   7.128
  419   2HB   GLU  58          2HB       GLU  58  12.059  -8.674   6.485
  420   1HG   GLU  58          1HG       GLU  58  10.854 -10.098   8.781
  421   2HG   GLU  58          2HG       GLU  58  12.314  -9.155   9.091
  422    H    ALA  59           H        ALA  59  11.776 -12.557   4.879
  423    HA   ALA  59           HA       ALA  59  11.476 -14.429   7.119
  424   1HB   ALA  59          1HB       ALA  59  11.663 -15.463   4.360
  425   2HB   ALA  59          2HB       ALA  59  10.195 -14.583   4.783
  426   3HB   ALA  59          3HB       ALA  59  10.670 -16.008   5.711
  Start of MODEL    4
    1   1H    ARG   1          1H        ARG   1  11.667   5.441   8.597
    2   2H    ARG   1          2H        ARG   1  11.223   5.168  10.237
    3   3H    ARG   1          3H        ARG   1  10.638   6.552   9.407
    4    HA   ARG   1           HA       ARG   1   9.229   4.409   9.750
    5   1HB   ARG   1          1HB       ARG   1   8.884   6.722   8.548
    6   2HB   ARG   1          2HB       ARG   1   9.071   5.765   7.083
    7   1HG   ARG   1          1HG       ARG   1   7.172   4.460   7.579
    8   2HG   ARG   1          2HG       ARG   1   7.108   5.061   9.238
    9   1HD   ARG   1          1HD       ARG   1   6.503   7.271   8.442
   10   2HD   ARG   1          2HD       ARG   1   6.669   6.731   6.769
   11    HE   ARG   1           HE       ARG   1   4.606   5.744   6.900
   12   1HH1  ARG   1          1HH1      ARG   1   5.642   6.610  10.126
   13   2HH1  ARG   1          2HH1      ARG   1   4.152   6.127  10.871
   14   1HH2  ARG   1          1HH2      ARG   1   2.654   5.140   7.857
   15   2HH2  ARG   1          2HH2      ARG   1   2.437   5.300   9.575
   16    H    ILE   2           H        ILE   2  10.789   4.843   6.556
   17    HA   ILE   2           HA       ILE   2  11.186   3.321   4.857
   18    HB   ILE   2           HB       ILE   2  13.315   3.357   6.013
   19   1HG1  ILE   2          1HG1      ILE   2  12.488   0.627   5.034
   20   2HG1  ILE   2          2HG1      ILE   2  13.327   1.899   4.150
   21   1HG2  ILE   2          1HG2      ILE   2  11.910   1.900   8.025
   22   2HG2  ILE   2          2HG2      ILE   2  13.508   2.656   8.103
   23   3HG2  ILE   2          3HG2      ILE   2  13.347   0.992   7.538
   24   1HD1  ILE   2          1HD1      ILE   2  15.236   1.594   5.763
   25   2HD1  ILE   2          2HD1      ILE   2  14.939   0.252   4.658
   26   3HD1  ILE   2          3HD1      ILE   2  14.404   0.151   6.336
   27    HA   PRO   3           HA       PRO   3   8.419  -0.202   5.987
   28   1HB   PRO   3          1HB       PRO   3   5.978   0.973   5.598
   29   2HB   PRO   3          2HB       PRO   3   6.844   0.963   7.138
   30   1HG   PRO   3          1HG       PRO   3   6.245   3.228   5.523
   31   2HG   PRO   3          2HG       PRO   3   7.234   3.185   6.990
   32   1HD   PRO   3          1HD       PRO   3   8.100   3.064   4.114
   33   2HD   PRO   3          2HD       PRO   3   8.909   3.832   5.508
   34    H    VAL   4           H        VAL   4   9.397   0.884   3.216
   35    HA   VAL   4           HA       VAL   4   7.378  -0.626   1.688
   36    HB   VAL   4           HB       VAL   4   8.589   1.984   0.681
   37   1HG1  VAL   4          1HG1      VAL   4   7.781   1.465  -1.316
   38   2HG1  VAL   4          2HG1      VAL   4   6.185   1.141  -0.646
   39   3HG1  VAL   4          3HG1      VAL   4   7.387  -0.145  -0.706
   40   1HG2  VAL   4          1HG2      VAL   4   6.561   3.088   1.136
   41   2HG2  VAL   4          2HG2      VAL   4   6.927   2.185   2.607
   42   3HG2  VAL   4          3HG2      VAL   4   5.712   1.578   1.482
   43    H    LYS   5           H        LYS   5   8.140  -1.642  -0.219
   44    HA   LYS   5           HA       LYS   5  11.073  -1.708  -0.479
   45   1HB   LYS   5          1HB       LYS   5   9.293  -3.840   0.248
   46   2HB   LYS   5          2HB       LYS   5  10.065  -4.222  -1.283
   47   1HG   LYS   5          1HG       LYS   5  11.489  -3.505   1.278
   48   2HG   LYS   5          2HG       LYS   5  11.301  -5.136   0.599
   49   1HD   LYS   5          1HD       LYS   5  12.599  -4.538  -1.333
   50   2HD   LYS   5          2HD       LYS   5  12.702  -2.854  -0.800
   51   1HE   LYS   5          1HE       LYS   5  13.987  -3.515   1.145
   52   2HE   LYS   5          2HE       LYS   5  13.804  -5.218   0.726
   53   1HZ   LYS   5          1HZ       LYS   5  15.029  -3.425  -1.245
   54   2HZ   LYS   5          2HZ       LYS   5  15.316  -5.069  -0.951
   55   3HZ   LYS   5          3HZ       LYS   5  15.953  -3.892   0.103
   56    H    TYR   6           H        TYR   6   8.520  -3.403  -2.268
   57    HA   TYR   6           HA       TYR   6   9.682  -2.336  -4.730
   58   1HB   TYR   6          1HB       TYR   6   7.562  -4.481  -4.521
   59   2HB   TYR   6          2HB       TYR   6   8.611  -4.127  -5.888
   60    HD1  TYR   6           HD1      TYR   6   8.618  -5.477  -2.425
   61    HD2  TYR   6           HD2      TYR   6  10.741  -5.155  -6.099
   62    HE1  TYR   6           HE1      TYR   6  10.230  -7.132  -1.624
   63    HE2  TYR   6           HE2      TYR   6  12.360  -6.818  -5.304
   64    HH   TYR   6           HH       TYR   6  13.021  -8.096  -3.612
   65    H    GLY   7           H        GLY   7   8.284  -1.651  -6.482
   66   1HA   GLY   7          1HA       GLY   7   5.994  -1.051  -7.143
   67   2HA   GLY   7          2HA       GLY   7   5.774  -0.370  -5.544
   68    H    ASN   8           H        ASN   8   5.212   1.646  -6.581
   69    HA   ASN   8           HA       ASN   8   7.523   2.969  -7.826
   70   1HB   ASN   8          1HB       ASN   8   6.038   4.474  -8.945
   71   2HB   ASN   8          2HB       ASN   8   5.444   2.839  -9.196
   72   1HD2  ASN   8          1HD2      ASN   8   4.055   5.374  -9.391
   73   2HD2  ASN   8          2HD2      ASN   8   2.737   5.290  -8.285
   74    H    ALA   9           H        ALA   9   6.581   2.703  -4.866
   75    HA   ALA   9           HA       ALA   9   6.557   5.522  -4.124
   76   1HB   ALA   9          1HB       ALA   9   6.501   3.291  -2.145
   77   2HB   ALA   9          2HB       ALA   9   5.057   3.637  -3.110
   78   3HB   ALA   9          3HB       ALA   9   5.737   4.885  -2.065
   79    H    ASP  10           H        ASP  10   8.862   5.044  -5.280
   80    HA   ASP  10           HA       ASP  10  10.914   3.902  -3.738
   81   1HB   ASP  10          1HB       ASP  10  11.036   5.999  -5.918
   82   2HB   ASP  10          2HB       ASP  10  12.447   5.198  -5.234
   83    H    GLY  11           H        GLY  11  11.457   4.544  -1.766
   84   1HA   GLY  11          1HA       GLY  11  12.555   5.977  -0.271
   85   2HA   GLY  11          2HA       GLY  11  12.226   7.322  -1.355
   86    H    GLU  12           H        GLU  12   9.348   6.323  -1.444
   87    HA   GLU  12           HA       GLU  12   8.426   7.997   0.694
   88   1HB   GLU  12          1HB       GLU  12   6.929   6.378  -1.366
   89   2HB   GLU  12          2HB       GLU  12   6.186   7.530  -0.262
   90   1HG   GLU  12          1HG       GLU  12   7.221   9.354  -1.295
   91   2HG   GLU  12          2HG       GLU  12   8.373   8.328  -2.118
   92    H    TYR  13           H        TYR  13   6.538   7.262   2.066
   93    HA   TYR  13           HA       TYR  13   6.997   4.554   3.033
   94   1HB   TYR  13          1HB       TYR  13   6.318   5.523   5.251
   95   2HB   TYR  13          2HB       TYR  13   7.913   5.941   4.637
   96    HD1  TYR  13           HD1      TYR  13   4.410   7.203   4.474
   97    HD2  TYR  13           HD2      TYR  13   8.546   8.097   4.809
   98    HE1  TYR  13           HE1      TYR  13   3.859   9.587   4.740
   99    HE2  TYR  13           HE2      TYR  13   8.023  10.487   5.080
  100    HH   TYR  13           HH       TYR  13   4.894  11.757   4.448
  101    H    CYS  14           H        CYS  14   5.072   3.814   4.497
  102    HA   CYS  14           HA       CYS  14   2.735   3.891   2.846
  103   1HB   CYS  14          1HB       CYS  14   3.279   2.571   5.506
  104   2HB   CYS  14          2HB       CYS  14   1.788   2.374   4.592
  105    H    LYS  15           H        LYS  15   0.863   4.940   3.181
  106    HA   LYS  15           HA       LYS  15   0.749   6.803   5.448
  107   1HB   LYS  15          1HB       LYS  15   0.601   7.741   3.124
  108   2HB   LYS  15          2HB       LYS  15  -0.870   6.808   2.886
  109   1HG   LYS  15          1HG       LYS  15  -0.737   8.705   5.184
  110   2HG   LYS  15          2HG       LYS  15  -0.956   9.343   3.556
  111   1HD   LYS  15          1HD       LYS  15  -2.928   7.944   3.251
  112   2HD   LYS  15          2HD       LYS  15  -2.703   7.257   4.864
  113   1HE   LYS  15          1HE       LYS  15  -3.043   9.461   5.860
  114   2HE   LYS  15          2HE       LYS  15  -3.220  10.170   4.254
  115   1HZ   LYS  15          1HZ       LYS  15  -5.351   9.682   5.456
  116   2HZ   LYS  15          2HZ       LYS  15  -5.001   8.030   5.283
  117   3HZ   LYS  15          3HZ       LYS  15  -5.234   8.990   3.905
  118    H    PHE  16           H        PHE  16  -0.410   6.094   7.111
  119    HA   PHE  16           HA       PHE  16  -2.738   4.368   6.562
  120   1HB   PHE  16          1HB       PHE  16  -1.017   4.460   9.050
  121   2HB   PHE  16          2HB       PHE  16  -2.427   3.438   8.823
  122    HD1  PHE  16           HD1      PHE  16  -2.178   2.131   6.364
  123    HD2  PHE  16           HD2      PHE  16   0.931   3.306   9.014
  124    HE1  PHE  16           HE1      PHE  16  -0.753   0.348   5.473
  125    HE2  PHE  16           HE2      PHE  16   2.370   1.529   8.128
  126    HZ   PHE  16           HZ       PHE  16   1.537   0.011   6.356
  127    HA   PRO  17           HA       PRO  17  -4.442   3.857   6.987
  128   1HB   PRO  17          1HB       PRO  17  -7.117   4.547   6.807
  129   2HB   PRO  17          2HB       PRO  17  -6.385   3.665   8.148
  130   1HG   PRO  17          1HG       PRO  17  -7.486   6.311   8.174
  131   2HG   PRO  17          2HG       PRO  17  -6.747   5.427   9.516
  132   1HD   PRO  17          1HD       PRO  17  -5.604   7.525   7.794
  133   2HD   PRO  17          2HD       PRO  17  -5.102   6.981   9.410
  134    H    PHE  18           H        PHE  18  -4.713   3.446   4.791
  135    HA   PHE  18           HA       PHE  18  -5.030   5.834   3.118
  136   1HB   PHE  18          1HB       PHE  18  -3.920   4.642   1.339
  137   2HB   PHE  18          2HB       PHE  18  -2.963   4.489   2.804
  138    HD1  PHE  18           HD1      PHE  18  -5.177   2.711   0.463
  139    HD2  PHE  18           HD2      PHE  18  -2.554   2.368   3.794
  140    HE1  PHE  18           HE1      PHE  18  -5.144   0.282   0.165
  141    HE2  PHE  18           HE2      PHE  18  -2.513  -0.078   3.504
  142    HZ   PHE  18           HZ       PHE  18  -3.807  -1.141   1.690
  143    H    LEU  19           H        LEU  19  -6.479   5.877   1.374
  144    HA   LEU  19           HA       LEU  19  -8.825   4.243   1.849
  145   1HB   LEU  19          1HB       LEU  19  -8.996   6.693   1.530
  146   2HB   LEU  19          2HB       LEU  19  -8.423   6.496  -0.115
  147    HG   LEU  19           HG       LEU  19 -10.455   4.955  -0.440
  148   1HD1  LEU  19          1HD1      LEU  19 -12.327   5.341   1.022
  149   2HD1  LEU  19          2HD1      LEU  19 -11.375   6.456   1.999
  150   3HD1  LEU  19          3HD1      LEU  19 -10.956   4.745   1.960
  151   1HD2  LEU  19          1HD2      LEU  19 -10.029   7.485  -1.087
  152   2HD2  LEU  19          2HD2      LEU  19 -11.358   7.738   0.042
  153   3HD2  LEU  19          3HD2      LEU  19 -11.585   6.697  -1.364
  154    H    PHE  20           H        PHE  20  -9.174   2.413   0.824
  155    HA   PHE  20           HA       PHE  20  -8.133   2.104  -1.912
  156   1HB   PHE  20          1HB       PHE  20  -7.139   0.527  -0.197
  157   2HB   PHE  20          2HB       PHE  20  -8.767  -0.110   0.013
  158    HD1  PHE  20           HD1      PHE  20  -7.051   0.845  -3.164
  159    HD2  PHE  20           HD2      PHE  20  -8.725  -2.216  -0.732
  160    HE1  PHE  20           HE1      PHE  20  -6.720  -0.800  -4.978
  161    HE2  PHE  20           HE2      PHE  20  -8.403  -3.860  -2.529
  162    HZ   PHE  20           HZ       PHE  20  -7.398  -3.145  -4.670
  163    H    ASN  21           H        ASN  21  -9.882   2.820  -2.974
  164    HA   ASN  21           HA       ASN  21 -11.962   2.919  -3.871
  165   1HB   ASN  21          1HB       ASN  21 -11.705  -0.036  -3.354
  166   2HB   ASN  21          2HB       ASN  21 -13.081   0.664  -4.205
  167   1HD2  ASN  21          1HD2      ASN  21 -12.905   0.662  -6.323
  168   2HD2  ASN  21          2HD2      ASN  21 -11.432   0.708  -7.225
  169    H    GLY  22           H        GLY  22 -11.842   3.444  -1.015
  170   1HA   GLY  22          1HA       GLY  22 -13.793   4.268   0.136
  171   2HA   GLY  22          2HA       GLY  22 -14.664   2.857  -0.430
  172    H    LYS  23           H        LYS  23 -11.693   1.774   0.561
  173    HA   LYS  23           HA       LYS  23 -12.668   1.365   3.312
  174   1HB   LYS  23          1HB       LYS  23 -12.778  -0.641   1.681
  175   2HB   LYS  23          2HB       LYS  23 -11.027  -0.666   1.797
  176   1HG   LYS  23          1HG       LYS  23 -11.185  -1.072   4.202
  177   2HG   LYS  23          2HG       LYS  23 -12.947  -1.011   4.107
  178   1HD   LYS  23          1HD       LYS  23 -12.800  -2.897   2.431
  179   2HD   LYS  23          2HD       LYS  23 -11.098  -3.046   2.879
  180   1HE   LYS  23          1HE       LYS  23 -13.451  -3.288   4.758
  181   2HE   LYS  23          2HE       LYS  23 -12.518  -4.632   4.101
  182   1HZ   LYS  23          1HZ       LYS  23 -11.999  -3.653   6.448
  183   2HZ   LYS  23          2HZ       LYS  23 -11.101  -2.519   5.572
  184   3HZ   LYS  23          3HZ       LYS  23 -10.739  -4.180   5.437
  185    H    GLU  24           H        GLU  24 -11.343   2.317   4.734
  186    HA   GLU  24           HA       GLU  24  -8.616   2.959   3.967
  187   1HB   GLU  24          1HB       GLU  24 -10.025   3.558   6.571
  188   2HB   GLU  24          2HB       GLU  24  -8.536   4.287   5.990
  189   1HG   GLU  24          1HG       GLU  24  -9.832   5.222   4.086
  190   2HG   GLU  24          2HG       GLU  24 -11.295   4.617   4.858
  191    H    TYR  25           H        TYR  25  -6.900   1.776   4.466
  192    HA   TYR  25           HA       TYR  25  -7.203  -0.376   6.442
  193   1HB   TYR  25          1HB       TYR  25  -5.222   0.020   4.225
  194   2HB   TYR  25          2HB       TYR  25  -5.153  -1.317   5.363
  195    HD1  TYR  25           HD1      TYR  25  -7.257  -2.829   5.501
  196    HD2  TYR  25           HD2      TYR  25  -6.453  -0.149   2.305
  197    HE1  TYR  25           HE1      TYR  25  -8.836  -4.071   4.057
  198    HE2  TYR  25           HE2      TYR  25  -8.019  -1.377   0.855
  199    HH   TYR  25           HH       TYR  25  -9.080  -4.408   1.474
  200    H    ASN  26           H        ASN  26  -6.022  -0.493   8.241
  201    HA   ASN  26           HA       ASN  26  -4.334   1.790   8.910
  202   1HB   ASN  26          1HB       ASN  26  -5.270  -0.553  10.591
  203   2HB   ASN  26          2HB       ASN  26  -4.259   0.753  11.187
  204   1HD2  ASN  26          1HD2      ASN  26  -6.444   1.932   8.937
  205   2HD2  ASN  26          2HD2      ASN  26  -7.653   2.500  10.033
  206    H    SER  27           H        SER  27  -4.089  -1.375   7.771
  207    HA   SER  27           HA       SER  27  -1.186  -1.293   8.065
  208   1HB   SER  27          1HB       SER  27  -1.179  -3.739   8.584
  209   2HB   SER  27          2HB       SER  27  -1.916  -2.762   9.861
  210    HG   SER  27           HG       SER  27  -2.988  -4.824   8.780
  211    H    CYS  28           H        CYS  28  -0.188  -3.025   6.601
  212    HA   CYS  28           HA       CYS  28  -1.099  -2.579   3.969
  213   1HB   CYS  28          1HB       CYS  28   0.763  -4.782   4.870
  214   2HB   CYS  28          2HB       CYS  28   0.698  -4.013   3.286
  215    H    THR  29           H        THR  29  -2.320  -3.797   2.584
  216    HA   THR  29           HA       THR  29  -3.471  -6.269   3.656
  217    HB   THR  29           HB       THR  29  -5.138  -4.498   3.696
  218    HG1  THR  29           HG1      THR  29  -5.885  -6.562   3.081
  219   1HG2  THR  29          1HG2      THR  29  -4.840  -2.846   2.193
  220   2HG2  THR  29          2HG2      THR  29  -5.908  -3.849   1.207
  221   3HG2  THR  29          3HG2      THR  29  -4.162  -3.926   0.973
  222    H    ASP  30           H        ASP  30  -4.352  -7.739   1.920
  223    HA   ASP  30           HA       ASP  30  -2.520  -7.727  -0.356
  224   1HB   ASP  30          1HB       ASP  30  -4.029 -10.147  -0.107
  225   2HB   ASP  30          2HB       ASP  30  -2.311  -9.946  -0.241
  226    H    THR  31           H        THR  31  -5.436  -6.708   0.369
  227    HA   THR  31           HA       THR  31  -7.192  -7.831  -1.508
  228    HB   THR  31           HB       THR  31  -7.200  -4.991  -0.506
  229    HG1  THR  31           HG1      THR  31  -7.157  -6.139   1.340
  230   1HG2  THR  31          1HG2      THR  31  -9.523  -4.971  -0.800
  231   2HG2  THR  31          2HG2      THR  31  -9.580  -6.711  -1.086
  232   3HG2  THR  31          3HG2      THR  31  -8.858  -5.642  -2.288
  233    H    GLY  32           H        GLY  32  -7.535  -7.473  -3.630
  234   1HA   GLY  32          1HA       GLY  32  -7.455  -6.286  -5.646
  235   2HA   GLY  32          2HA       GLY  32  -6.279  -5.193  -4.932
  236    H    ARG  33           H        ARG  33  -4.877  -7.685  -3.889
  237    HA   ARG  33           HA       ARG  33  -3.278  -8.141  -6.294
  238   1HB   ARG  33          1HB       ARG  33  -2.659  -8.913  -3.438
  239   2HB   ARG  33          2HB       ARG  33  -1.540  -8.907  -4.792
  240   1HG   ARG  33          1HG       ARG  33  -2.834  -6.487  -3.548
  241   2HG   ARG  33          2HG       ARG  33  -1.170  -7.013  -3.308
  242   1HD   ARG  33          1HD       ARG  33  -2.387  -6.160  -5.935
  243   2HD   ARG  33          2HD       ARG  33  -1.331  -5.176  -4.921
  244    HE   ARG  33           HE       ARG  33  -0.115  -7.666  -5.594
  245   1HH1  ARG  33          1HH1      ARG  33  -0.834  -4.473  -6.825
  246   2HH1  ARG  33          2HH1      ARG  33   0.444  -4.492  -8.000
  247   1HH2  ARG  33          1HH2      ARG  33   1.547  -7.714  -7.147
  248   2HH2  ARG  33          2HH2      ARG  33   1.820  -6.328  -8.165
  249    H    SER  34           H        SER  34  -3.146 -10.112  -7.241
  250    HA   SER  34           HA       SER  34  -4.978 -12.162  -6.314
  251   1HB   SER  34          1HB       SER  34  -3.113 -12.339  -8.686
  252   2HB   SER  34          2HB       SER  34  -4.628 -13.199  -8.428
  253    HG   SER  34           HG       SER  34  -5.355 -10.727  -8.335
  254    H    ASP  35           H        ASP  35  -1.654 -11.408  -5.999
  255    HA   ASP  35           HA       ASP  35  -0.875 -14.134  -5.479
  256   1HB   ASP  35          1HB       ASP  35   0.645 -11.606  -5.706
  257   2HB   ASP  35          2HB       ASP  35   1.399 -13.086  -5.184
  258    H    GLY  36           H        GLY  36  -2.345 -11.904  -3.720
  259   1HA   GLY  36          1HA       GLY  36  -2.620 -11.564  -1.457
  260   2HA   GLY  36          2HA       GLY  36  -1.816 -13.112  -1.240
  261    H    PHE  37           H        PHE  37  -0.666 -10.000  -2.550
  262    HA   PHE  37           HA       PHE  37   1.608 -10.189  -0.702
  263   1HB   PHE  37          1HB       PHE  37   1.206  -8.727  -3.303
  264   2HB   PHE  37          2HB       PHE  37   2.520  -8.309  -2.217
  265    HD1  PHE  37           HD1      PHE  37   3.578  -8.886  -4.613
  266    HD2  PHE  37           HD2      PHE  37   2.035 -11.722  -1.843
  267    HE1  PHE  37           HE1      PHE  37   4.978 -10.639  -5.630
  268    HE2  PHE  37           HE2      PHE  37   3.429 -13.474  -2.850
  269    HZ   PHE  37           HZ       PHE  37   4.911 -12.930  -4.749
  270    H    LEU  38           H        LEU  38   2.023  -8.607   0.785
  271    HA   LEU  38           HA       LEU  38  -0.160  -6.876   1.479
  272   1HB   LEU  38          1HB       LEU  38   2.582  -7.049   2.671
  273   2HB   LEU  38          2HB       LEU  38   1.211  -6.236   3.388
  274    HG   LEU  38           HG       LEU  38   1.421  -9.210   2.900
  275   1HD1  LEU  38          1HD1      LEU  38   2.112  -7.477   5.185
  276   2HD1  LEU  38          2HD1      LEU  38   2.796  -9.021   4.677
  277   3HD1  LEU  38          3HD1      LEU  38   1.263  -8.979   5.545
  278   1HD2  LEU  38          1HD2      LEU  38  -0.809  -7.469   3.594
  279   2HD2  LEU  38          2HD2      LEU  38  -0.548  -8.763   4.764
  280   3HD2  LEU  38          3HD2      LEU  38  -0.804  -9.150   3.062
  281    H    TRP  39           H        TRP  39  -0.450  -4.853   0.786
  282    HA   TRP  39           HA       TRP  39   1.924  -3.293   0.065
  283   1HB   TRP  39          1HB       TRP  39   0.836  -2.394  -1.921
  284   2HB   TRP  39          2HB       TRP  39   0.946  -4.146  -2.029
  285    HD1  TRP  39           HD1      TRP  39  -1.402  -5.525  -1.681
  286    HE1  TRP  39           HE1      TRP  39  -3.821  -4.832  -2.156
  287    HE3  TRP  39           HE3      TRP  39  -0.784  -0.445  -1.906
  288    HZ2  TRP  39           HZ2      TRP  39  -5.280  -2.460  -2.571
  289    HZ3  TRP  39           HZ3      TRP  39  -2.761   0.952  -2.358
  290    HH2  TRP  39           HH2      TRP  39  -4.956  -0.044  -2.668
  291    H    CYS  40           H        CYS  40   1.308  -0.932  -0.269
  292    HA   CYS  40           HA       CYS  40  -0.942  -0.032   1.343
  293   1HB   CYS  40          1HB       CYS  40   0.415   1.295   2.833
  294   2HB   CYS  40          2HB       CYS  40   1.045  -0.350   2.879
  295    H    SER  41           H        SER  41  -1.125   2.408   1.172
  296    HA   SER  41           HA       SER  41  -0.163   3.231  -1.476
  297   1HB   SER  41          1HB       SER  41  -2.679   3.233  -0.957
  298   2HB   SER  41          2HB       SER  41  -2.351   4.603   0.102
  299    HG   SER  41           HG       SER  41  -1.499   4.593  -2.599
  300    H    THR  42           H        THR  42   0.426   5.544  -1.661
  301    HA   THR  42           HA       THR  42   1.924   6.383   0.727
  302    HB   THR  42           HB       THR  42   2.424   7.352  -2.080
  303    HG1  THR  42           HG1      THR  42   4.046   5.330  -1.245
  304   1HG2  THR  42          1HG2      THR  42   3.588   8.311   0.026
  305   2HG2  THR  42          2HG2      THR  42   4.547   7.915  -1.401
  306   3HG2  THR  42          3HG2      THR  42   4.514   6.809  -0.026
  307    H    THR  43           H        THR  43  -0.553   7.271  -1.476
  308    HA   THR  43           HA       THR  43  -0.579  10.027  -0.480
  309    HB   THR  43           HB       THR  43  -2.160  10.370  -2.432
  310    HG1  THR  43           HG1      THR  43  -2.626   8.747  -3.684
  311   1HG2  THR  43          1HG2      THR  43  -0.433  11.023  -3.652
  312   2HG2  THR  43          2HG2      THR  43   0.126   9.365  -3.869
  313   3HG2  THR  43          3HG2      THR  43   0.610  10.280  -2.443
  314    H    TYR  44           H        TYR  44  -3.417  10.203  -1.440
  315    HA   TYR  44           HA       TYR  44  -4.617   9.232   1.023
  316   1HB   TYR  44          1HB       TYR  44  -5.437  11.300  -0.969
  317   2HB   TYR  44          2HB       TYR  44  -6.571  10.699   0.233
  318    HD1  TYR  44           HD1      TYR  44  -5.529  10.701   2.711
  319    HD2  TYR  44           HD2      TYR  44  -4.290  13.249  -0.463
  320    HE1  TYR  44           HE1      TYR  44  -4.614  12.286   4.350
  321    HE2  TYR  44           HE2      TYR  44  -3.366  14.837   1.172
  322    HH   TYR  44           HH       TYR  44  -3.594  14.226   4.668
  323    H    ASN  45           H        ASN  45  -5.566   9.422  -2.404
  324    HA   ASN  45           HA       ASN  45  -7.144   6.981  -1.956
  325   1HB   ASN  45          1HB       ASN  45  -8.370   9.085  -2.680
  326   2HB   ASN  45          2HB       ASN  45  -7.513   8.982  -4.198
  327   1HD2  ASN  45          1HD2      ASN  45  -7.853   5.902  -3.907
  328   2HD2  ASN  45          2HD2      ASN  45  -9.452   5.744  -4.436
  329    H    PHE  46           H        PHE  46  -6.159   5.226  -2.714
  330    HA   PHE  46           HA       PHE  46  -3.902   5.130  -4.323
  331   1HB   PHE  46          1HB       PHE  46  -4.547   3.253  -2.952
  332   2HB   PHE  46          2HB       PHE  46  -6.055   3.041  -3.875
  333    HD1  PHE  46           HD1      PHE  46  -2.347   3.242  -4.541
  334    HD2  PHE  46           HD2      PHE  46  -6.048   1.307  -5.385
  335    HE1  PHE  46           HE1      PHE  46  -1.195   1.697  -6.057
  336    HE2  PHE  46           HE2      PHE  46  -4.894  -0.242  -6.900
  337    HZ   PHE  46           HZ       PHE  46  -2.468  -0.051  -7.240
  338    H    GLU  47           H        GLU  47  -7.293   4.776  -5.278
  339    HA   GLU  47           HA       GLU  47  -6.961   4.108  -7.961
  340   1HB   GLU  47          1HB       GLU  47  -9.077   3.998  -6.734
  341   2HB   GLU  47          2HB       GLU  47  -9.138   5.747  -6.656
  342   1HG   GLU  47          1HG       GLU  47  -9.330   5.849  -9.085
  343   2HG   GLU  47          2HG       GLU  47  -9.271   4.087  -9.160
  344    H    LYS  48           H        LYS  48  -7.481   7.307  -6.545
  345    HA   LYS  48           HA       LYS  48  -7.317   8.748  -8.944
  346   1HB   LYS  48          1HB       LYS  48  -8.386   9.933  -7.293
  347   2HB   LYS  48          2HB       LYS  48  -7.274   9.410  -6.041
  348   1HG   LYS  48          1HG       LYS  48  -5.578  10.974  -6.944
  349   2HG   LYS  48          2HG       LYS  48  -6.769  11.548  -8.115
  350   1HD   LYS  48          1HD       LYS  48  -8.218  12.285  -6.312
  351   2HD   LYS  48          2HD       LYS  48  -7.091  11.649  -5.114
  352   1HE   LYS  48          1HE       LYS  48  -6.484  13.835  -7.105
  353   2HE   LYS  48          2HE       LYS  48  -6.871  14.083  -5.402
  354   1HZ   LYS  48          1HZ       LYS  48  -4.830  13.427  -4.751
  355   2HZ   LYS  48          2HZ       LYS  48  -4.389  13.883  -6.325
  356   3HZ   LYS  48          3HZ       LYS  48  -4.677  12.252  -5.967
  357    H    ASP  49           H        ASP  49  -4.796   8.105  -6.494
  358    HA   ASP  49           HA       ASP  49  -2.902   9.625  -8.083
  359   1HB   ASP  49          1HB       ASP  49  -2.577   8.255  -5.416
  360   2HB   ASP  49          2HB       ASP  49  -1.364   9.280  -6.184
  361    H    GLY  50           H        GLY  50  -2.871   6.331  -6.679
  362   1HA   GLY  50          1HA       GLY  50  -2.349   4.416  -8.005
  363   2HA   GLY  50          2HA       GLY  50  -1.462   5.470  -9.088
  364    H    LYS  51           H        LYS  51  -0.681   6.371  -6.003
  365    HA   LYS  51           HA       LYS  51   1.924   5.156  -6.187
  366   1HB   LYS  51          1HB       LYS  51   0.756   6.860  -3.998
  367   2HB   LYS  51          2HB       LYS  51   2.457   6.469  -4.221
  368   1HG   LYS  51          1HG       LYS  51   0.833   7.917  -6.270
  369   2HG   LYS  51          2HG       LYS  51   1.714   8.743  -4.988
  370   1HD   LYS  51          1HD       LYS  51   2.853   7.006  -7.168
  371   2HD   LYS  51          2HD       LYS  51   3.028   8.756  -7.004
  372   1HE   LYS  51          1HE       LYS  51   4.103   8.226  -4.730
  373   2HE   LYS  51          2HE       LYS  51   4.243   6.574  -5.327
  374   1HZ   LYS  51          1HZ       LYS  51   5.501   7.473  -7.250
  375   2HZ   LYS  51          2HZ       LYS  51   6.265   7.719  -5.756
  376   3HZ   LYS  51          3HZ       LYS  51   5.460   9.010  -6.514
  377    H    TYR  52           H        TYR  52   2.563   3.361  -5.231
  378    HA   TYR  52           HA       TYR  52   1.394   2.435  -2.765
  379   1HB   TYR  52          1HB       TYR  52   0.583   0.338  -3.608
  380   2HB   TYR  52          2HB       TYR  52  -0.121   1.600  -4.614
  381    HD1  TYR  52           HD1      TYR  52   2.237  -1.177  -4.486
  382    HD2  TYR  52           HD2      TYR  52   0.603   1.887  -6.938
  383    HE1  TYR  52           HE1      TYR  52   3.175  -2.278  -6.465
  384    HE2  TYR  52           HE2      TYR  52   1.532   0.790  -8.934
  385    HH   TYR  52           HH       TYR  52   3.584  -2.096  -8.653
  386    H    GLY  53           H        GLY  53   2.396   0.306  -2.166
  387   1HA   GLY  53          1HA       GLY  53   4.806  -0.539  -3.372
  388   2HA   GLY  53          2HA       GLY  53   5.133   0.449  -1.959
  389    H    PHE  54           H        PHE  54   5.808  -2.293  -2.155
  390    HA   PHE  54           HA       PHE  54   3.752  -3.674  -0.649
  391   1HB   PHE  54          1HB       PHE  54   6.403  -4.656  -1.694
  392   2HB   PHE  54          2HB       PHE  54   5.212  -5.660  -0.876
  393    HD1  PHE  54           HD1      PHE  54   5.611  -3.409  -3.813
  394    HD2  PHE  54           HD2      PHE  54   3.553  -6.717  -2.102
  395    HE1  PHE  54           HE1      PHE  54   4.465  -3.789  -5.952
  396    HE2  PHE  54           HE2      PHE  54   2.405  -7.109  -4.248
  397    HZ   PHE  54           HZ       PHE  54   2.859  -5.644  -6.173
  398    H    CYS  55           H        CYS  55   3.826  -4.177   1.479
  399    HA   CYS  55           HA       CYS  55   6.277  -3.496   2.948
  400   1HB   CYS  55          1HB       CYS  55   4.640  -2.474   4.688
  401   2HB   CYS  55          2HB       CYS  55   5.115  -1.528   3.279
  402    HA   PRO  56           HA       PRO  56   4.427  -7.299   4.793
  403   1HB   PRO  56          1HB       PRO  56   6.396  -9.039   4.257
  404   2HB   PRO  56          2HB       PRO  56   5.130  -8.672   3.083
  405   1HG   PRO  56          1HG       PRO  56   7.970  -7.834   3.114
  406   2HG   PRO  56          2HG       PRO  56   6.875  -8.056   1.742
  407   1HD   PRO  56          1HD       PRO  56   7.600  -5.605   2.992
  408   2HD   PRO  56          2HD       PRO  56   6.378  -5.843   1.726
  409    H    HIS  57           H        HIS  57   5.292  -8.491   6.743
  410    HA   HIS  57           HA       HIS  57   6.979  -6.705   8.238
  411   1HB   HIS  57          1HB       HIS  57   6.601  -8.126  10.156
  412   2HB   HIS  57          2HB       HIS  57   5.077  -7.842   9.333
  413    HD1  HIS  57           HD1      HIS  57   7.754 -10.565   9.424
  414    HD2  HIS  57           HD2      HIS  57   3.644 -10.098   8.987
  415    HE1  HIS  57           HE1      HIS  57   6.814 -12.896   9.368
  416    H    GLU  58           H        GLU  58   7.435  -9.507   6.342
  417    HA   GLU  58           HA       GLU  58  10.200  -9.712   7.298
  418   1HB   GLU  58          1HB       GLU  58  10.217 -12.002   6.565
  419   2HB   GLU  58          2HB       GLU  58   8.852 -11.769   7.630
  420   1HG   GLU  58          1HG       GLU  58   8.631 -11.774   4.634
  421   2HG   GLU  58          2HG       GLU  58   8.475 -13.222   5.619
  422    H    ALA  59           H        ALA  59  10.993 -11.277   4.955
  423    HA   ALA  59           HA       ALA  59  11.008  -9.092   2.987
  424   1HB   ALA  59          1HB       ALA  59  13.140  -9.968   2.197
  425   2HB   ALA  59          2HB       ALA  59  13.047 -11.282   3.374
  426   3HB   ALA  59          3HB       ALA  59  13.215  -9.611   3.923
  Start of MODEL    5
    1   1H    ARG   1          1H        ARG   1  14.394   6.364   3.646
    2   2H    ARG   1          2H        ARG   1  14.271   6.887   5.280
    3   3H    ARG   1          3H        ARG   1  13.502   7.783   4.030
    4    HA   ARG   1           HA       ARG   1  12.260   6.094   5.544
    5   1HB   ARG   1          1HB       ARG   1  11.890   6.773   2.679
    6   2HB   ARG   1          2HB       ARG   1  10.688   5.838   3.541
    7   1HG   ARG   1          1HG       ARG   1  10.309   7.655   5.074
    8   2HG   ARG   1          2HG       ARG   1  11.651   8.571   4.388
    9   1HD   ARG   1          1HD       ARG   1  10.475   9.193   2.542
   10   2HD   ARG   1          2HD       ARG   1   9.482   7.738   2.544
   11    HE   ARG   1           HE       ARG   1   8.710   9.164   4.775
   12   1HH1  ARG   1          1HH1      ARG   1   8.832   9.756   1.326
   13   2HH1  ARG   1          2HH1      ARG   1   7.442  10.800   1.333
   14   1HH2  ARG   1          1HH2      ARG   1   6.900  10.582   4.779
   15   2HH2  ARG   1          2HH2      ARG   1   6.361  11.269   3.272
   16    H    ILE   2           H        ILE   2  11.148   3.945   5.042
   17    HA   ILE   2           HA       ILE   2  12.590   2.131   3.362
   18    HB   ILE   2           HB       ILE   2  13.743   2.498   5.824
   19   1HG1  ILE   2          1HG1      ILE   2  14.712   1.512   3.749
   20   2HG1  ILE   2          2HG1      ILE   2  15.193   0.695   5.231
   21   1HG2  ILE   2          1HG2      ILE   2  11.642   0.593   6.215
   22   2HG2  ILE   2          2HG2      ILE   2  12.790   1.253   7.380
   23   3HG2  ILE   2          3HG2      ILE   2  13.214  -0.175   6.436
   24   1HD1  ILE   2          1HD1      ILE   2  13.076  -0.259   3.314
   25   2HD1  ILE   2          2HD1      ILE   2  13.604  -1.086   4.781
   26   3HD1  ILE   2          3HD1      ILE   2  14.721  -0.878   3.431
   27    HA   PRO   3           HA       PRO   3   8.743   0.014   5.823
   28   1HB   PRO   3          1HB       PRO   3   6.989   2.320   5.146
   29   2HB   PRO   3          2HB       PRO   3   6.894   1.189   6.502
   30   1HG   PRO   3          1HG       PRO   3   7.856   3.617   6.903
   31   2HG   PRO   3          2HG       PRO   3   8.651   2.212   7.644
   32   1HD   PRO   3          1HD       PRO   3   9.475   3.816   5.240
   33   2HD   PRO   3          2HD       PRO   3  10.478   3.128   6.535
   34    H    VAL   4           H        VAL   4   8.991   1.834   2.874
   35    HA   VAL   4           HA       VAL   4   7.196  -0.116   1.563
   36    HB   VAL   4           HB       VAL   4   7.978   2.678   0.616
   37   1HG1  VAL   4          1HG1      VAL   4   6.094   0.699  -0.666
   38   2HG1  VAL   4          2HG1      VAL   4   7.721   1.066  -1.239
   39   3HG1  VAL   4          3HG1      VAL   4   6.482   2.319  -1.246
   40   1HG2  VAL   4          1HG2      VAL   4   5.155   2.231   0.840
   41   2HG2  VAL   4          2HG2      VAL   4   6.158   3.426   1.660
   42   3HG2  VAL   4          3HG2      VAL   4   5.932   1.829   2.371
   43    H    LYS   5           H        LYS   5   7.958  -1.213  -0.285
   44    HA   LYS   5           HA       LYS   5  10.868  -1.019  -0.619
   45   1HB   LYS   5          1HB       LYS   5   9.094  -3.290  -0.175
   46   2HB   LYS   5          2HB       LYS   5  10.204  -3.535  -1.517
   47   1HG   LYS   5          1HG       LYS   5  10.954  -2.840   1.317
   48   2HG   LYS   5          2HG       LYS   5  11.108  -4.420   0.540
   49   1HD   LYS   5          1HD       LYS   5  12.756  -3.592  -0.984
   50   2HD   LYS   5          2HD       LYS   5  12.502  -1.932  -0.448
   51   1HE   LYS   5          1HE       LYS   5  13.330  -2.569   1.799
   52   2HE   LYS   5          2HE       LYS   5  13.655  -4.192   1.183
   53   1HZ   LYS   5          1HZ       LYS   5  14.826  -1.768  -0.060
   54   2HZ   LYS   5          2HZ       LYS   5  15.328  -3.385  -0.225
   55   3HZ   LYS   5          3HZ       LYS   5  15.579  -2.565   1.242
   56    H    TYR   6           H        TYR   6   8.646  -2.921  -2.580
   57    HA   TYR   6           HA       TYR   6   9.774  -1.613  -4.940
   58   1HB   TYR   6          1HB       TYR   6   8.147  -4.162  -4.868
   59   2HB   TYR   6          2HB       TYR   6   9.156  -3.567  -6.187
   60    HD1  TYR   6           HD1      TYR   6   9.266  -4.986  -2.757
   61    HD2  TYR   6           HD2      TYR   6  11.507  -3.993  -6.237
   62    HE1  TYR   6           HE1      TYR   6  11.188  -6.209  -1.860
   63    HE2  TYR   6           HE2      TYR   6  13.430  -5.222  -5.348
   64    HH   TYR   6           HH       TYR   6  13.537  -6.381  -2.094
   65    H    GLY   7           H        GLY   7   8.411  -1.247  -6.811
   66   1HA   GLY   7          1HA       GLY   7   6.054  -1.080  -7.596
   67   2HA   GLY   7          2HA       GLY   7   5.703  -0.320  -6.055
   68    H    ASN   8           H        ASN   8   5.006   1.612  -7.096
   69    HA   ASN   8           HA       ASN   8   7.208   3.040  -8.402
   70   1HB   ASN   8          1HB       ASN   8   5.628   4.389  -9.633
   71   2HB   ASN   8          2HB       ASN   8   5.250   2.689  -9.872
   72   1HD2  ASN   8          1HD2      ASN   8   3.606   5.122 -10.143
   73   2HD2  ASN   8          2HD2      ASN   8   2.227   4.860  -9.134
   74    H    ALA   9           H        ALA   9   6.251   2.819  -5.498
   75    HA   ALA   9           HA       ALA   9   5.997   5.663  -4.844
   76   1HB   ALA   9          1HB       ALA   9   5.816   3.485  -2.820
   77   2HB   ALA   9          2HB       ALA   9   4.458   3.746  -3.928
   78   3HB   ALA   9          3HB       ALA   9   4.987   5.053  -2.863
   79    H    ASP  10           H        ASP  10   8.309   3.434  -5.316
   80    HA   ASP  10           HA       ASP  10  10.488   3.204  -4.766
   81   1HB   ASP  10          1HB       ASP  10  10.047   5.895  -3.454
   82   2HB   ASP  10          2HB       ASP  10  11.615   5.091  -3.513
   83    H    GLY  11           H        GLY  11  11.026   4.672  -1.906
   84   1HA   GLY  11          1HA       GLY  11   9.982   2.415  -0.357
   85   2HA   GLY  11          2HA       GLY  11  11.662   2.896  -0.209
   86    H    GLU  12           H        GLU  12   8.634   4.765  -0.343
   87    HA   GLU  12           HA       GLU  12   9.563   6.455   1.802
   88   1HB   GLU  12          1HB       GLU  12   6.901   6.471   0.377
   89   2HB   GLU  12          2HB       GLU  12   7.556   7.758   1.372
   90   1HG   GLU  12          1HG       GLU  12   8.665   6.809  -1.259
   91   2HG   GLU  12          2HG       GLU  12   7.750   8.287  -0.982
   92    H    TYR  13           H        TYR  13   7.066   7.094   2.970
   93    HA   TYR  13           HA       TYR  13   6.812   4.929   4.870
   94   1HB   TYR  13          1HB       TYR  13   6.190   7.813   4.793
   95   2HB   TYR  13          2HB       TYR  13   5.051   6.828   5.706
   96    HD1  TYR  13           HD1      TYR  13   6.426   4.968   7.189
   97    HD2  TYR  13           HD2      TYR  13   7.763   8.836   6.059
   98    HE1  TYR  13           HE1      TYR  13   7.926   5.000   9.112
   99    HE2  TYR  13           HE2      TYR  13   9.278   8.882   7.974
  100    HH   TYR  13           HH       TYR  13   9.086   6.612  10.525
  101    H    CYS  14           H        CYS  14   4.767   4.021   5.468
  102    HA   CYS  14           HA       CYS  14   2.898   3.796   3.263
  103   1HB   CYS  14          1HB       CYS  14   3.143   2.384   5.917
  104   2HB   CYS  14          2HB       CYS  14   1.753   2.157   4.864
  105    H    LYS  15           H        LYS  15   1.082   4.985   3.155
  106    HA   LYS  15           HA       LYS  15   0.512   6.798   5.331
  107   1HB   LYS  15          1HB       LYS  15   0.319   7.048   2.627
  108   2HB   LYS  15          2HB       LYS  15  -1.354   6.709   3.049
  109   1HG   LYS  15          1HG       LYS  15   0.311   8.907   4.259
  110   2HG   LYS  15          2HG       LYS  15  -0.836   9.119   2.936
  111   1HD   LYS  15          1HD       LYS  15  -2.670   8.448   4.355
  112   2HD   LYS  15          2HD       LYS  15  -1.554   8.072   5.676
  113   1HE   LYS  15          1HE       LYS  15  -0.912  10.401   5.843
  114   2HE   LYS  15          2HE       LYS  15  -1.925  10.812   4.457
  115   1HZ   LYS  15          1HZ       LYS  15  -3.257  11.381   6.216
  116   2HZ   LYS  15          2HZ       LYS  15  -2.721  10.112   7.207
  117   3HZ   LYS  15          3HZ       LYS  15  -3.796   9.796   5.921
  118    H    PHE  16           H        PHE  16  -0.726   6.269   6.958
  119    HA   PHE  16           HA       PHE  16  -3.020   4.476   6.485
  120   1HB   PHE  16          1HB       PHE  16  -1.340   4.715   8.989
  121   2HB   PHE  16          2HB       PHE  16  -2.765   3.699   8.808
  122    HD1  PHE  16           HD1      PHE  16  -2.508   2.260   6.432
  123    HD2  PHE  16           HD2      PHE  16   0.583   3.528   9.056
  124    HE1  PHE  16           HE1      PHE  16  -1.103   0.403   5.659
  125    HE2  PHE  16           HE2      PHE  16   2.002   1.688   8.293
  126    HZ   PHE  16           HZ       PHE  16   1.180   0.098   6.585
  127    HA   PRO  17           HA       PRO  17  -4.712   4.082   6.803
  128   1HB   PRO  17          1HB       PRO  17  -7.367   4.683   6.631
  129   2HB   PRO  17          2HB       PRO  17  -6.604   4.011   8.075
  130   1HG   PRO  17          1HG       PRO  17  -7.712   6.672   7.681
  131   2HG   PRO  17          2HG       PRO  17  -7.145   5.917   9.178
  132   1HD   PRO  17          1HD       PRO  17  -5.773   7.814   7.420
  133   2HD   PRO  17          2HD       PRO  17  -5.372   7.327   9.080
  134    H    PHE  18           H        PHE  18  -4.751   3.681   4.617
  135    HA   PHE  18           HA       PHE  18  -5.187   5.987   2.882
  136   1HB   PHE  18          1HB       PHE  18  -4.080   4.748   1.130
  137   2HB   PHE  18          2HB       PHE  18  -3.107   4.672   2.589
  138    HD1  PHE  18           HD1      PHE  18  -5.370   2.747   0.401
  139    HD2  PHE  18           HD2      PHE  18  -2.566   2.612   3.598
  140    HE1  PHE  18           HE1      PHE  18  -5.263   0.310   0.182
  141    HE2  PHE  18           HE2      PHE  18  -2.455   0.161   3.393
  142    HZ   PHE  18           HZ       PHE  18  -3.794  -1.010   1.685
  143    H    LEU  19           H        LEU  19  -6.580   5.875   1.040
  144    HA   LEU  19           HA       LEU  19  -8.991   4.370   1.632
  145   1HB   LEU  19          1HB       LEU  19  -9.000   6.804   1.108
  146   2HB   LEU  19          2HB       LEU  19  -8.474   6.413  -0.518
  147    HG   LEU  19           HG       LEU  19 -10.578   5.048  -0.764
  148   1HD1  LEU  19          1HD1      LEU  19 -12.166   6.404   1.124
  149   2HD1  LEU  19          2HD1      LEU  19 -10.794   5.716   1.998
  150   3HD1  LEU  19          3HD1      LEU  19 -11.833   4.675   1.018
  151   1HD2  LEU  19          1HD2      LEU  19 -11.987   7.001  -1.180
  152   2HD2  LEU  19          2HD2      LEU  19 -10.341   7.270  -1.753
  153   3HD2  LEU  19          3HD2      LEU  19 -10.882   8.004  -0.242
  154    H    PHE  20           H        PHE  20  -9.380   2.462   0.761
  155    HA   PHE  20           HA       PHE  20  -8.556   1.984  -2.030
  156   1HB   PHE  20          1HB       PHE  20  -7.238   0.652  -0.218
  157   2HB   PHE  20          2HB       PHE  20  -8.761  -0.202   0.006
  158    HD1  PHE  20           HD1      PHE  20  -6.907   0.896  -3.054
  159    HD2  PHE  20           HD2      PHE  20  -8.736  -2.240  -0.841
  160    HE1  PHE  20           HE1      PHE  20  -6.391  -0.706  -4.863
  161    HE2  PHE  20           HE2      PHE  20  -8.227  -3.838  -2.635
  162    HZ   PHE  20           HZ       PHE  20  -7.055  -3.062  -4.664
  163    H    ASN  21           H        ASN  21 -10.468   2.185  -3.053
  164    HA   ASN  21           HA       ASN  21 -12.632   1.856  -3.679
  165   1HB   ASN  21          1HB       ASN  21 -11.975  -0.789  -2.401
  166   2HB   ASN  21          2HB       ASN  21 -13.540  -0.484  -3.146
  167   1HD2  ASN  21          1HD2      ASN  21 -13.642  -1.324  -5.083
  168   2HD2  ASN  21          2HD2      ASN  21 -12.372  -1.364  -6.253
  169    H    GLY  22           H        GLY  22 -12.235   3.186  -1.114
  170   1HA   GLY  22          1HA       GLY  22 -13.951   4.176   0.164
  171   2HA   GLY  22          2HA       GLY  22 -14.948   2.764  -0.113
  172    H    LYS  23           H        LYS  23 -11.963   1.625   0.770
  173    HA   LYS  23           HA       LYS  23 -12.767   1.600   3.603
  174   1HB   LYS  23          1HB       LYS  23 -12.983  -0.617   2.483
  175   2HB   LYS  23          2HB       LYS  23 -11.263  -0.568   2.117
  176   1HG   LYS  23          1HG       LYS  23 -10.766  -0.500   4.528
  177   2HG   LYS  23          2HG       LYS  23 -12.492  -0.616   4.874
  178   1HD   LYS  23          1HD       LYS  23 -12.579  -2.782   3.756
  179   2HD   LYS  23          2HD       LYS  23 -10.862  -2.659   3.368
  180   1HE   LYS  23          1HE       LYS  23 -10.328  -2.625   5.770
  181   2HE   LYS  23          2HE       LYS  23 -12.046  -2.763   6.149
  182   1HZ   LYS  23          1HZ       LYS  23 -10.242  -4.793   4.972
  183   2HZ   LYS  23          2HZ       LYS  23 -11.920  -4.886   4.722
  184   3HZ   LYS  23          3HZ       LYS  23 -11.291  -4.938   6.297
  185    H    GLU  24           H        GLU  24 -11.376   2.484   4.980
  186    HA   GLU  24           HA       GLU  24  -8.731   3.216   3.997
  187   1HB   GLU  24          1HB       GLU  24 -10.166   3.976   6.542
  188   2HB   GLU  24          2HB       GLU  24  -8.610   4.607   6.034
  189   1HG   GLU  24          1HG       GLU  24  -9.702   5.562   4.038
  190   2HG   GLU  24          2HG       GLU  24 -11.256   5.002   4.659
  191    H    TYR  25           H        TYR  25  -7.122   1.873   4.312
  192    HA   TYR  25           HA       TYR  25  -7.263  -0.150   6.384
  193   1HB   TYR  25          1HB       TYR  25  -5.293   0.345   4.173
  194   2HB   TYR  25          2HB       TYR  25  -5.122  -0.961   5.335
  195    HD1  TYR  25           HD1      TYR  25  -7.015  -2.660   5.499
  196    HD2  TYR  25           HD2      TYR  25  -6.615   0.107   2.302
  197    HE1  TYR  25           HE1      TYR  25  -8.526  -4.036   4.111
  198    HE2  TYR  25           HE2      TYR  25  -8.120  -1.255   0.903
  199    HH   TYR  25           HH       TYR  25  -8.823  -4.362   1.489
  200    H    ASN  26           H        ASN  26  -6.197  -0.202   8.202
  201    HA   ASN  26           HA       ASN  26  -4.492   2.084   8.871
  202   1HB   ASN  26          1HB       ASN  26  -5.595  -0.125  10.645
  203   2HB   ASN  26          2HB       ASN  26  -4.632   1.233  11.206
  204   1HD2  ASN  26          1HD2      ASN  26  -6.706   2.151   8.720
  205   2HD2  ASN  26          2HD2      ASN  26  -7.975   2.811   9.688
  206    H    SER  27           H        SER  27  -4.243  -0.962   7.656
  207    HA   SER  27           HA       SER  27  -1.400  -1.105   8.242
  208   1HB   SER  27          1HB       SER  27  -1.696  -3.616   8.671
  209   2HB   SER  27          2HB       SER  27  -2.187  -2.528   9.969
  210    HG   SER  27           HG       SER  27  -3.748  -4.131   8.284
  211    H    CYS  28           H        CYS  28  -0.395  -2.912   6.879
  212    HA   CYS  28           HA       CYS  28  -1.119  -2.490   4.166
  213   1HB   CYS  28          1HB       CYS  28   0.719  -4.591   5.337
  214   2HB   CYS  28          2HB       CYS  28   0.639  -4.121   3.642
  215    H    THR  29           H        THR  29  -2.160  -3.814   2.704
  216    HA   THR  29           HA       THR  29  -3.325  -6.287   3.748
  217    HB   THR  29           HB       THR  29  -5.005  -4.474   3.819
  218    HG1  THR  29           HG1      THR  29  -5.965  -6.373   3.475
  219   1HG2  THR  29          1HG2      THR  29  -5.009  -2.911   2.238
  220   2HG2  THR  29          2HG2      THR  29  -5.817  -4.101   1.215
  221   3HG2  THR  29          3HG2      THR  29  -4.066  -3.914   1.131
  222    H    ASP  30           H        ASP  30  -4.156  -7.713   1.956
  223    HA   ASP  30           HA       ASP  30  -2.336  -7.560  -0.334
  224   1HB   ASP  30          1HB       ASP  30  -3.766 -10.039  -0.090
  225   2HB   ASP  30          2HB       ASP  30  -2.063  -9.777  -0.300
  226    H    THR  31           H        THR  31  -5.244  -6.601   0.420
  227    HA   THR  31           HA       THR  31  -7.026  -7.742  -1.414
  228    HB   THR  31           HB       THR  31  -7.021  -4.886  -0.450
  229    HG1  THR  31           HG1      THR  31  -6.894  -6.182   1.363
  230   1HG2  THR  31          1HG2      THR  31  -9.569  -6.236  -0.573
  231   2HG2  THR  31          2HG2      THR  31  -8.783  -6.128  -2.149
  232   3HG2  THR  31          3HG2      THR  31  -9.085  -4.667  -1.208
  233    H    GLY  32           H        GLY  32  -7.381  -7.412  -3.540
  234   1HA   GLY  32          1HA       GLY  32  -7.327  -6.251  -5.575
  235   2HA   GLY  32          2HA       GLY  32  -6.163  -5.136  -4.880
  236    H    ARG  33           H        ARG  33  -4.580  -7.366  -3.792
  237    HA   ARG  33           HA       ARG  33  -2.987  -7.885  -6.166
  238   1HB   ARG  33          1HB       ARG  33  -2.461  -8.581  -3.270
  239   2HB   ARG  33          2HB       ARG  33  -1.300  -8.685  -4.585
  240   1HG   ARG  33          1HG       ARG  33  -2.553  -6.177  -3.484
  241   2HG   ARG  33          2HG       ARG  33  -0.885  -6.704  -3.261
  242   1HD   ARG  33          1HD       ARG  33  -2.190  -5.952  -5.876
  243   2HD   ARG  33          2HD       ARG  33  -1.060  -4.950  -4.965
  244    HE   ARG  33           HE       ARG  33  -0.021  -7.554  -5.674
  245   1HH1  ARG  33          1HH1      ARG  33  -0.328  -4.181  -6.584
  246   2HH1  ARG  33          2HH1      ARG  33   0.862  -4.292  -7.850
  247   1HH2  ARG  33          1HH2      ARG  33   1.547  -7.683  -7.345
  248   2HH2  ARG  33          2HH2      ARG  33   1.932  -6.257  -8.264
  249    H    SER  34           H        SER  34  -2.870  -9.797  -7.171
  250    HA   SER  34           HA       SER  34  -4.622 -11.924  -6.296
  251   1HB   SER  34          1HB       SER  34  -2.782 -11.902  -8.692
  252   2HB   SER  34          2HB       SER  34  -4.213 -12.900  -8.446
  253    HG   SER  34           HG       SER  34  -4.391 -10.904  -9.820
  254    H    ASP  35           H        ASP  35  -1.313 -11.155  -5.885
  255    HA   ASP  35           HA       ASP  35  -0.608 -13.931  -5.456
  256   1HB   ASP  35          1HB       ASP  35   1.004 -11.492  -5.870
  257   2HB   ASP  35          2HB       ASP  35   1.727 -12.959  -5.274
  258    H    GLY  36           H        GLY  36  -2.014 -11.814  -3.628
  259   1HA   GLY  36          1HA       GLY  36  -2.193 -11.518  -1.355
  260   2HA   GLY  36          2HA       GLY  36  -1.277 -13.006  -1.203
  261    H    PHE  37           H        PHE  37  -0.212  -9.912  -2.617
  262    HA   PHE  37           HA       PHE  37   2.063  -9.974  -0.775
  263   1HB   PHE  37          1HB       PHE  37   1.477  -8.394  -3.269
  264   2HB   PHE  37          2HB       PHE  37   2.821  -7.993  -2.217
  265    HD1  PHE  37           HD1      PHE  37   3.729  -8.354  -4.716
  266    HD2  PHE  37           HD2      PHE  37   2.539 -11.436  -2.035
  267    HE1  PHE  37           HE1      PHE  37   5.129  -9.961  -5.944
  268    HE2  PHE  37           HE2      PHE  37   3.939 -13.042  -3.255
  269    HZ   PHE  37           HZ       PHE  37   5.234 -12.309  -5.214
  270    H    LEU  38           H        LEU  38   2.421  -8.443   0.774
  271    HA   LEU  38           HA       LEU  38   0.186  -6.810   1.566
  272   1HB   LEU  38          1HB       LEU  38   2.943  -7.206   2.666
  273   2HB   LEU  38          2HB       LEU  38   1.835  -6.047   3.353
  274    HG   LEU  38           HG       LEU  38   1.258  -9.001   3.146
  275   1HD1  LEU  38          1HD1      LEU  38   3.036  -8.926   4.648
  276   2HD1  LEU  38          2HD1      LEU  38   1.615  -8.826   5.689
  277   3HD1  LEU  38          3HD1      LEU  38   2.540  -7.371   5.311
  278   1HD2  LEU  38          1HD2      LEU  38  -0.782  -7.875   3.320
  279   2HD2  LEU  38          2HD2      LEU  38  -0.127  -6.669   4.428
  280   3HD2  LEU  38          3HD2      LEU  38  -0.389  -8.320   4.981
  281    H    TRP  39           H        TRP  39  -0.165  -4.770   0.911
  282    HA   TRP  39           HA       TRP  39   2.167  -3.171   0.156
  283   1HB   TRP  39          1HB       TRP  39   1.061  -2.271  -1.813
  284   2HB   TRP  39          2HB       TRP  39   1.158  -4.021  -1.931
  285    HD1  TRP  39           HD1      TRP  39  -1.191  -5.389  -1.561
  286    HE1  TRP  39           HE1      TRP  39  -3.606  -4.683  -2.049
  287    HE3  TRP  39           HE3      TRP  39  -0.544  -0.323  -1.808
  288    HZ2  TRP  39           HZ2      TRP  39  -5.050  -2.298  -2.478
  289    HZ3  TRP  39           HZ3      TRP  39  -2.501   1.102  -2.271
  290    HH2  TRP  39           HH2      TRP  39  -4.706   0.113  -2.592
  291    H    CYS  40           H        CYS  40   1.558  -0.835  -0.145
  292    HA   CYS  40           HA       CYS  40  -0.709   0.062   1.426
  293   1HB   CYS  40          1HB       CYS  40   0.616   1.377   2.978
  294   2HB   CYS  40          2HB       CYS  40   1.129  -0.306   3.085
  295    H    SER  41           H        SER  41  -1.209   2.266   0.969
  296    HA   SER  41           HA       SER  41  -0.024   3.170  -1.530
  297   1HB   SER  41          1HB       SER  41  -2.356   4.362  -0.010
  298   2HB   SER  41          2HB       SER  41  -1.912   4.662  -1.691
  299    HG   SER  41           HG       SER  41  -3.117   2.413  -0.529
  300    H    THR  42           H        THR  42   0.951   5.236  -1.774
  301    HA   THR  42           HA       THR  42   2.155   6.276   0.654
  302    HB   THR  42           HB       THR  42   2.639   7.655  -1.907
  303    HG1  THR  42           HG1      THR  42   3.518   4.986  -1.570
  304   1HG2  THR  42          1HG2      THR  42   4.344   8.223  -0.567
  305   2HG2  THR  42          2HG2      THR  42   5.029   6.702  -1.132
  306   3HG2  THR  42          3HG2      THR  42   4.197   6.771   0.421
  307    H    THR  43           H        THR  43  -0.388   6.967  -1.517
  308    HA   THR  43           HA       THR  43  -0.741   9.668  -0.420
  309    HB   THR  43           HB       THR  43  -2.256   9.967  -2.409
  310    HG1  THR  43           HG1      THR  43  -2.671   8.331  -3.654
  311   1HG2  THR  43          1HG2      THR  43   0.360  10.334  -2.362
  312   2HG2  THR  43          2HG2      THR  43  -0.592  10.547  -3.832
  313   3HG2  THR  43          3HG2      THR  43   0.304   9.051  -3.571
  314    H    TYR  44           H        TYR  44  -3.180  10.260  -0.360
  315    HA   TYR  44           HA       TYR  44  -4.479   8.367   1.392
  316   1HB   TYR  44          1HB       TYR  44  -4.599  10.828   1.766
  317   2HB   TYR  44          2HB       TYR  44  -5.466  11.001   0.244
  318    HD1  TYR  44           HD1      TYR  44  -7.079  12.254   1.813
  319    HD2  TYR  44           HD2      TYR  44  -6.468   8.046   2.037
  320    HE1  TYR  44           HE1      TYR  44  -9.216  12.013   3.001
  321    HE2  TYR  44           HE2      TYR  44  -8.607   7.797   3.226
  322    HH   TYR  44           HH       TYR  44 -10.277   8.912   4.314
  323    H    ASN  45           H        ASN  45  -5.102   9.830  -1.766
  324    HA   ASN  45           HA       ASN  45  -7.214   7.901  -2.304
  325   1HB   ASN  45          1HB       ASN  45  -7.400  10.382  -2.860
  326   2HB   ASN  45          2HB       ASN  45  -6.209  10.113  -4.107
  327   1HD2  ASN  45          1HD2      ASN  45  -7.650   7.366  -4.482
  328   2HD2  ASN  45          2HD2      ASN  45  -8.969   7.871  -5.423
  329    H    PHE  46           H        PHE  46  -6.426   5.951  -2.937
  330    HA   PHE  46           HA       PHE  46  -3.942   5.739  -4.391
  331   1HB   PHE  46          1HB       PHE  46  -4.437   4.053  -2.726
  332   2HB   PHE  46          2HB       PHE  46  -5.960   3.643  -3.546
  333    HD1  PHE  46           HD1      PHE  46  -2.300   3.932  -4.407
  334    HD2  PHE  46           HD2      PHE  46  -5.909   1.699  -4.786
  335    HE1  PHE  46           HE1      PHE  46  -1.122   2.243  -5.746
  336    HE2  PHE  46           HE2      PHE  46  -4.735   0.014  -6.121
  337    HZ   PHE  46           HZ       PHE  46  -2.333   0.281  -6.604
  338    H    GLU  47           H        GLU  47  -7.346   5.588  -5.088
  339    HA   GLU  47           HA       GLU  47  -7.315   4.358  -7.589
  340   1HB   GLU  47          1HB       GLU  47  -9.351   4.837  -6.286
  341   2HB   GLU  47          2HB       GLU  47  -9.150   6.547  -6.606
  342   1HG   GLU  47          1HG       GLU  47  -9.410   6.100  -9.011
  343   2HG   GLU  47          2HG       GLU  47  -9.708   4.402  -8.634
  344    H    LYS  48           H        LYS  48  -7.248   7.827  -6.834
  345    HA   LYS  48           HA       LYS  48  -6.900   8.558  -9.561
  346   1HB   LYS  48          1HB       LYS  48  -8.051  10.170  -8.339
  347   2HB   LYS  48          2HB       LYS  48  -6.969  10.052  -6.964
  348   1HG   LYS  48          1HG       LYS  48  -5.234  11.254  -8.229
  349   2HG   LYS  48          2HG       LYS  48  -6.340  11.413  -9.596
  350   1HD   LYS  48          1HD       LYS  48  -6.320  13.453  -8.288
  351   2HD   LYS  48          2HD       LYS  48  -7.897  12.668  -8.159
  352   1HE   LYS  48          1HE       LYS  48  -7.297  11.761  -5.990
  353   2HE   LYS  48          2HE       LYS  48  -5.678  12.451  -6.120
  354   1HZ   LYS  48          1HZ       LYS  48  -7.058  14.648  -6.441
  355   2HZ   LYS  48          2HZ       LYS  48  -6.699  14.044  -4.891
  356   3HZ   LYS  48          3HZ       LYS  48  -8.233  13.780  -5.566
  357    H    ASP  49           H        ASP  49  -4.678   8.630  -6.748
  358    HA   ASP  49           HA       ASP  49  -2.517   9.632  -8.307
  359   1HB   ASP  49          1HB       ASP  49  -2.639   8.437  -5.545
  360   2HB   ASP  49          2HB       ASP  49  -1.145   9.040  -6.263
  361    H    GLY  50           H        GLY  50  -3.074   6.448  -6.833
  362   1HA   GLY  50          1HA       GLY  50  -2.594   4.359  -7.717
  363   2HA   GLY  50          2HA       GLY  50  -1.923   5.155  -9.127
  364    H    LYS  51           H        LYS  51  -0.597   6.240  -6.139
  365    HA   LYS  51           HA       LYS  51   1.884   4.884  -6.823
  366   1HB   LYS  51          1HB       LYS  51   1.274   6.995  -4.753
  367   2HB   LYS  51          2HB       LYS  51   2.852   6.252  -4.930
  368   1HG   LYS  51          1HG       LYS  51   3.133   8.155  -6.142
  369   2HG   LYS  51          2HG       LYS  51   2.588   7.057  -7.411
  370   1HD   LYS  51          1HD       LYS  51   0.262   7.908  -7.021
  371   2HD   LYS  51          2HD       LYS  51   0.953   9.116  -5.937
  372   1HE   LYS  51          1HE       LYS  51   0.616  10.115  -8.084
  373   2HE   LYS  51          2HE       LYS  51   2.349   9.931  -7.813
  374   1HZ   LYS  51          1HZ       LYS  51   1.119   9.178 -10.050
  375   2HZ   LYS  51          2HZ       LYS  51   1.040   7.722  -9.191
  376   3HZ   LYS  51          3HZ       LYS  51   2.546   8.449  -9.486
  377    H    TYR  52           H        TYR  52   2.354   2.965  -6.016
  378    HA   TYR  52           HA       TYR  52   1.478   2.327  -3.288
  379   1HB   TYR  52          1HB       TYR  52   0.736   0.135  -3.952
  380   2HB   TYR  52          2HB       TYR  52  -0.068   1.309  -4.989
  381    HD1  TYR  52           HD1      TYR  52   2.629  -1.231  -4.860
  382    HD2  TYR  52           HD2      TYR  52   0.289   1.310  -7.351
  383    HE1  TYR  52           HE1      TYR  52   3.491  -2.398  -6.839
  384    HE2  TYR  52           HE2      TYR  52   1.140   0.141  -9.336
  385    HH   TYR  52           HH       TYR  52   2.149  -1.895  -9.997
  386    H    GLY  53           H        GLY  53   2.578   0.390  -2.442
  387   1HA   GLY  53          1HA       GLY  53   5.014  -0.492  -3.660
  388   2HA   GLY  53          2HA       GLY  53   5.280   0.574  -2.287
  389    H    PHE  54           H        PHE  54   6.028  -2.175  -2.435
  390    HA   PHE  54           HA       PHE  54   4.061  -3.582  -0.851
  391   1HB   PHE  54          1HB       PHE  54   6.757  -4.461  -1.856
  392   2HB   PHE  54          2HB       PHE  54   5.609  -5.497  -1.016
  393    HD1  PHE  54           HD1      PHE  54   3.100  -5.186  -2.119
  394    HD2  PHE  54           HD2      PHE  54   6.837  -4.813  -4.126
  395    HE1  PHE  54           HE1      PHE  54   1.992  -5.679  -4.259
  396    HE2  PHE  54           HE2      PHE  54   5.732  -5.305  -6.274
  397    HZ   PHE  54           HZ       PHE  54   3.314  -5.736  -6.343
  398    H    CYS  55           H        CYS  55   4.180  -4.112   1.229
  399    HA   CYS  55           HA       CYS  55   5.947  -2.571   2.900
  400   1HB   CYS  55          1HB       CYS  55   3.919  -4.671   3.702
  401   2HB   CYS  55          2HB       CYS  55   4.603  -3.412   4.730
  402    HA   PRO  56           HA       PRO  56   9.127  -5.459   3.859
  403   1HB   PRO  56          1HB       PRO  56   9.040  -5.702   6.589
  404   2HB   PRO  56          2HB       PRO  56   9.819  -4.384   5.715
  405   1HG   PRO  56          1HG       PRO  56   7.118  -4.470   6.996
  406   2HG   PRO  56          2HG       PRO  56   8.308  -3.155   6.979
  407   1HD   PRO  56          1HD       PRO  56   6.170  -3.110   5.375
  408   2HD   PRO  56          2HD       PRO  56   7.745  -2.506   4.818
  409    H    HIS  57           H        HIS  57   8.902  -7.482   3.217
  410    HA   HIS  57           HA       HIS  57   7.870  -9.448   5.038
  411   1HB   HIS  57          1HB       HIS  57   6.244 -10.471   3.557
  412   2HB   HIS  57          2HB       HIS  57   5.803  -8.793   3.829
  413    HD1  HIS  57           HD1      HIS  57   6.888  -7.179   1.712
  414    HD2  HIS  57           HD2      HIS  57   5.884 -11.155   0.995
  415    HE1  HIS  57           HE1      HIS  57   6.570  -7.361  -0.777
  416    H    GLU  58           H        GLU  58   7.687 -11.444   2.835
  417    HA   GLU  58           HA       GLU  58  10.523 -11.955   2.663
  418   1HB   GLU  58          1HB       GLU  58   9.826 -14.128   1.636
  419   2HB   GLU  58          2HB       GLU  58   9.190 -13.843   3.245
  420   1HG   GLU  58          1HG       GLU  58   7.043 -13.111   2.146
  421   2HG   GLU  58          2HG       GLU  58   7.727 -13.677   0.622
  422    H    ALA  59           H        ALA  59  10.592  -9.878   1.265
  423    HA   ALA  59           HA       ALA  59  10.583 -10.743  -1.545
  424   1HB   ALA  59          1HB       ALA  59  10.126  -7.885  -1.222
  425   2HB   ALA  59          2HB       ALA  59   8.824  -8.873  -0.556
  426   3HB   ALA  59          3HB       ALA  59   9.294  -9.059  -2.246
  Start of MODEL    6
    1   1H    ARG   1          1H        ARG   1   5.665   1.680  11.460
    2   2H    ARG   1          2H        ARG   1   6.084   0.308  10.517
    3   3H    ARG   1          3H        ARG   1   4.428   0.701  10.787
    4    HA   ARG   1           HA       ARG   1   4.621   1.546   8.760
    5   1HB   ARG   1          1HB       ARG   1   4.176   3.335  10.483
    6   2HB   ARG   1          2HB       ARG   1   5.881   3.754  10.406
    7   1HG   ARG   1          1HG       ARG   1   5.649   4.412   8.094
    8   2HG   ARG   1          2HG       ARG   1   3.960   3.885   8.087
    9   1HD   ARG   1          1HD       ARG   1   3.566   5.517   9.966
   10   2HD   ARG   1          2HD       ARG   1   5.183   6.145   9.658
   11    HE   ARG   1           HE       ARG   1   3.876   6.202   7.222
   12   1HH1  ARG   1          1HH1      ARG   1   3.460   7.610  10.395
   13   2HH1  ARG   1          2HH1      ARG   1   2.621   9.014   9.815
   14   1HH2  ARG   1          1HH2      ARG   1   2.779   8.059   6.429
   15   2HH2  ARG   1          2HH2      ARG   1   2.230   9.277   7.550
   16    H    ILE   2           H        ILE   2   6.137   0.370   7.554
   17    HA   ILE   2           HA       ILE   2   8.938   1.053   7.738
   18    HB   ILE   2           HB       ILE   2   9.221  -0.671   5.940
   19   1HG1  ILE   2          1HG1      ILE   2   6.269  -1.161   6.374
   20   2HG1  ILE   2          2HG1      ILE   2   6.958  -0.389   4.947
   21   1HG2  ILE   2          1HG2      ILE   2   8.710  -2.616   7.337
   22   2HG2  ILE   2          2HG2      ILE   2   7.685  -1.625   8.370
   23   3HG2  ILE   2          3HG2      ILE   2   9.423  -1.319   8.297
   24   1HD1  ILE   2          1HD1      ILE   2   8.274  -2.468   4.568
   25   2HD1  ILE   2          2HD1      ILE   2   6.522  -2.671   4.436
   26   3HD1  ILE   2          3HD1      ILE   2   7.370  -3.213   5.886
   27    HA   PRO   3           HA       PRO   3   9.459   3.765   4.335
   28   1HB   PRO   3          1HB       PRO   3  11.639   2.766   3.094
   29   2HB   PRO   3          2HB       PRO   3  11.713   3.545   4.682
   30   1HG   PRO   3          1HG       PRO   3  11.528   0.616   4.027
   31   2HG   PRO   3          2HG       PRO   3  12.665   1.435   5.118
   32   1HD   PRO   3          1HD       PRO   3  10.515   0.212   6.085
   33   2HD   PRO   3          2HD       PRO   3  11.031   1.778   6.755
   34    H    VAL   4           H        VAL   4   8.269   0.710   3.691
   35    HA   VAL   4           HA       VAL   4   7.116  -0.135   1.885
   36    HB   VAL   4           HB       VAL   4   7.909   2.490   0.562
   37   1HG1  VAL   4          1HG1      VAL   4   7.610   0.707  -1.106
   38   2HG1  VAL   4          2HG1      VAL   4   6.358   1.945  -1.210
   39   3HG1  VAL   4          3HG1      VAL   4   6.003   0.388  -0.458
   40   1HG2  VAL   4          1HG2      VAL   4   5.119   1.688   1.247
   41   2HG2  VAL   4          2HG2      VAL   4   5.850   3.295   1.156
   42   3HG2  VAL   4          3HG2      VAL   4   6.188   2.245   2.535
   43    H    LYS   5           H        LYS   5   7.548  -1.447   0.128
   44    HA   LYS   5           HA       LYS   5  10.408  -1.793  -0.396
   45   1HB   LYS   5          1HB       LYS   5   8.044  -3.614  -0.345
   46   2HB   LYS   5          2HB       LYS   5   9.399  -4.037  -1.374
   47   1HG   LYS   5          1HG       LYS   5   9.543  -3.582   1.599
   48   2HG   LYS   5          2HG       LYS   5   9.484  -5.158   0.784
   49   1HD   LYS   5          1HD       LYS   5  11.607  -4.756  -0.272
   50   2HD   LYS   5          2HD       LYS   5  11.656  -3.104   0.357
   51   1HE   LYS   5          1HE       LYS   5  11.785  -3.935   2.629
   52   2HE   LYS   5          2HE       LYS   5  11.631  -5.599   2.062
   53   1HZ   LYS   5          1HZ       LYS   5  13.727  -5.033   0.692
   54   2HZ   LYS   5          2HZ       LYS   5  13.894  -5.347   2.353
   55   3HZ   LYS   5          3HZ       LYS   5  13.911  -3.746   1.789
   56    H    TYR   6           H        TYR   6   8.947  -3.601  -2.585
   57    HA   TYR   6           HA       TYR   6   9.739  -2.026  -4.800
   58   1HB   TYR   6          1HB       TYR   6   7.995  -4.460  -5.067
   59   2HB   TYR   6          2HB       TYR   6   9.328  -3.917  -6.091
   60    HD1  TYR   6           HD1      TYR   6   8.462  -5.668  -2.970
   61    HD2  TYR   6           HD2      TYR   6  11.639  -4.413  -5.511
   62    HE1  TYR   6           HE1      TYR   6  10.005  -7.118  -1.745
   63    HE2  TYR   6           HE2      TYR   6  13.191  -5.870  -4.297
   64    HH   TYR   6           HH       TYR   6  12.641  -8.250  -2.711
   65    H    GLY   7           H        GLY   7   8.377  -1.562  -6.665
   66   1HA   GLY   7          1HA       GLY   7   5.962  -1.367  -7.360
   67   2HA   GLY   7          2HA       GLY   7   5.745  -0.495  -5.851
   68    H    ASN   8           H        ASN   8   5.100   1.390  -7.005
   69    HA   ASN   8           HA       ASN   8   7.253   2.625  -8.592
   70   1HB   ASN   8          1HB       ASN   8   5.627   3.904  -9.750
   71   2HB   ASN   8          2HB       ASN   8   5.001   2.265  -9.671
   72   1HD2  ASN   8          1HD2      ASN   8   3.667   4.879 -10.023
   73   2HD2  ASN   8          2HD2      ASN   8   2.479   4.947  -8.772
   74    H    ALA   9           H        ALA   9   6.684   2.588  -5.579
   75    HA   ALA   9           HA       ALA   9   6.439   5.402  -4.969
   76   1HB   ALA   9          1HB       ALA   9   7.127   3.556  -2.808
   77   2HB   ALA   9          2HB       ALA   9   5.622   3.193  -3.656
   78   3HB   ALA   9          3HB       ALA   9   5.853   4.772  -2.910
   79    H    ASP  10           H        ASP  10   8.083   6.632  -3.967
   80    HA   ASP  10           HA       ASP  10  10.737   5.807  -4.793
   81   1HB   ASP  10          1HB       ASP  10   9.584   8.409  -3.835
   82   2HB   ASP  10          2HB       ASP  10  11.320   8.188  -4.030
   83    H    GLY  11           H        GLY  11   8.994   5.738  -1.880
   84   1HA   GLY  11          1HA       GLY  11  10.492   4.367  -0.273
   85   2HA   GLY  11          2HA       GLY  11  11.487   5.810  -0.310
   86    H    GLU  12           H        GLU  12   8.335   6.842  -0.510
   87    HA   GLU  12           HA       GLU  12   8.347   7.935   2.098
   88   1HB   GLU  12          1HB       GLU  12   5.995   7.533   0.227
   89   2HB   GLU  12          2HB       GLU  12   5.994   8.555   1.649
   90   1HG   GLU  12          1HG       GLU  12   6.296  10.116   0.031
   91   2HG   GLU  12          2HG       GLU  12   7.971   9.745   0.401
   92    H    TYR  13           H        TYR  13   7.633   7.099   4.008
   93    HA   TYR  13           HA       TYR  13   7.078   4.408   4.296
   94   1HB   TYR  13          1HB       TYR  13   6.024   5.298   6.550
   95   2HB   TYR  13          2HB       TYR  13   7.755   5.187   6.281
   96    HD1  TYR  13           HD1      TYR  13   5.068   7.657   5.449
   97    HD2  TYR  13           HD2      TYR  13   8.908   6.942   7.128
   98    HE1  TYR  13           HE1      TYR  13   5.268  10.054   5.997
   99    HE2  TYR  13           HE2      TYR  13   9.124   9.339   7.681
  100    HH   TYR  13           HH       TYR  13   8.041  11.569   6.672
  101    H    CYS  14           H        CYS  14   5.162   3.257   4.868
  102    HA   CYS  14           HA       CYS  14   3.017   3.635   3.205
  103   1HB   CYS  14          1HB       CYS  14   3.045   2.273   5.898
  104   2HB   CYS  14          2HB       CYS  14   1.753   2.119   4.714
  105    H    LYS  15           H        LYS  15   1.219   4.815   3.172
  106    HA   LYS  15           HA       LYS  15   0.841   6.791   5.270
  107   1HB   LYS  15          1HB       LYS  15   0.833   7.256   2.731
  108   2HB   LYS  15          2HB       LYS  15  -0.769   6.537   2.728
  109   1HG   LYS  15          1HG       LYS  15  -0.052   8.867   4.489
  110   2HG   LYS  15          2HG       LYS  15  -0.621   9.064   2.829
  111   1HD   LYS  15          1HD       LYS  15  -2.653   7.735   3.466
  112   2HD   LYS  15          2HD       LYS  15  -2.098   7.812   5.144
  113   1HE   LYS  15          1HE       LYS  15  -2.769  10.156   3.365
  114   2HE   LYS  15          2HE       LYS  15  -3.728   9.558   4.723
  115   1HZ   LYS  15          1HZ       LYS  15  -1.032  10.807   4.848
  116   2HZ   LYS  15          2HZ       LYS  15  -1.805  10.077   6.181
  117   3HZ   LYS  15          3HZ       LYS  15  -2.489  11.442   5.447
  118    H    PHE  16           H        PHE  16  -0.385   6.192   6.952
  119    HA   PHE  16           HA       PHE  16  -2.771   4.552   6.401
  120   1HB   PHE  16          1HB       PHE  16  -1.163   4.676   8.963
  121   2HB   PHE  16          2HB       PHE  16  -2.610   3.711   8.705
  122    HD1  PHE  16           HD1      PHE  16  -2.260   2.340   6.255
  123    HD2  PHE  16           HD2      PHE  16   0.679   3.364   9.155
  124    HE1  PHE  16           HE1      PHE  16  -0.882   0.444   5.527
  125    HE2  PHE  16           HE2      PHE  16   2.066   1.478   8.438
  126    HZ   PHE  16           HZ       PHE  16   1.298  -0.020   6.613
  127    HA   PRO  17           HA       PRO  17  -4.513   4.163   6.839
  128   1HB   PRO  17          1HB       PRO  17  -7.129   4.849   6.570
  129   2HB   PRO  17          2HB       PRO  17  -6.435   4.245   8.079
  130   1HG   PRO  17          1HG       PRO  17  -7.353   6.949   7.417
  131   2HG   PRO  17          2HG       PRO  17  -7.032   6.235   9.003
  132   1HD   PRO  17          1HD       PRO  17  -5.359   8.003   7.442
  133   2HD   PRO  17          2HD       PRO  17  -5.087   7.379   9.081
  134    H    PHE  18           H        PHE  18  -4.786   3.586   4.702
  135    HA   PHE  18           HA       PHE  18  -4.976   5.824   2.816
  136   1HB   PHE  18          1HB       PHE  18  -3.924   4.441   1.146
  137   2HB   PHE  18          2HB       PHE  18  -2.962   4.389   2.611
  138    HD1  PHE  18           HD1      PHE  18  -5.469   2.466   0.657
  139    HD2  PHE  18           HD2      PHE  18  -2.370   2.362   3.576
  140    HE1  PHE  18           HE1      PHE  18  -5.465   0.019   0.556
  141    HE2  PHE  18           HE2      PHE  18  -2.364  -0.100   3.483
  142    HZ   PHE  18           HZ       PHE  18  -3.912  -1.293   1.973
  143    H    LEU  19           H        LEU  19  -6.370   5.703   1.014
  144    HA   LEU  19           HA       LEU  19  -8.819   4.274   1.668
  145   1HB   LEU  19          1HB       LEU  19  -8.743   6.729   1.138
  146   2HB   LEU  19          2HB       LEU  19  -8.351   6.292  -0.515
  147    HG   LEU  19           HG       LEU  19 -10.506   5.038  -0.638
  148   1HD1  LEU  19          1HD1      LEU  19 -11.593   6.475   1.684
  149   2HD1  LEU  19          2HD1      LEU  19 -10.512   5.134   2.054
  150   3HD1  LEU  19          3HD1      LEU  19 -11.951   4.859   1.074
  151   1HD2  LEU  19          1HD2      LEU  19 -10.357   7.243  -1.572
  152   2HD2  LEU  19          2HD2      LEU  19 -10.613   7.974   0.012
  153   3HD2  LEU  19          3HD2      LEU  19 -11.914   7.073  -0.770
  154    H    PHE  20           H        PHE  20  -9.485   2.522   0.689
  155    HA   PHE  20           HA       PHE  20  -8.681   1.936  -2.075
  156   1HB   PHE  20          1HB       PHE  20  -7.277   0.646  -0.237
  157   2HB   PHE  20          2HB       PHE  20  -8.775  -0.247  -0.044
  158    HD1  PHE  20           HD1      PHE  20  -7.149   0.964  -3.181
  159    HD2  PHE  20           HD2      PHE  20  -8.474  -2.287  -0.787
  160    HE1  PHE  20           HE1      PHE  20  -6.574  -0.617  -4.988
  161    HE2  PHE  20           HE2      PHE  20  -7.907  -3.874  -2.575
  162    HZ   PHE  20           HZ       PHE  20  -6.956  -3.033  -4.692
  163    H    ASN  21           H        ASN  21 -10.638   1.940  -3.064
  164    HA   ASN  21           HA       ASN  21 -12.823   1.538  -3.519
  165   1HB   ASN  21          1HB       ASN  21 -12.112  -0.925  -1.953
  166   2HB   ASN  21          2HB       ASN  21 -13.732  -0.687  -2.596
  167   1HD2  ASN  21          1HD2      ASN  21 -14.078  -1.559  -4.492
  168   2HD2  ASN  21          2HD2      ASN  21 -12.894  -1.859  -5.711
  169    H    GLY  22           H        GLY  22 -12.399   3.323  -1.411
  170   1HA   GLY  22          1HA       GLY  22 -13.825   4.496  -0.018
  171   2HA   GLY  22          2HA       GLY  22 -14.989   3.191  -0.157
  172    H    LYS  23           H        LYS  23 -12.080   1.849   0.769
  173    HA   LYS  23           HA       LYS  23 -12.847   2.038   3.604
  174   1HB   LYS  23          1HB       LYS  23 -13.178  -0.222   2.690
  175   2HB   LYS  23          2HB       LYS  23 -11.486  -0.272   2.202
  176   1HG   LYS  23          1HG       LYS  23 -10.829  -0.066   4.568
  177   2HG   LYS  23          2HG       LYS  23 -12.532  -0.109   5.024
  178   1HD   LYS  23          1HD       LYS  23 -12.747  -2.341   4.116
  179   2HD   LYS  23          2HD       LYS  23 -11.077  -2.292   3.538
  180   1HE   LYS  23          1HE       LYS  23 -10.315  -2.032   5.872
  181   2HE   LYS  23          2HE       LYS  23 -11.989  -2.181   6.410
  182   1HZ   LYS  23          1HZ       LYS  23 -11.574  -4.341   6.536
  183   2HZ   LYS  23          2HZ       LYS  23 -10.127  -4.224   5.668
  184   3HZ   LYS  23          3HZ       LYS  23 -11.607  -4.375   4.834
  185    H    GLU  24           H        GLU  24 -11.356   2.621   5.074
  186    HA   GLU  24           HA       GLU  24  -8.723   3.400   4.054
  187   1HB   GLU  24          1HB       GLU  24 -10.080   4.043   6.682
  188   2HB   GLU  24          2HB       GLU  24  -8.539   4.694   6.143
  189   1HG   GLU  24          1HG       GLU  24  -9.668   5.795   4.279
  190   2HG   GLU  24          2HG       GLU  24 -11.210   5.134   4.827
  191    H    TYR  25           H        TYR  25  -6.956   2.231   4.488
  192    HA   TYR  25           HA       TYR  25  -7.166   0.120   6.520
  193   1HB   TYR  25          1HB       TYR  25  -5.340   0.367   4.147
  194   2HB   TYR  25          2HB       TYR  25  -5.216  -0.916   5.334
  195    HD1  TYR  25           HD1      TYR  25  -7.605   0.619   2.942
  196    HD2  TYR  25           HD2      TYR  25  -6.390  -2.900   4.994
  197    HE1  TYR  25           HE1      TYR  25  -9.230  -0.685   1.625
  198    HE2  TYR  25           HE2      TYR  25  -8.016  -4.225   3.674
  199    HH   TYR  25           HH       TYR  25  -9.544  -4.196   2.066
  200    H    ASN  26           H        ASN  26  -5.873   0.055   8.223
  201    HA   ASN  26           HA       ASN  26  -3.815   2.147   8.461
  202   1HB   ASN  26          1HB       ASN  26  -5.371   0.624  10.551
  203   2HB   ASN  26          2HB       ASN  26  -3.953   1.592  10.936
  204   1HD2  ASN  26          1HD2      ASN  26  -7.256   1.618  10.622
  205   2HD2  ASN  26          2HD2      ASN  26  -7.500   3.326  10.536
  206    H    SER  27           H        SER  27  -3.967  -0.762   7.358
  207    HA   SER  27           HA       SER  27  -1.288  -1.465   8.222
  208   1HB   SER  27          1HB       SER  27  -2.006  -3.879   8.506
  209   2HB   SER  27          2HB       SER  27  -2.580  -2.781   9.772
  210    HG   SER  27           HG       SER  27  -4.589  -2.667   8.619
  211    H    CYS  28           H        CYS  28  -0.313  -3.060   6.738
  212    HA   CYS  28           HA       CYS  28  -1.116  -2.501   4.041
  213   1HB   CYS  28          1HB       CYS  28   1.026  -4.404   5.009
  214   2HB   CYS  28          2HB       CYS  28   0.865  -3.718   3.392
  215    H    THR  29           H        THR  29  -2.348  -3.671   2.736
  216    HA   THR  29           HA       THR  29  -3.209  -6.315   3.658
  217    HB   THR  29           HB       THR  29  -4.957  -4.593   3.818
  218    HG1  THR  29           HG1      THR  29  -5.657  -6.670   3.310
  219   1HG2  THR  29          1HG2      THR  29  -5.381  -3.074   2.262
  220   2HG2  THR  29          2HG2      THR  29  -5.558  -4.314   1.023
  221   3HG2  THR  29          3HG2      THR  29  -3.963  -3.653   1.382
  222    H    ASP  30           H        ASP  30  -4.047  -7.772   1.927
  223    HA   ASP  30           HA       ASP  30  -2.367  -7.556  -0.454
  224   1HB   ASP  30          1HB       ASP  30  -3.686 -10.085  -0.174
  225   2HB   ASP  30          2HB       ASP  30  -1.997  -9.755  -0.404
  226    H    THR  31           H        THR  31  -5.196  -6.556   0.349
  227    HA   THR  31           HA       THR  31  -7.117  -7.781  -1.282
  228    HB   THR  31           HB       THR  31  -6.974  -4.874  -0.468
  229    HG1  THR  31           HG1      THR  31  -6.834  -6.097   1.385
  230   1HG2  THR  31          1HG2      THR  31  -8.809  -4.878  -1.819
  231   2HG2  THR  31          2HG2      THR  31  -9.534  -5.324  -0.276
  232   3HG2  THR  31          3HG2      THR  31  -9.196  -6.568  -1.481
  233    H    GLY  32           H        GLY  32  -7.720  -7.514  -3.366
  234   1HA   GLY  32          1HA       GLY  32  -7.779  -6.591  -5.503
  235   2HA   GLY  32          2HA       GLY  32  -6.578  -5.413  -4.997
  236    H    ARG  33           H        ARG  33  -4.847  -7.497  -3.871
  237    HA   ARG  33           HA       ARG  33  -3.401  -8.140  -6.279
  238   1HB   ARG  33          1HB       ARG  33  -2.773  -8.973  -3.447
  239   2HB   ARG  33          2HB       ARG  33  -1.659  -8.897  -4.801
  240   1HG   ARG  33          1HG       ARG  33  -3.005  -6.540  -3.492
  241   2HG   ARG  33          2HG       ARG  33  -1.345  -7.056  -3.216
  242   1HD   ARG  33          1HD       ARG  33  -2.497  -6.130  -5.850
  243   2HD   ARG  33          2HD       ARG  33  -1.481  -5.163  -4.776
  244    HE   ARG  33           HE       ARG  33  -0.275  -7.652  -5.588
  245   1HH1  ARG  33          1HH1      ARG  33  -0.736  -4.273  -6.369
  246   2HH1  ARG  33          2HH1      ARG  33   0.574  -4.225  -7.506
  247   1HH2  ARG  33          1HH2      ARG  33   1.393  -7.610  -7.129
  248   2HH2  ARG  33          2HH2      ARG  33   1.782  -6.127  -7.946
  249    H    SER  34           H        SER  34  -2.962 -10.224  -7.048
  250    HA   SER  34           HA       SER  34  -4.876 -12.249  -6.127
  251   1HB   SER  34          1HB       SER  34  -3.271 -12.187  -8.693
  252   2HB   SER  34          2HB       SER  34  -4.578 -13.303  -8.292
  253    HG   SER  34           HG       SER  34  -5.052 -11.331  -9.636
  254    H    ASP  35           H        ASP  35  -1.587 -11.491  -5.886
  255    HA   ASP  35           HA       ASP  35  -0.860 -14.283  -5.515
  256   1HB   ASP  35          1HB       ASP  35   0.709 -11.883  -6.209
  257   2HB   ASP  35          2HB       ASP  35   1.494 -13.328  -5.628
  258    H    GLY  36           H        GLY  36  -2.155 -12.377  -3.533
  259   1HA   GLY  36          1HA       GLY  36  -2.061 -12.011  -1.275
  260   2HA   GLY  36          2HA       GLY  36  -0.967 -13.384  -1.219
  261    H    PHE  37           H        PHE  37  -0.520 -10.209  -2.739
  262    HA   PHE  37           HA       PHE  37   1.925  -9.894  -1.161
  263   1HB   PHE  37          1HB       PHE  37   1.020  -8.942  -3.826
  264   2HB   PHE  37          2HB       PHE  37   2.071  -7.863  -2.916
  265    HD1  PHE  37           HD1      PHE  37   4.177  -9.122  -1.850
  266    HD2  PHE  37           HD2      PHE  37   2.018 -10.386  -5.296
  267    HE1  PHE  37           HE1      PHE  37   6.152 -10.368  -2.626
  268    HE2  PHE  37           HE2      PHE  37   3.990 -11.638  -6.076
  269    HZ   PHE  37           HZ       PHE  37   6.061 -11.629  -4.741
  270    H    LEU  38           H        LEU  38   1.754  -8.679   0.619
  271    HA   LEU  38           HA       LEU  38  -0.479  -6.931   0.964
  272   1HB   LEU  38          1HB       LEU  38   0.830  -6.399   3.146
  273   2HB   LEU  38          2HB       LEU  38   0.010  -7.925   2.974
  274    HG   LEU  38           HG       LEU  38   2.983  -7.568   2.523
  275   1HD1  LEU  38          1HD1      LEU  38   2.779  -8.934   4.839
  276   2HD1  LEU  38          2HD1      LEU  38   1.388  -7.862   4.985
  277   3HD1  LEU  38          3HD1      LEU  38   3.002  -7.187   4.749
  278   1HD2  LEU  38          1HD2      LEU  38   1.150  -9.760   2.154
  279   2HD2  LEU  38          2HD2      LEU  38   2.336 -10.155   3.395
  280   3HD2  LEU  38          3HD2      LEU  38   2.869  -9.673   1.784
  281    H    TRP  39           H        TRP  39  -0.550  -4.812   0.724
  282    HA   TRP  39           HA       TRP  39   1.946  -3.374   0.160
  283   1HB   TRP  39          1HB       TRP  39   0.912  -2.297  -1.796
  284   2HB   TRP  39          2HB       TRP  39   0.965  -4.042  -1.994
  285    HD1  TRP  39           HD1      TRP  39  -1.404  -5.370  -1.761
  286    HE1  TRP  39           HE1      TRP  39  -3.802  -4.596  -2.216
  287    HE3  TRP  39           HE3      TRP  39  -0.664  -0.299  -1.726
  288    HZ2  TRP  39           HZ2      TRP  39  -5.194  -2.178  -2.530
  289    HZ3  TRP  39           HZ3      TRP  39  -2.599   1.172  -2.129
  290    HH2  TRP  39           HH2      TRP  39  -4.813   0.236  -2.520
  291    H    CYS  40           H        CYS  40   1.487  -0.983  -0.102
  292    HA   CYS  40           HA       CYS  40  -0.733   0.041   1.466
  293   1HB   CYS  40          1HB       CYS  40   0.704   1.311   2.982
  294   2HB   CYS  40          2HB       CYS  40   1.031  -0.411   3.138
  295    H    SER  41           H        SER  41  -1.196   2.207   0.907
  296    HA   SER  41           HA       SER  41   0.010   3.043  -1.582
  297   1HB   SER  41          1HB       SER  41  -2.142   4.467   0.001
  298   2HB   SER  41          2HB       SER  41  -1.774   4.650  -1.714
  299    HG   SER  41           HG       SER  41  -3.117   2.587  -0.380
  300    H    THR  42           H        THR  42   1.028   5.085  -1.941
  301    HA   THR  42           HA       THR  42   2.546   6.030   0.339
  302    HB   THR  42           HB       THR  42   2.507   7.060  -2.509
  303    HG1  THR  42           HG1      THR  42   3.815   4.885  -1.332
  304   1HG2  THR  42          1HG2      THR  42   3.734   8.200  -0.357
  305   2HG2  THR  42          2HG2      THR  42   4.231   8.388  -2.038
  306   3HG2  THR  42          3HG2      THR  42   5.012   7.179  -1.019
  307    H    THR  43           H        THR  43  -0.136   6.951  -1.635
  308    HA   THR  43           HA       THR  43  -0.399   9.516  -0.233
  309    HB   THR  43           HB       THR  43  -2.019  10.029  -2.087
  310    HG1  THR  43           HG1      THR  43  -2.499   8.551  -3.501
  311   1HG2  THR  43          1HG2      THR  43   0.012   9.553  -3.903
  312   2HG2  THR  43          2HG2      THR  43   0.837   9.765  -2.360
  313   3HG2  THR  43          3HG2      THR  43  -0.247  11.021  -2.959
  314    H    TYR  44           H        TYR  44  -3.048  10.000  -0.427
  315    HA   TYR  44           HA       TYR  44  -4.158   8.044   1.405
  316   1HB   TYR  44          1HB       TYR  44  -4.475  10.349   2.025
  317   2HB   TYR  44          2HB       TYR  44  -5.150  10.743   0.444
  318    HD1  TYR  44           HD1      TYR  44  -5.849   8.136   3.068
  319    HD2  TYR  44           HD2      TYR  44  -7.403  11.202   0.556
  320    HE1  TYR  44           HE1      TYR  44  -8.111   7.699   3.931
  321    HE2  TYR  44           HE2      TYR  44  -9.656  10.772   1.412
  322    HH   TYR  44           HH       TYR  44 -10.234   8.414   3.983
  323    H    ASN  45           H        ASN  45  -5.078   9.565  -1.677
  324    HA   ASN  45           HA       ASN  45  -7.064   7.476  -2.079
  325   1HB   ASN  45          1HB       ASN  45  -7.522   9.931  -2.564
  326   2HB   ASN  45          2HB       ASN  45  -6.431   9.786  -3.922
  327   1HD2  ASN  45          1HD2      ASN  45  -7.624   6.918  -4.201
  328   2HD2  ASN  45          2HD2      ASN  45  -9.052   7.290  -5.026
  329    H    PHE  46           H        PHE  46  -6.108   5.616  -2.742
  330    HA   PHE  46           HA       PHE  46  -3.776   5.535  -4.387
  331   1HB   PHE  46          1HB       PHE  46  -4.158   3.762  -2.799
  332   2HB   PHE  46          2HB       PHE  46  -5.726   3.378  -3.540
  333    HD1  PHE  46           HD1      PHE  46  -2.091   3.646  -4.462
  334    HD2  PHE  46           HD2      PHE  46  -5.781   1.590  -5.016
  335    HE1  PHE  46           HE1      PHE  46  -0.985   2.060  -5.974
  336    HE2  PHE  46           HE2      PHE  46  -4.675   0.002  -6.525
  337    HZ   PHE  46           HZ       PHE  46  -2.270   0.230  -7.007
  338    H    GLU  47           H        GLU  47  -7.206   5.318  -4.987
  339    HA   GLU  47           HA       GLU  47  -7.297   4.117  -7.460
  340   1HB   GLU  47          1HB       GLU  47  -9.188   4.889  -5.909
  341   2HB   GLU  47          2HB       GLU  47  -9.044   6.441  -6.714
  342   1HG   GLU  47          1HG       GLU  47  -9.687   5.536  -8.795
  343   2HG   GLU  47          2HG       GLU  47  -9.557   3.881  -8.194
  344    H    LYS  48           H        LYS  48  -6.954   7.628  -6.837
  345    HA   LYS  48           HA       LYS  48  -6.552   8.047  -9.681
  346   1HB   LYS  48          1HB       LYS  48  -6.665  10.425  -9.228
  347   2HB   LYS  48          2HB       LYS  48  -8.025   9.590  -8.489
  348   1HG   LYS  48          1HG       LYS  48  -7.089   9.811  -6.317
  349   2HG   LYS  48          2HG       LYS  48  -5.545  10.367  -6.968
  350   1HD   LYS  48          1HD       LYS  48  -6.642  12.385  -7.836
  351   2HD   LYS  48          2HD       LYS  48  -8.180  11.837  -7.167
  352   1HE   LYS  48          1HE       LYS  48  -7.168  13.477  -5.709
  353   2HE   LYS  48          2HE       LYS  48  -7.208  11.905  -4.914
  354   1HZ   LYS  48          1HZ       LYS  48  -4.860  11.605  -5.489
  355   2HZ   LYS  48          2HZ       LYS  48  -5.087  13.012  -4.569
  356   3HZ   LYS  48          3HZ       LYS  48  -4.836  13.129  -6.245
  357    H    ASP  49           H        ASP  49  -4.629   8.277  -6.717
  358    HA   ASP  49           HA       ASP  49  -2.451   9.558  -8.051
  359   1HB   ASP  49          1HB       ASP  49  -2.660   8.251  -5.342
  360   2HB   ASP  49          2HB       ASP  49  -1.181   9.012  -5.926
  361    H    GLY  50           H        GLY  50  -2.998   6.224  -6.969
  362   1HA   GLY  50          1HA       GLY  50  -2.238   4.286  -7.963
  363   2HA   GLY  50          2HA       GLY  50  -1.416   5.265  -9.156
  364    H    LYS  51           H        LYS  51  -0.319   6.452  -6.271
  365    HA   LYS  51           HA       LYS  51   2.160   5.011  -6.554
  366   1HB   LYS  51          1HB       LYS  51   1.256   7.289  -4.829
  367   2HB   LYS  51          2HB       LYS  51   2.736   6.431  -4.437
  368   1HG   LYS  51          1HG       LYS  51   3.430   8.237  -5.709
  369   2HG   LYS  51          2HG       LYS  51   3.435   6.888  -6.839
  370   1HD   LYS  51          1HD       LYS  51   2.468   8.660  -8.026
  371   2HD   LYS  51          2HD       LYS  51   1.100   7.667  -7.515
  372   1HE   LYS  51          1HE       LYS  51   0.564   9.172  -5.741
  373   2HE   LYS  51          2HE       LYS  51   2.066  10.071  -5.973
  374   1HZ   LYS  51          1HZ       LYS  51   1.082  10.453  -8.344
  375   2HZ   LYS  51          2HZ       LYS  51   0.554  11.407  -7.037
  376   3HZ   LYS  51          3HZ       LYS  51  -0.397  10.115  -7.584
  377    H    TYR  52           H        TYR  52   2.629   3.174  -5.624
  378    HA   TYR  52           HA       TYR  52   1.624   2.556  -2.958
  379   1HB   TYR  52          1HB       TYR  52   0.651   0.466  -3.600
  380   2HB   TYR  52          2HB       TYR  52  -0.011   1.672  -4.699
  381    HD1  TYR  52           HD1      TYR  52   1.855  -1.386  -4.433
  382    HD2  TYR  52           HD2      TYR  52   0.980   1.868  -7.030
  383    HE1  TYR  52           HE1      TYR  52   2.674  -2.704  -6.339
  384    HE2  TYR  52           HE2      TYR  52   1.786   0.558  -8.947
  385    HH   TYR  52           HH       TYR  52   3.693  -1.789  -8.913
  386    H    GLY  53           H        GLY  53   2.509   0.295  -2.379
  387   1HA   GLY  53          1HA       GLY  53   4.875  -0.612  -3.626
  388   2HA   GLY  53          2HA       GLY  53   5.248   0.332  -2.197
  389    H    PHE  54           H        PHE  54   5.890  -2.369  -2.371
  390    HA   PHE  54           HA       PHE  54   3.811  -3.832  -1.020
  391   1HB   PHE  54          1HB       PHE  54   6.599  -4.609  -1.819
  392   2HB   PHE  54          2HB       PHE  54   5.469  -5.704  -1.025
  393    HD1  PHE  54           HD1      PHE  54   6.494  -6.579  -3.545
  394    HD2  PHE  54           HD2      PHE  54   3.278  -3.895  -2.783
  395    HE1  PHE  54           HE1      PHE  54   5.503  -7.136  -5.734
  396    HE2  PHE  54           HE2      PHE  54   2.292  -4.439  -4.966
  397    HZ   PHE  54           HZ       PHE  54   3.408  -6.058  -6.447
  398    H    CYS  55           H        CYS  55   3.952  -4.705   1.082
  399    HA   CYS  55           HA       CYS  55   6.031  -3.600   2.799
  400   1HB   CYS  55          1HB       CYS  55   4.650  -1.740   3.066
  401   2HB   CYS  55          2HB       CYS  55   3.210  -2.651   2.643
  402    HA   PRO  56           HA       PRO  56   4.785  -7.567   4.578
  403   1HB   PRO  56          1HB       PRO  56   7.279  -8.469   5.017
  404   2HB   PRO  56          2HB       PRO  56   6.527  -8.554   3.426
  405   1HG   PRO  56          1HG       PRO  56   8.694  -6.798   4.381
  406   2HG   PRO  56          2HG       PRO  56   8.284  -7.282   2.729
  407   1HD   PRO  56          1HD       PRO  56   7.642  -4.824   4.069
  408   2HD   PRO  56          2HD       PRO  56   7.228  -5.309   2.412
  409    H    HIS  57           H        HIS  57   4.348  -5.430   6.073
  410    HA   HIS  57           HA       HIS  57   6.107  -5.035   8.271
  411   1HB   HIS  57          1HB       HIS  57   4.421  -3.381   7.414
  412   2HB   HIS  57          2HB       HIS  57   3.161  -4.389   8.117
  413    HD1  HIS  57           HD1      HIS  57   2.585  -2.209   9.542
  414    HD2  HIS  57           HD2      HIS  57   6.242  -4.013  10.390
  415    HE1  HIS  57           HE1      HIS  57   3.328  -1.238  11.742
  416    H    GLU  58           H        GLU  58   2.923  -6.626   8.037
  417    HA   GLU  58           HA       GLU  58   3.044  -7.638  10.687
  418   1HB   GLU  58          1HB       GLU  58   1.244  -8.309   8.375
  419   2HB   GLU  58          2HB       GLU  58   1.014  -8.912   9.990
  420   1HG   GLU  58          1HG       GLU  58  -0.531  -7.133   9.597
  421   2HG   GLU  58          2HG       GLU  58   0.670  -6.580  10.763
  422    H    ALA  59           H        ALA  59   1.819 -10.178   9.122
  423    HA   ALA  59           HA       ALA  59   4.319 -11.555   8.564
  424   1HB   ALA  59          1HB       ALA  59   4.271 -13.033  10.277
  425   2HB   ALA  59          2HB       ALA  59   2.508 -13.082  10.319
  426   3HB   ALA  59          3HB       ALA  59   3.369 -11.745  11.080
  Start of MODEL    7
    1   1H    ARG   1          1H        ARG   1   4.955   1.365  11.288
    2   2H    ARG   1          2H        ARG   1   3.554   2.358  11.286
    3   3H    ARG   1          3H        ARG   1   4.899   2.766  12.274
    4    HA   ARG   1           HA       ARG   1   4.559   4.025  10.132
    5   1HB   ARG   1          1HB       ARG   1   6.617   3.837  11.683
    6   2HB   ARG   1          2HB       ARG   1   7.252   2.710  10.491
    7   1HG   ARG   1          1HG       ARG   1   6.694   4.704   8.840
    8   2HG   ARG   1          2HG       ARG   1   6.873   5.648  10.320
    9   1HD   ARG   1          1HD       ARG   1   9.002   5.595   9.262
   10   2HD   ARG   1          2HD       ARG   1   9.093   4.509  10.654
   11    HE   ARG   1           HE       ARG   1   8.342   3.105   8.300
   12   1HH1  ARG   1          1HH1      ARG   1  11.106   4.510   9.935
   13   2HH1  ARG   1          2HH1      ARG   1  12.249   3.488   9.120
   14   1HH2  ARG   1          1HH2      ARG   1   9.859   1.801   7.216
   15   2HH2  ARG   1          2HH2      ARG   1  11.546   1.950   7.597
   16    H    ILE   2           H        ILE   2   6.502   1.064   9.784
   17    HA   ILE   2           HA       ILE   2   6.938  -0.332   8.172
   18    HB   ILE   2           HB       ILE   2   4.328   0.144   6.781
   19   1HG1  ILE   2          1HG1      ILE   2   3.861   0.414   9.243
   20   2HG1  ILE   2          2HG1      ILE   2   3.004  -0.919   8.477
   21   1HG2  ILE   2          1HG2      ILE   2   5.237  -2.491   7.817
   22   2HG2  ILE   2          2HG2      ILE   2   6.020  -1.812   6.383
   23   3HG2  ILE   2          3HG2      ILE   2   4.281  -2.125   6.378
   24   1HD1  ILE   2          1HD1      ILE   2   3.880  -1.524  10.675
   25   2HD1  ILE   2          2HD1      ILE   2   5.516  -1.178  10.111
   26   3HD1  ILE   2          3HD1      ILE   2   4.594  -2.497   9.388
   27    HA   PRO   3           HA       PRO   3   8.435   2.127   4.841
   28   1HB   PRO   3          1HB       PRO   3  10.173   0.138   3.959
   29   2HB   PRO   3          2HB       PRO   3  10.518   1.341   5.200
   30   1HG   PRO   3          1HG       PRO   3  10.230  -1.473   5.538
   31   2HG   PRO   3          2HG       PRO   3  10.477  -0.250   6.794
   32   1HD   PRO   3          1HD       PRO   3   7.987  -1.600   5.938
   33   2HD   PRO   3          2HD       PRO   3   8.384  -0.847   7.493
   34    H    VAL   4           H        VAL   4   8.979   1.873   2.514
   35    HA   VAL   4           HA       VAL   4   7.239  -0.054   1.110
   36    HB   VAL   4           HB       VAL   4   7.566   2.889   0.356
   37   1HG1  VAL   4          1HG1      VAL   4   7.282   1.224  -1.505
   38   2HG1  VAL   4          2HG1      VAL   4   6.044   2.476  -1.411
   39   3HG1  VAL   4          3HG1      VAL   4   5.698   0.847  -0.828
   40   1HG2  VAL   4          1HG2      VAL   4   5.025   1.555   1.259
   41   2HG2  VAL   4          2HG2      VAL   4   5.340   3.273   1.023
   42   3HG2  VAL   4          3HG2      VAL   4   6.092   2.413   2.365
   43    H    LYS   5           H        LYS   5   8.213  -0.908  -0.762
   44    HA   LYS   5           HA       LYS   5  10.834   0.235  -1.453
   45   1HB   LYS   5          1HB       LYS   5  10.399  -2.255  -0.215
   46   2HB   LYS   5          2HB       LYS   5  10.853  -2.598  -1.879
   47   1HG   LYS   5          1HG       LYS   5  12.435  -0.882   0.038
   48   2HG   LYS   5          2HG       LYS   5  12.774  -2.561  -0.361
   49   1HD   LYS   5          1HD       LYS   5  14.223  -1.523  -1.782
   50   2HD   LYS   5          2HD       LYS   5  12.806  -1.677  -2.820
   51   1HE   LYS   5          1HE       LYS   5  12.179   0.652  -2.147
   52   2HE   LYS   5          2HE       LYS   5  13.728   0.777  -1.323
   53   1HZ   LYS   5          1HZ       LYS   5  14.636   1.377  -3.232
   54   2HZ   LYS   5          2HZ       LYS   5  13.170   1.148  -4.068
   55   3HZ   LYS   5          3HZ       LYS   5  14.256  -0.144  -3.893
   56    H    TYR   6           H        TYR   6   8.960  -2.535  -2.692
   57    HA   TYR   6           HA       TYR   6   9.557  -1.617  -5.371
   58   1HB   TYR   6          1HB       TYR   6   8.177  -4.145  -4.460
   59   2HB   TYR   6          2HB       TYR   6   8.734  -3.797  -6.100
   60    HD1  TYR   6           HD1      TYR   6  11.319  -2.910  -6.111
   61    HD2  TYR   6           HD2      TYR   6   9.601  -5.522  -3.224
   62    HE1  TYR   6           HE1      TYR   6  13.553  -3.721  -5.519
   63    HE2  TYR   6           HE2      TYR   6  11.831  -6.340  -2.629
   64    HH   TYR   6           HH       TYR   6  14.227  -5.415  -2.749
   65    H    GLY   7           H        GLY   7   8.052  -1.406  -7.032
   66   1HA   GLY   7          1HA       GLY   7   5.658  -1.318  -7.675
   67   2HA   GLY   7          2HA       GLY   7   5.376  -0.506  -6.141
   68    H    ASN   8           H        ASN   8   4.600   1.426  -7.220
   69    HA   ASN   8           HA       ASN   8   6.666   2.694  -8.845
   70   1HB   ASN   8          1HB       ASN   8   5.056   4.251  -9.694
   71   2HB   ASN   8          2HB       ASN   8   4.400   2.627  -9.822
   72   1HD2  ASN   8          1HD2      ASN   8   3.104   5.217  -9.809
   73   2HD2  ASN   8          2HD2      ASN   8   1.929   5.142  -8.550
   74    H    ALA   9           H        ALA   9   5.958   2.556  -5.739
   75    HA   ALA   9           HA       ALA   9   6.511   5.321  -5.018
   76   1HB   ALA   9          1HB       ALA   9   6.450   3.115  -3.030
   77   2HB   ALA   9          2HB       ALA   9   4.922   3.552  -3.813
   78   3HB   ALA   9          3HB       ALA   9   5.821   4.766  -2.899
   79    H    ASP  10           H        ASP  10   8.648   5.927  -4.678
   80    HA   ASP  10           HA       ASP  10  10.704   4.060  -5.187
   81   1HB   ASP  10          1HB       ASP  10  10.856   6.530  -5.605
   82   2HB   ASP  10          2HB       ASP  10  11.082   6.746  -3.870
   83    H    GLY  11           H        GLY  11  10.426   5.966  -2.156
   84   1HA   GLY  11          1HA       GLY  11  10.740   3.541  -0.618
   85   2HA   GLY  11          2HA       GLY  11  12.143   4.592  -0.615
   86    H    GLU  12           H        GLU  12   8.656   5.311  -0.442
   87    HA   GLU  12           HA       GLU  12   9.213   6.995   1.870
   88   1HB   GLU  12          1HB       GLU  12   6.689   6.583   0.251
   89   2HB   GLU  12          2HB       GLU  12   6.814   7.665   1.629
   90   1HG   GLU  12          1HG       GLU  12   8.375   7.893  -0.935
   91   2HG   GLU  12          2HG       GLU  12   6.986   8.877  -0.468
   92    H    TYR  13           H        TYR  13   6.846   6.783   3.291
   93    HA   TYR  13           HA       TYR  13   6.966   4.030   4.236
   94   1HB   TYR  13          1HB       TYR  13   6.809   4.770   6.408
   95   2HB   TYR  13          2HB       TYR  13   7.828   5.980   5.656
   96    HD1  TYR  13           HD1      TYR  13   6.592   8.051   4.703
   97    HD2  TYR  13           HD2      TYR  13   5.035   5.467   7.690
   98    HE1  TYR  13           HE1      TYR  13   5.120   9.867   5.487
   99    HE2  TYR  13           HE2      TYR  13   3.549   7.268   8.493
  100    HH   TYR  13           HH       TYR  13   3.704   9.933   8.398
  101    H    CYS  14           H        CYS  14   4.922   3.187   5.186
  102    HA   CYS  14           HA       CYS  14   2.776   3.564   3.402
  103   1HB   CYS  14          1HB       CYS  14   2.973   2.130   6.037
  104   2HB   CYS  14          2HB       CYS  14   1.502   2.138   5.070
  105    H    LYS  15           H        LYS  15   0.963   4.744   3.481
  106    HA   LYS  15           HA       LYS  15   0.731   6.659   5.668
  107   1HB   LYS  15          1HB       LYS  15   0.738   7.411   3.251
  108   2HB   LYS  15          2HB       LYS  15  -0.821   6.618   3.071
  109   1HG   LYS  15          1HG       LYS  15  -1.811   8.090   4.696
  110   2HG   LYS  15          2HG       LYS  15  -0.239   8.814   5.041
  111   1HD   LYS  15          1HD       LYS  15  -0.127   9.606   2.706
  112   2HD   LYS  15          2HD       LYS  15  -1.738   8.947   2.426
  113   1HE   LYS  15          1HE       LYS  15  -1.762  11.377   2.892
  114   2HE   LYS  15          2HE       LYS  15  -2.687  10.445   4.073
  115   1HZ   LYS  15          1HZ       LYS  15  -0.832  10.588   5.600
  116   2HZ   LYS  15          2HZ       LYS  15  -1.316  12.140   5.130
  117   3HZ   LYS  15          3HZ       LYS  15   0.089  11.450   4.462
  118    H    PHE  16           H        PHE  16  -0.415   5.889   7.331
  119    HA   PHE  16           HA       PHE  16  -2.842   4.317   6.748
  120   1HB   PHE  16          1HB       PHE  16  -1.113   4.361   9.238
  121   2HB   PHE  16          2HB       PHE  16  -2.607   3.455   9.079
  122    HD1  PHE  16           HD1      PHE  16   0.148   2.374   9.754
  123    HD2  PHE  16           HD2      PHE  16  -1.967   2.738   6.083
  124    HE1  PHE  16           HE1      PHE  16   1.390   0.464   8.857
  125    HE2  PHE  16           HE2      PHE  16  -0.729   0.835   5.166
  126    HZ   PHE  16           HZ       PHE  16   0.976  -0.335   6.552
  127    HA   PRO  17           HA       PRO  17  -4.544   3.991   6.966
  128   1HB   PRO  17          1HB       PRO  17  -7.150   4.693   6.644
  129   2HB   PRO  17          2HB       PRO  17  -6.520   3.946   8.114
  130   1HG   PRO  17          1HG       PRO  17  -7.457   6.685   7.705
  131   2HG   PRO  17          2HG       PRO  17  -7.139   5.830   9.222
  132   1HD   PRO  17          1HD       PRO  17  -5.466   7.745   7.821
  133   2HD   PRO  17          2HD       PRO  17  -5.249   7.042   9.433
  134    H    PHE  18           H        PHE  18  -5.276   3.605   4.800
  135    HA   PHE  18           HA       PHE  18  -5.235   6.003   3.098
  136   1HB   PHE  18          1HB       PHE  18  -4.124   4.765   1.342
  137   2HB   PHE  18          2HB       PHE  18  -3.172   4.668   2.813
  138    HD1  PHE  18           HD1      PHE  18  -3.212   2.539   4.138
  139    HD2  PHE  18           HD2      PHE  18  -4.904   2.850   0.253
  140    HE1  PHE  18           HE1      PHE  18  -3.142   0.093   3.915
  141    HE2  PHE  18           HE2      PHE  18  -4.846   0.406   0.017
  142    HZ   PHE  18           HZ       PHE  18  -3.964  -0.993   1.856
  143    H    LEU  19           H        LEU  19  -6.552   5.967   1.227
  144    HA   LEU  19           HA       LEU  19  -8.927   4.309   1.600
  145   1HB   LEU  19          1HB       LEU  19  -9.129   6.776   1.463
  146   2HB   LEU  19          2HB       LEU  19  -8.536   6.698  -0.187
  147    HG   LEU  19           HG       LEU  19 -10.490   5.260  -0.755
  148   1HD1  LEU  19          1HD1      LEU  19 -11.121   5.810   2.113
  149   2HD1  LEU  19          2HD1      LEU  19 -11.229   4.300   1.211
  150   3HD1  LEU  19          3HD1      LEU  19 -12.424   5.568   0.944
  151   1HD2  LEU  19          1HD2      LEU  19 -10.828   8.061   0.246
  152   2HD2  LEU  19          2HD2      LEU  19 -12.167   7.184  -0.495
  153   3HD2  LEU  19          3HD2      LEU  19 -10.693   7.482  -1.415
  154    H    PHE  20           H        PHE  20  -9.073   2.520   0.522
  155    HA   PHE  20           HA       PHE  20  -7.869   2.331  -2.154
  156   1HB   PHE  20          1HB       PHE  20  -7.092   0.642  -0.496
  157   2HB   PHE  20          2HB       PHE  20  -8.759   0.121  -0.305
  158    HD1  PHE  20           HD1      PHE  20  -6.745   0.877  -3.363
  159    HD2  PHE  20           HD2      PHE  20  -9.053  -1.912  -1.138
  160    HE1  PHE  20           HE1      PHE  20  -6.504  -0.784  -5.173
  161    HE2  PHE  20           HE2      PHE  20  -8.815  -3.575  -2.935
  162    HZ   PHE  20           HZ       PHE  20  -7.539  -3.000  -4.968
  163    H    ASN  21           H        ASN  21  -9.444   3.165  -3.386
  164    HA   ASN  21           HA       ASN  21 -11.393   3.408  -4.521
  165   1HB   ASN  21          1HB       ASN  21 -11.249   0.419  -4.189
  166   2HB   ASN  21          2HB       ASN  21 -12.448   1.212  -5.204
  167   1HD2  ASN  21          1HD2      ASN  21 -11.924   1.309  -7.260
  168   2HD2  ASN  21          2HD2      ASN  21 -10.321   1.384  -7.901
  169    H    GLY  22           H        GLY  22 -11.677   3.391  -1.449
  170   1HA   GLY  22          1HA       GLY  22 -13.955   4.242  -0.795
  171   2HA   GLY  22          2HA       GLY  22 -14.550   2.723  -1.432
  172    H    LYS  23           H        LYS  23 -11.649   2.137   0.121
  173    HA   LYS  23           HA       LYS  23 -12.941   1.753   2.726
  174   1HB   LYS  23          1HB       LYS  23 -13.057  -0.372   1.433
  175   2HB   LYS  23          2HB       LYS  23 -11.306  -0.356   1.301
  176   1HG   LYS  23          1HG       LYS  23 -11.092  -0.583   3.710
  177   2HG   LYS  23          2HG       LYS  23 -12.848  -0.530   3.884
  178   1HD   LYS  23          1HD       LYS  23 -13.064  -2.570   2.591
  179   2HD   LYS  23          2HD       LYS  23 -11.319  -2.605   2.319
  180   1HE   LYS  23          1HE       LYS  23 -11.996  -4.145   4.101
  181   2HE   LYS  23          2HE       LYS  23 -10.925  -2.876   4.694
  182   1HZ   LYS  23          1HZ       LYS  23 -12.442  -2.361   6.202
  183   2HZ   LYS  23          2HZ       LYS  23 -13.496  -3.547   5.594
  184   3HZ   LYS  23          3HZ       LYS  23 -13.552  -1.966   4.973
  185    H    GLU  24           H        GLU  24 -11.650   2.281   4.430
  186    HA   GLU  24           HA       GLU  24  -8.940   3.169   3.779
  187   1HB   GLU  24          1HB       GLU  24 -10.526   3.621   6.309
  188   2HB   GLU  24          2HB       GLU  24  -9.009   4.397   5.873
  189   1HG   GLU  24          1HG       GLU  24 -10.148   5.402   3.921
  190   2HG   GLU  24          2HG       GLU  24 -11.661   4.708   4.498
  191    H    TYR  25           H        TYR  25  -7.158   2.153   4.443
  192    HA   TYR  25           HA       TYR  25  -7.457  -0.062   6.371
  193   1HB   TYR  25          1HB       TYR  25  -5.482   0.229   4.122
  194   2HB   TYR  25          2HB       TYR  25  -5.494  -1.101   5.261
  195    HD1  TYR  25           HD1      TYR  25  -7.424   0.541   2.570
  196    HD2  TYR  25           HD2      TYR  25  -6.875  -2.996   4.866
  197    HE1  TYR  25           HE1      TYR  25  -8.935  -0.670   1.042
  198    HE2  TYR  25           HE2      TYR  25  -8.385  -4.220   3.341
  199    HH   TYR  25           HH       TYR  25  -9.283  -4.124   1.173
  200    H    ASN  26           H        ASN  26  -6.187  -0.075   8.152
  201    HA   ASN  26           HA       ASN  26  -4.170   2.058   8.401
  202   1HB   ASN  26          1HB       ASN  26  -5.862   0.602  10.402
  203   2HB   ASN  26          2HB       ASN  26  -4.317   1.282  10.911
  204   1HD2  ASN  26          1HD2      ASN  26  -7.531   1.891  10.656
  205   2HD2  ASN  26          2HD2      ASN  26  -7.496   3.617  10.657
  206    H    SER  27           H        SER  27  -4.008  -0.611   7.080
  207    HA   SER  27           HA       SER  27  -1.401  -1.355   8.065
  208   1HB   SER  27          1HB       SER  27  -2.134  -3.811   8.201
  209   2HB   SER  27          2HB       SER  27  -2.633  -2.767   9.539
  210    HG   SER  27           HG       SER  27  -4.166  -4.159   7.785
  211    H    CYS  28           H        CYS  28  -0.622  -3.319   6.622
  212    HA   CYS  28           HA       CYS  28  -1.139  -2.539   3.896
  213   1HB   CYS  28          1HB       CYS  28   0.555  -4.817   4.949
  214   2HB   CYS  28          2HB       CYS  28   0.582  -4.170   3.313
  215    H    THR  29           H        THR  29  -2.332  -3.705   2.385
  216    HA   THR  29           HA       THR  29  -3.719  -6.040   3.474
  217    HB   THR  29           HB       THR  29  -5.166  -4.044   3.316
  218    HG1  THR  29           HG1      THR  29  -6.404  -5.757   3.124
  219   1HG2  THR  29          1HG2      THR  29  -5.557  -4.129   0.438
  220   2HG2  THR  29          2HG2      THR  29  -3.959  -3.532   0.891
  221   3HG2  THR  29          3HG2      THR  29  -5.405  -2.746   1.528
  222    H    ASP  30           H        ASP  30  -4.536  -7.573   1.864
  223    HA   ASP  30           HA       ASP  30  -2.681  -7.706  -0.382
  224   1HB   ASP  30          1HB       ASP  30  -4.093 -10.158  -0.014
  225   2HB   ASP  30          2HB       ASP  30  -2.387  -9.895   0.010
  226    H    THR  31           H        THR  31  -5.390  -6.380   0.040
  227    HA   THR  31           HA       THR  31  -7.249  -7.691  -1.695
  228    HB   THR  31           HB       THR  31  -7.200  -4.794  -0.840
  229    HG1  THR  31           HG1      THR  31  -7.153  -5.839   1.059
  230   1HG2  THR  31          1HG2      THR  31  -9.106  -6.290  -2.310
  231   2HG2  THR  31          2HG2      THR  31  -9.182  -4.609  -1.780
  232   3HG2  THR  31          3HG2      THR  31  -9.788  -5.895  -0.735
  233    H    GLY  32           H        GLY  32  -7.881  -6.936  -3.815
  234   1HA   GLY  32          1HA       GLY  32  -7.578  -5.683  -5.789
  235   2HA   GLY  32          2HA       GLY  32  -6.059  -5.084  -5.127
  236    H    ARG  33           H        ARG  33  -4.337  -6.787  -4.810
  237    HA   ARG  33           HA       ARG  33  -4.218  -8.380  -7.227
  238   1HB   ARG  33          1HB       ARG  33  -1.902  -8.833  -5.803
  239   2HB   ARG  33          2HB       ARG  33  -2.052  -7.802  -7.165
  240   1HG   ARG  33          1HG       ARG  33  -2.532  -5.929  -5.415
  241   2HG   ARG  33          2HG       ARG  33  -1.985  -7.117  -4.246
  242   1HD   ARG  33          1HD       ARG  33  -0.380  -6.233  -6.631
  243   2HD   ARG  33          2HD       ARG  33  -0.177  -5.621  -4.989
  244    HE   ARG  33           HE       ARG  33   0.159  -8.198  -4.518
  245   1HH1  ARG  33          1HH1      ARG  33   1.333  -6.299  -7.215
  246   2HH1  ARG  33          2HH1      ARG  33   2.768  -7.261  -7.430
  247   1HH2  ARG  33          1HH2      ARG  33   2.041  -9.468  -4.815
  248   2HH2  ARG  33          2HH2      ARG  33   3.174  -9.062  -6.062
  249    H    SER  34           H        SER  34  -2.853 -10.664  -6.596
  250    HA   SER  34           HA       SER  34  -4.217 -11.812  -4.263
  251   1HB   SER  34          1HB       SER  34  -4.429 -13.084  -6.996
  252   2HB   SER  34          2HB       SER  34  -5.192 -13.630  -5.505
  253    HG   SER  34           HG       SER  34  -5.728 -11.221  -6.920
  254    H    ASP  35           H        ASP  35  -1.352 -11.350  -4.779
  255    HA   ASP  35           HA       ASP  35  -0.315 -14.006  -5.208
  256   1HB   ASP  35          1HB       ASP  35   1.216 -11.522  -4.718
  257   2HB   ASP  35          2HB       ASP  35   1.818 -13.006  -5.392
  258    H    GLY  36           H        GLY  36  -1.551 -12.708  -2.568
  259   1HA   GLY  36          1HA       GLY  36  -1.298 -13.251  -0.327
  260   2HA   GLY  36          2HA       GLY  36  -0.050 -14.389  -0.811
  261    H    PHE  37           H        PHE  37   0.192 -11.142  -1.767
  262    HA   PHE  37           HA       PHE  37   2.677 -10.627  -0.426
  263   1HB   PHE  37          1HB       PHE  37   2.318  -8.461  -1.730
  264   2HB   PHE  37          2HB       PHE  37   2.263  -9.910  -2.738
  265    HD1  PHE  37           HD1      PHE  37   0.104 -10.826  -3.463
  266    HD2  PHE  37           HD2      PHE  37   0.350  -7.154  -1.336
  267    HE1  PHE  37           HE1      PHE  37  -2.253 -10.387  -3.952
  268    HE2  PHE  37           HE2      PHE  37  -2.005  -6.707  -1.848
  269    HZ   PHE  37           HZ       PHE  37  -3.310  -8.333  -3.137
  270    H    LEU  38           H        LEU  38   2.199  -7.828  -0.220
  271    HA   LEU  38           HA       LEU  38   0.015  -7.216   1.505
  272   1HB   LEU  38          1HB       LEU  38   2.722  -7.702   2.635
  273   2HB   LEU  38          2HB       LEU  38   1.755  -6.416   3.321
  274    HG   LEU  38           HG       LEU  38   0.731  -9.239   3.080
  275   1HD1  LEU  38          1HD1      LEU  38   1.979  -9.911   4.783
  276   2HD1  LEU  38          2HD1      LEU  38   1.435  -8.549   5.758
  277   3HD1  LEU  38          3HD1      LEU  38   2.854  -8.380   4.726
  278   1HD2  LEU  38          1HD2      LEU  38  -0.843  -8.530   4.751
  279   2HD2  LEU  38          2HD2      LEU  38  -0.889  -7.403   3.397
  280   3HD2  LEU  38          3HD2      LEU  38  -0.053  -6.959   4.886
  281    H    TRP  39           H        TRP  39  -0.496  -5.230   0.557
  282    HA   TRP  39           HA       TRP  39   1.803  -3.452   0.082
  283   1HB   TRP  39          1HB       TRP  39   0.891  -2.634  -1.956
  284   2HB   TRP  39          2HB       TRP  39   0.871  -4.383  -2.043
  285    HD1  TRP  39           HD1      TRP  39  -1.537  -5.599  -2.272
  286    HE1  TRP  39           HE1      TRP  39  -3.879  -4.703  -2.749
  287    HE3  TRP  39           HE3      TRP  39  -0.726  -0.560  -1.597
  288    HZ2  TRP  39           HZ2      TRP  39  -5.215  -2.261  -2.870
  289    HZ3  TRP  39           HZ3      TRP  39  -2.620   0.973  -1.956
  290    HH2  TRP  39           HH2      TRP  39  -4.813   0.128  -2.570
  291    H    CYS  40           H        CYS  40   1.299  -1.176  -0.106
  292    HA   CYS  40           HA       CYS  40  -1.088  -0.186   1.251
  293   1HB   CYS  40          1HB       CYS  40   0.066   0.996   2.970
  294   2HB   CYS  40          2HB       CYS  40   0.742  -0.629   3.014
  295    H    SER  41           H        SER  41  -1.173   2.278   0.937
  296    HA   SER  41           HA       SER  41   0.277   2.918  -1.533
  297   1HB   SER  41          1HB       SER  41  -1.443   4.667  -1.888
  298   2HB   SER  41          2HB       SER  41  -2.140   3.051  -1.758
  299    HG   SER  41           HG       SER  41  -2.454   5.252  -0.136
  300    H    THR  42           H        THR  42   0.995   5.163  -1.824
  301    HA   THR  42           HA       THR  42   2.341   6.080   0.587
  302    HB   THR  42           HB       THR  42   2.599   7.118  -2.239
  303    HG1  THR  42           HG1      THR  42   3.646   4.848  -1.014
  304   1HG2  THR  42          1HG2      THR  42   5.045   7.373  -1.245
  305   2HG2  THR  42          2HG2      THR  42   4.123   7.562   0.249
  306   3HG2  THR  42          3HG2      THR  42   3.824   8.638  -1.117
  307    H    THR  43           H        THR  43  -0.246   6.911  -1.509
  308    HA   THR  43           HA       THR  43  -0.556   9.541  -0.245
  309    HB   THR  43           HB       THR  43  -2.162   9.947  -2.147
  310    HG1  THR  43           HG1      THR  43  -2.620   8.376  -3.451
  311   1HG2  THR  43          1HG2      THR  43   0.408  10.425  -2.192
  312   2HG2  THR  43          2HG2      THR  43  -0.560  10.578  -3.659
  313   3HG2  THR  43          3HG2      THR  43   0.419   9.132  -3.397
  314    H    TYR  44           H        TYR  44  -2.971  10.148   0.018
  315    HA   TYR  44           HA       TYR  44  -4.156   8.152   1.700
  316   1HB   TYR  44          1HB       TYR  44  -4.427  10.509   2.292
  317   2HB   TYR  44          2HB       TYR  44  -5.237  10.824   0.755
  318    HD1  TYR  44           HD1      TYR  44  -5.603   8.387   3.595
  319    HD2  TYR  44           HD2      TYR  44  -7.527  11.075   0.914
  320    HE1  TYR  44           HE1      TYR  44  -7.773   7.846   4.615
  321    HE2  TYR  44           HE2      TYR  44  -9.702  10.544   1.933
  322    HH   TYR  44           HH       TYR  44  -9.995   8.056   4.446
  323    H    ASN  45           H        ASN  45  -5.169   9.745  -1.313
  324    HA   ASN  45           HA       ASN  45  -7.171   7.685  -1.718
  325   1HB   ASN  45          1HB       ASN  45  -7.553  10.148  -2.243
  326   2HB   ASN  45          2HB       ASN  45  -6.439   9.952  -3.573
  327   1HD2  ASN  45          1HD2      ASN  45  -7.725   7.121  -3.858
  328   2HD2  ASN  45          2HD2      ASN  45  -9.125   7.539  -4.715
  329    H    PHE  46           H        PHE  46  -6.255   5.778  -2.378
  330    HA   PHE  46           HA       PHE  46  -3.909   5.701  -4.033
  331   1HB   PHE  46          1HB       PHE  46  -4.243   3.935  -2.419
  332   2HB   PHE  46          2HB       PHE  46  -5.820   3.522  -3.137
  333    HD1  PHE  46           HD1      PHE  46  -2.254   3.953  -4.299
  334    HD2  PHE  46           HD2      PHE  46  -5.820   1.627  -4.439
  335    HE1  PHE  46           HE1      PHE  46  -1.168   2.380  -5.828
  336    HE2  PHE  46           HE2      PHE  46  -4.723   0.042  -5.961
  337    HZ   PHE  46           HZ       PHE  46  -2.396   0.417  -6.658
  338    H    GLU  47           H        GLU  47  -7.332   5.391  -4.529
  339    HA   GLU  47           HA       GLU  47  -7.414   4.304  -7.092
  340   1HB   GLU  47          1HB       GLU  47  -9.313   4.647  -5.497
  341   2HB   GLU  47          2HB       GLU  47  -9.290   6.349  -5.901
  342   1HG   GLU  47          1HG       GLU  47  -9.763   5.742  -8.254
  343   2HG   GLU  47          2HG       GLU  47  -9.937   4.064  -7.736
  344    H    LYS  48           H        LYS  48  -7.308   7.698  -6.080
  345    HA   LYS  48           HA       LYS  48  -7.303   8.627  -8.782
  346   1HB   LYS  48          1HB       LYS  48  -8.428  10.050  -7.306
  347   2HB   LYS  48          2HB       LYS  48  -7.176   9.947  -6.089
  348   1HG   LYS  48          1HG       LYS  48  -5.705  11.340  -7.564
  349   2HG   LYS  48          2HG       LYS  48  -7.088  11.547  -8.653
  350   1HD   LYS  48          1HD       LYS  48  -6.924  13.450  -7.173
  351   2HD   LYS  48          2HD       LYS  48  -8.369  12.516  -6.780
  352   1HE   LYS  48          1HE       LYS  48  -7.180  11.448  -4.934
  353   2HE   LYS  48          2HE       LYS  48  -5.730  12.373  -5.317
  354   1HZ   LYS  48          1HZ       LYS  48  -7.183  14.407  -4.960
  355   2HZ   LYS  48          2HZ       LYS  48  -6.758  13.516  -3.576
  356   3HZ   LYS  48          3HZ       LYS  48  -8.314  13.355  -4.245
  357    H    ASP  49           H        ASP  49  -4.833   8.612  -6.175
  358    HA   ASP  49           HA       ASP  49  -2.887   9.820  -7.901
  359   1HB   ASP  49          1HB       ASP  49  -2.566   8.554  -5.178
  360   2HB   ASP  49          2HB       ASP  49  -1.320   9.467  -6.022
  361    H    GLY  50           H        GLY  50  -3.093   6.579  -6.404
  362   1HA   GLY  50          1HA       GLY  50  -2.655   4.576  -7.558
  363   2HA   GLY  50          2HA       GLY  50  -1.854   5.505  -8.803
  364    H    LYS  51           H        LYS  51  -0.646   6.506  -5.828
  365    HA   LYS  51           HA       LYS  51   1.819   5.102  -6.328
  366   1HB   LYS  51          1HB       LYS  51   0.975   7.147  -4.309
  367   2HB   LYS  51          2HB       LYS  51   2.484   6.273  -4.106
  368   1HG   LYS  51          1HG       LYS  51   3.176   8.157  -5.185
  369   2HG   LYS  51          2HG       LYS  51   2.937   7.052  -6.537
  370   1HD   LYS  51          1HD       LYS  51   0.771   8.055  -6.994
  371   2HD   LYS  51          2HD       LYS  51   0.959   9.130  -5.605
  372   1HE   LYS  51          1HE       LYS  51   3.111   9.923  -6.738
  373   2HE   LYS  51          2HE       LYS  51   2.523   9.099  -8.180
  374   1HZ   LYS  51          1HZ       LYS  51   1.996  11.518  -8.047
  375   2HZ   LYS  51          2HZ       LYS  51   0.970  11.182  -6.741
  376   3HZ   LYS  51          3HZ       LYS  51   0.640  10.520  -8.276
  377    H    TYR  52           H        TYR  52   2.200   3.096  -5.669
  378    HA   TYR  52           HA       TYR  52   1.274   2.277  -3.022
  379   1HB   TYR  52          1HB       TYR  52   0.389   0.206  -3.819
  380   2HB   TYR  52          2HB       TYR  52  -0.330   1.472  -4.805
  381    HD1  TYR  52           HD1      TYR  52   1.915  -1.400  -4.764
  382    HD2  TYR  52           HD2      TYR  52   0.338   1.745  -7.162
  383    HE1  TYR  52           HE1      TYR  52   2.720  -2.542  -6.780
  384    HE2  TYR  52           HE2      TYR  52   1.130   0.601  -9.186
  385    HH   TYR  52           HH       TYR  52   3.359  -1.505  -9.354
  386    H    GLY  53           H        GLY  53   2.332   0.259  -2.332
  387   1HA   GLY  53          1HA       GLY  53   4.640  -0.693  -3.671
  388   2HA   GLY  53          2HA       GLY  53   5.064   0.398  -2.366
  389    H    PHE  54           H        PHE  54   5.888  -2.190  -2.277
  390    HA   PHE  54           HA       PHE  54   3.999  -3.586  -0.566
  391   1HB   PHE  54          1HB       PHE  54   6.691  -4.508  -1.561
  392   2HB   PHE  54          2HB       PHE  54   5.463  -5.509  -0.791
  393    HD1  PHE  54           HD1      PHE  54   3.045  -5.164  -1.966
  394    HD2  PHE  54           HD2      PHE  54   6.838  -4.716  -3.836
  395    HE1  PHE  54           HE1      PHE  54   2.004  -5.530  -4.164
  396    HE2  PHE  54           HE2      PHE  54   5.809  -5.087  -6.033
  397    HZ   PHE  54           HZ       PHE  54   3.392  -5.492  -6.204
  398    H    CYS  55           H        CYS  55   4.195  -3.716   1.593
  399    HA   CYS  55           HA       CYS  55   6.421  -2.242   2.759
  400   1HB   CYS  55          1HB       CYS  55   4.600  -2.675   4.795
  401   2HB   CYS  55          2HB       CYS  55   4.760  -1.220   3.820
  402    HA   PRO  56           HA       PRO  56   6.941  -6.049   5.417
  403   1HB   PRO  56          1HB       PRO  56   4.797  -7.785   5.730
  404   2HB   PRO  56          2HB       PRO  56   5.226  -6.470   6.814
  405   1HG   PRO  56          1HG       PRO  56   2.893  -6.647   5.248
  406   2HG   PRO  56          2HG       PRO  56   3.477  -5.214   6.114
  407   1HD   PRO  56          1HD       PRO  56   3.776  -5.948   3.236
  408   2HD   PRO  56          2HD       PRO  56   3.577  -4.345   3.979
  409    H    HIS  57           H        HIS  57   7.400  -6.185   2.727
  410    HA   HIS  57           HA       HIS  57   7.326  -9.083   2.239
  411   1HB   HIS  57          1HB       HIS  57   5.785  -7.469   0.795
  412   2HB   HIS  57          2HB       HIS  57   7.294  -7.180  -0.067
  413    HD1  HIS  57           HD1      HIS  57   5.347 -10.255   1.107
  414    HD2  HIS  57           HD2      HIS  57   7.569  -8.892  -2.147
  415    HE1  HIS  57           HE1      HIS  57   5.301 -12.123  -0.588
  416    H    GLU  58           H        GLU  58   8.869  -8.645  -0.253
  417    HA   GLU  58           HA       GLU  58  11.468  -8.615   0.905
  418   1HB   GLU  58          1HB       GLU  58  12.264  -8.792  -1.450
  419   2HB   GLU  58          2HB       GLU  58  11.086 -10.015  -1.012
  420   1HG   GLU  58          1HG       GLU  58   9.344  -8.522  -2.105
  421   2HG   GLU  58          2HG       GLU  58  10.699  -7.600  -2.758
  422    H    ALA  59           H        ALA  59  13.093  -7.064   0.725
  423    HA   ALA  59           HA       ALA  59  12.283  -4.451  -0.338
  424   1HB   ALA  59          1HB       ALA  59  13.890  -3.859   1.844
  425   2HB   ALA  59          2HB       ALA  59  12.822  -5.142   2.420
  426   3HB   ALA  59          3HB       ALA  59  12.140  -3.663   1.740
  Start of MODEL    8
    1   1H    ARG   1          1H        ARG   1   7.068   2.686  10.877
    2   2H    ARG   1          2H        ARG   1   5.563   1.962  10.473
    3   3H    ARG   1          3H        ARG   1   5.603   3.526  11.175
    4    HA   ARG   1           HA       ARG   1   5.219   3.321   8.698
    5   1HB   ARG   1          1HB       ARG   1   5.901   5.349  10.185
    6   2HB   ARG   1          2HB       ARG   1   7.519   5.082   9.561
    7   1HG   ARG   1          1HG       ARG   1   6.658   6.751   8.217
    8   2HG   ARG   1          2HG       ARG   1   6.476   5.293   7.245
    9   1HD   ARG   1          1HD       ARG   1   4.115   5.147   7.967
   10   2HD   ARG   1          2HD       ARG   1   4.313   6.647   8.869
   11    HE   ARG   1           HE       ARG   1   3.837   6.375   6.072
   12   1HH1  ARG   1          1HH1      ARG   1   5.324   8.435   8.477
   13   2HH1  ARG   1          2HH1      ARG   1   5.407   9.813   7.424
   14   1HH2  ARG   1          1HH2      ARG   1   3.964   8.164   4.693
   15   2HH2  ARG   1          2HH2      ARG   1   4.612   9.662   5.271
   16    H    ILE   2           H        ILE   2   6.017   1.312   7.829
   17    HA   ILE   2           HA       ILE   2   8.766   0.716   7.629
   18    HB   ILE   2           HB       ILE   2   8.111  -0.961   5.874
   19   1HG1  ILE   2          1HG1      ILE   2   6.157   0.529   5.085
   20   2HG1  ILE   2          2HG1      ILE   2   5.943  -1.215   5.061
   21   1HG2  ILE   2          1HG2      ILE   2   7.944  -2.155   7.850
   22   2HG2  ILE   2          2HG2      ILE   2   6.216  -2.063   7.513
   23   3HG2  ILE   2          3HG2      ILE   2   6.959  -0.905   8.609
   24   1HD1  ILE   2          1HD1      ILE   2   4.762   0.786   6.951
   25   2HD1  ILE   2          2HD1      ILE   2   4.799  -0.938   7.317
   26   3HD1  ILE   2          3HD1      ILE   2   3.941  -0.353   5.891
   27    HA   PRO   3           HA       PRO   3  10.182   3.194   4.325
   28   1HB   PRO   3          1HB       PRO   3  12.352   1.780   3.595
   29   2HB   PRO   3          2HB       PRO   3  12.255   2.662   5.125
   30   1HG   PRO   3          1HG       PRO   3  11.832  -0.251   4.582
   31   2HG   PRO   3          2HG       PRO   3  12.739   0.525   5.893
   32   1HD   PRO   3          1HD       PRO   3  10.214  -0.433   6.219
   33   2HD   PRO   3          2HD       PRO   3  10.836   0.963   7.123
   34    H    VAL   4           H        VAL   4   8.546   0.412   3.659
   35    HA   VAL   4           HA       VAL   4   7.572  -0.392   1.736
   36    HB   VAL   4           HB       VAL   4   9.133   1.729   0.199
   37   1HG1  VAL   4          1HG1      VAL   4   7.440  -0.360  -0.679
   38   2HG1  VAL   4          2HG1      VAL   4   8.161   0.942  -1.624
   39   3HG1  VAL   4          3HG1      VAL   4   6.569   1.157  -0.897
   40   1HG2  VAL   4          1HG2      VAL   4   6.400   2.442   0.512
   41   2HG2  VAL   4          2HG2      VAL   4   7.840   3.301   1.068
   42   3HG2  VAL   4          3HG2      VAL   4   7.065   2.103   2.111
   43    H    LYS   5           H        LYS   5   8.067  -1.763  -0.087
   44    HA   LYS   5           HA       LYS   5  10.853  -2.712  -0.004
   45   1HB   LYS   5          1HB       LYS   5   8.247  -4.042   0.002
   46   2HB   LYS   5          2HB       LYS   5   9.340  -4.704  -1.203
   47   1HG   LYS   5          1HG       LYS   5   9.874  -4.492   1.762
   48   2HG   LYS   5          2HG       LYS   5   9.462  -5.954   0.866
   49   1HD   LYS   5          1HD       LYS   5  11.515  -5.899  -0.340
   50   2HD   LYS   5          2HD       LYS   5  11.919  -4.304   0.306
   51   1HE   LYS   5          1HE       LYS   5  12.215  -5.190   2.506
   52   2HE   LYS   5          2HE       LYS   5  11.542  -6.753   2.038
   53   1HZ   LYS   5          1HZ       LYS   5  13.832  -5.918   0.473
   54   2HZ   LYS   5          2HZ       LYS   5  13.493  -7.415   1.190
   55   3HZ   LYS   5          3HZ       LYS   5  14.167  -6.172   2.124
   56    H    TYR   6           H        TYR   6   8.249  -3.264  -2.334
   57    HA   TYR   6           HA       TYR   6  10.025  -2.228  -4.442
   58   1HB   TYR   6          1HB       TYR   6   7.996  -4.435  -4.822
   59   2HB   TYR   6          2HB       TYR   6   9.300  -3.963  -5.907
   60    HD1  TYR   6           HD1      TYR   6  11.746  -4.103  -4.763
   61    HD2  TYR   6           HD2      TYR   6   8.332  -6.351  -3.559
   62    HE1  TYR   6           HE1      TYR   6  13.207  -5.762  -3.705
   63    HE2  TYR   6           HE2      TYR   6   9.789  -8.009  -2.501
   64    HH   TYR   6           HH       TYR   6  13.322  -7.739  -2.679
   65    H    GLY   7           H        GLY   7   8.583  -2.018  -6.570
   66   1HA   GLY   7          1HA       GLY   7   6.393  -1.343  -7.398
   67   2HA   GLY   7          2HA       GLY   7   6.145  -0.485  -5.889
   68    H    ASN   8           H        ASN   8   5.763   1.459  -7.063
   69    HA   ASN   8           HA       ASN   8   8.142   2.491  -8.418
   70   1HB   ASN   8          1HB       ASN   8   6.739   4.134  -9.530
   71   2HB   ASN   8          2HB       ASN   8   6.126   2.510  -9.804
   72   1HD2  ASN   8          1HD2      ASN   8   4.719   4.997 -10.085
   73   2HD2  ASN   8          2HD2      ASN   8   3.389   4.942  -8.981
   74    H    ALA   9           H        ALA   9   6.662   2.676  -5.492
   75    HA   ALA   9           HA       ALA   9   7.206   5.436  -4.870
   76   1HB   ALA   9          1HB       ALA   9   6.821   3.391  -2.747
   77   2HB   ALA   9          2HB       ALA   9   5.456   3.745  -3.810
   78   3HB   ALA   9          3HB       ALA   9   6.190   5.039  -2.852
   79    H    ASP  10           H        ASP  10   9.019   6.216  -3.835
   80    HA   ASP  10           HA       ASP  10  11.249   4.315  -3.630
   81   1HB   ASP  10          1HB       ASP  10  11.465   6.415  -5.034
   82   2HB   ASP  10          2HB       ASP  10  11.419   7.334  -3.533
   83    H    GLY  11           H        GLY  11  11.096   7.343  -1.863
   84   1HA   GLY  11          1HA       GLY  11  11.419   5.806   0.603
   85   2HA   GLY  11          2HA       GLY  11  11.897   7.481   0.380
   86    H    GLU  12           H        GLU  12   8.832   6.375  -0.775
   87    HA   GLU  12           HA       GLU  12   7.496   8.165   1.075
   88   1HB   GLU  12          1HB       GLU  12   6.501   6.612  -1.317
   89   2HB   GLU  12          2HB       GLU  12   5.480   7.633  -0.327
   90   1HG   GLU  12          1HG       GLU  12   6.001   8.896  -2.229
   91   2HG   GLU  12          2HG       GLU  12   6.994   9.556  -0.935
   92    H    TYR  13           H        TYR  13   7.652   6.980   3.016
   93    HA   TYR  13           HA       TYR  13   6.973   4.286   3.316
   94   1HB   TYR  13          1HB       TYR  13   6.474   6.127   5.598
   95   2HB   TYR  13          2HB       TYR  13   7.265   4.548   5.565
   96    HD1  TYR  13           HD1      TYR  13   7.755   8.152   4.913
   97    HD2  TYR  13           HD2      TYR  13   9.601   4.336   5.254
   98    HE1  TYR  13           HE1      TYR  13   9.963   9.233   4.947
   99    HE2  TYR  13           HE2      TYR  13  11.814   5.402   5.291
  100    HH   TYR  13           HH       TYR  13  12.545   8.148   4.220
  101    H    CYS  14           H        CYS  14   5.122   3.215   3.915
  102    HA   CYS  14           HA       CYS  14   2.757   3.819   2.770
  103   1HB   CYS  14          1HB       CYS  14   3.114   2.313   5.364
  104   2HB   CYS  14          2HB       CYS  14   1.716   2.204   4.301
  105    H    LYS  15           H        LYS  15   1.207   5.311   3.033
  106    HA   LYS  15           HA       LYS  15   1.146   6.798   5.557
  107   1HB   LYS  15          1HB       LYS  15   1.344   7.953   3.284
  108   2HB   LYS  15          2HB       LYS  15  -0.342   7.515   3.035
  109   1HG   LYS  15          1HG       LYS  15  -1.085   8.934   4.727
  110   2HG   LYS  15          2HG       LYS  15   0.511   9.022   5.479
  111   1HD   LYS  15          1HD       LYS  15   1.350  10.285   3.558
  112   2HD   LYS  15          2HD       LYS  15  -0.242  10.201   2.803
  113   1HE   LYS  15          1HE       LYS  15   0.332  11.498   5.472
  114   2HE   LYS  15          2HE       LYS  15   0.217  12.366   3.939
  115   1HZ   LYS  15          1HZ       LYS  15  -1.888  12.566   4.917
  116   2HZ   LYS  15          2HZ       LYS  15  -1.928  10.942   5.394
  117   3HZ   LYS  15          3HZ       LYS  15  -2.080  11.341   3.753
  118    H    PHE  16           H        PHE  16  -0.242   6.144   7.013
  119    HA   PHE  16           HA       PHE  16  -2.677   4.741   6.166
  120   1HB   PHE  16          1HB       PHE  16  -1.162   4.735   8.789
  121   2HB   PHE  16          2HB       PHE  16  -2.621   3.795   8.475
  122    HD1  PHE  16           HD1      PHE  16   0.157   2.799   9.319
  123    HD2  PHE  16           HD2      PHE  16  -1.759   3.160   5.541
  124    HE1  PHE  16           HE1      PHE  16   1.525   0.956   8.456
  125    HE2  PHE  16           HE2      PHE  16  -0.401   1.321   4.665
  126    HZ   PHE  16           HZ       PHE  16   1.255   0.182   6.120
  127    HA   PRO  17           HA       PRO  17  -4.472   4.176   6.776
  128   1HB   PRO  17          1HB       PRO  17  -7.159   4.797   6.733
  129   2HB   PRO  17          2HB       PRO  17  -6.307   4.108   8.118
  130   1HG   PRO  17          1HG       PRO  17  -7.469   6.723   7.880
  131   2HG   PRO  17          2HG       PRO  17  -6.629   6.025   9.273
  132   1HD   PRO  17          1HD       PRO  17  -5.622   7.883   7.209
  133   2HD   PRO  17          2HD       PRO  17  -5.027   7.584   8.856
  134    H    PHE  18           H        PHE  18  -4.500   3.691   4.631
  135    HA   PHE  18           HA       PHE  18  -5.172   5.844   2.786
  136   1HB   PHE  18          1HB       PHE  18  -4.025   4.641   1.086
  137   2HB   PHE  18          2HB       PHE  18  -3.038   4.519   2.530
  138    HD1  PHE  18           HD1      PHE  18  -5.322   2.674   0.291
  139    HD2  PHE  18           HD2      PHE  18  -2.533   2.421   3.495
  140    HE1  PHE  18           HE1      PHE  18  -5.236   0.245   0.010
  141    HE2  PHE  18           HE2      PHE  18  -2.445  -0.021   3.224
  142    HZ   PHE  18           HZ       PHE  18  -3.788  -1.133   1.479
  143    H    LEU  19           H        LEU  19  -6.662   5.648   1.120
  144    HA   LEU  19           HA       LEU  19  -8.935   3.956   1.792
  145   1HB   LEU  19          1HB       LEU  19  -9.126   6.439   1.430
  146   2HB   LEU  19          2HB       LEU  19  -8.762   6.156  -0.261
  147    HG   LEU  19           HG       LEU  19 -10.793   4.637  -0.316
  148   1HD1  LEU  19          1HD1      LEU  19 -12.407   5.663   1.618
  149   2HD1  LEU  19          2HD1      LEU  19 -10.871   5.523   2.475
  150   3HD1  LEU  19          3HD1      LEU  19 -11.587   4.107   1.707
  151   1HD2  LEU  19          1HD2      LEU  19 -11.268   7.549   0.292
  152   2HD2  LEU  19          2HD2      LEU  19 -12.328   6.474  -0.623
  153   3HD2  LEU  19          3HD2      LEU  19 -10.739   6.901  -1.257
  154    H    PHE  20           H        PHE  20  -9.564   2.276   0.666
  155    HA   PHE  20           HA       PHE  20  -8.633   1.920  -2.107
  156   1HB   PHE  20          1HB       PHE  20  -7.273   0.559  -0.362
  157   2HB   PHE  20          2HB       PHE  20  -8.772  -0.338  -0.149
  158    HD1  PHE  20           HD1      PHE  20  -7.127   0.921  -3.279
  159    HD2  PHE  20           HD2      PHE  20  -8.555  -2.372  -0.993
  160    HE1  PHE  20           HE1      PHE  20  -6.606  -0.624  -5.139
  161    HE2  PHE  20           HE2      PHE  20  -8.038  -3.913  -2.838
  162    HZ   PHE  20           HZ       PHE  20  -7.064  -3.026  -4.926
  163    H    ASN  21           H        ASN  21 -10.527   1.976  -3.204
  164    HA   ASN  21           HA       ASN  21 -12.668   1.505  -3.862
  165   1HB   ASN  21          1HB       ASN  21 -12.093  -1.013  -2.295
  166   2HB   ASN  21          2HB       ASN  21 -13.549  -0.779  -3.252
  167   1HD2  ASN  21          1HD2      ASN  21 -11.276   0.850  -4.905
  168   2HD2  ASN  21          2HD2      ASN  21 -10.723  -0.397  -5.965
  169    H    GLY  22           H        GLY  22 -12.226   2.948  -1.308
  170   1HA   GLY  22          1HA       GLY  22 -13.868   4.040  -0.026
  171   2HA   GLY  22          2HA       GLY  22 -14.964   2.705  -0.337
  172    H    LYS  23           H        LYS  23 -11.901   1.606   0.655
  173    HA   LYS  23           HA       LYS  23 -12.860   1.398   3.435
  174   1HB   LYS  23          1HB       LYS  23 -12.969  -0.750   2.173
  175   2HB   LYS  23          2HB       LYS  23 -11.238  -0.639   1.892
  176   1HG   LYS  23          1HG       LYS  23 -10.788  -0.857   4.251
  177   2HG   LYS  23          2HG       LYS  23 -12.517  -0.828   4.617
  178   1HD   LYS  23          1HD       LYS  23 -11.117  -2.913   2.944
  179   2HD   LYS  23          2HD       LYS  23 -11.591  -3.109   4.635
  180   1HE   LYS  23          1HE       LYS  23 -13.912  -2.927   4.075
  181   2HE   LYS  23          2HE       LYS  23 -13.531  -2.465   2.416
  182   1HZ   LYS  23          1HZ       LYS  23 -14.232  -4.795   2.645
  183   2HZ   LYS  23          2HZ       LYS  23 -12.879  -5.105   3.622
  184   3HZ   LYS  23          3HZ       LYS  23 -12.667  -4.648   1.996
  185    H    GLU  24           H        GLU  24 -11.500   2.182   4.942
  186    HA   GLU  24           HA       GLU  24  -8.866   3.096   4.077
  187   1HB   GLU  24          1HB       GLU  24 -10.421   3.618   6.612
  188   2HB   GLU  24          2HB       GLU  24  -8.840   4.299   6.256
  189   1HG   GLU  24          1HG       GLU  24  -9.824   5.370   4.252
  190   2HG   GLU  24          2HG       GLU  24 -11.404   4.783   4.768
  191    H    TYR  25           H        TYR  25  -7.108   1.992   4.455
  192    HA   TYR  25           HA       TYR  25  -7.166  -0.177   6.427
  193   1HB   TYR  25          1HB       TYR  25  -5.315   0.398   4.131
  194   2HB   TYR  25          2HB       TYR  25  -5.073  -0.927   5.253
  195    HD1  TYR  25           HD1      TYR  25  -7.094  -2.578   5.499
  196    HD2  TYR  25           HD2      TYR  25  -6.530   0.051   2.208
  197    HE1  TYR  25           HE1      TYR  25  -8.590  -3.987   4.116
  198    HE2  TYR  25           HE2      TYR  25  -8.009  -1.343   0.819
  199    HH   TYR  25           HH       TYR  25  -8.873  -4.442   1.590
  200    H    ASN  26           H        ASN  26  -6.024  -0.083   8.239
  201    HA   ASN  26           HA       ASN  26  -4.405   2.287   8.754
  202   1HB   ASN  26          1HB       ASN  26  -5.350   0.048  10.561
  203   2HB   ASN  26          2HB       ASN  26  -4.261   1.323  11.092
  204   1HD2  ASN  26          1HD2      ASN  26  -6.609   2.296   8.805
  205   2HD2  ASN  26          2HD2      ASN  26  -7.694   3.056   9.913
  206    H    SER  27           H        SER  27  -3.901  -0.551   7.331
  207    HA   SER  27           HA       SER  27  -1.056  -0.494   7.800
  208   1HB   SER  27          1HB       SER  27  -0.915  -2.884   8.416
  209   2HB   SER  27          2HB       SER  27  -1.823  -1.958   9.623
  210    HG   SER  27           HG       SER  27  -2.768  -3.797   7.702
  211    H    CYS  28           H        CYS  28  -0.349  -2.859   6.597
  212    HA   CYS  28           HA       CYS  28  -1.033  -2.318   3.851
  213   1HB   CYS  28          1HB       CYS  28   0.666  -4.558   4.968
  214   2HB   CYS  28          2HB       CYS  28   0.636  -3.983   3.305
  215    H    THR  29           H        THR  29  -2.001  -3.840   2.403
  216    HA   THR  29           HA       THR  29  -3.419  -6.063   3.647
  217    HB   THR  29           HB       THR  29  -4.941  -4.130   3.555
  218    HG1  THR  29           HG1      THR  29  -6.141  -5.878   3.345
  219   1HG2  THR  29          1HG2      THR  29  -3.795  -3.522   1.127
  220   2HG2  THR  29          2HG2      THR  29  -5.250  -2.794   1.808
  221   3HG2  THR  29          3HG2      THR  29  -5.386  -4.149   0.687
  222    H    ASP  30           H        ASP  30  -4.335  -7.577   1.969
  223    HA   ASP  30           HA       ASP  30  -2.493  -7.699  -0.304
  224   1HB   ASP  30          1HB       ASP  30  -4.004 -10.113   0.066
  225   2HB   ASP  30          2HB       ASP  30  -2.294  -9.916  -0.134
  226    H    THR  31           H        THR  31  -5.404  -6.651   0.396
  227    HA   THR  31           HA       THR  31  -7.227  -7.822  -1.345
  228    HB   THR  31           HB       THR  31  -7.073  -4.897  -0.660
  229    HG1  THR  31           HG1      THR  31  -6.980  -5.877   1.292
  230   1HG2  THR  31          1HG2      THR  31  -9.186  -6.614  -1.752
  231   2HG2  THR  31          2HG2      THR  31  -8.941  -4.873  -1.892
  232   3HG2  THR  31          3HG2      THR  31  -9.670  -5.546  -0.436
  233    H    GLY  32           H        GLY  32  -7.760  -7.502  -3.485
  234   1HA   GLY  32          1HA       GLY  32  -7.623  -6.551  -5.616
  235   2HA   GLY  32          2HA       GLY  32  -6.328  -5.512  -5.036
  236    H    ARG  33           H        ARG  33  -4.576  -7.330  -3.989
  237    HA   ARG  33           HA       ARG  33  -3.347  -8.387  -6.363
  238   1HB   ARG  33          1HB       ARG  33  -2.534  -8.765  -3.470
  239   2HB   ARG  33          2HB       ARG  33  -1.520  -8.999  -4.886
  240   1HG   ARG  33          1HG       ARG  33  -2.709  -6.351  -4.087
  241   2HG   ARG  33          2HG       ARG  33  -1.094  -6.888  -3.630
  242   1HD   ARG  33          1HD       ARG  33  -2.095  -6.558  -6.457
  243   2HD   ARG  33          2HD       ARG  33  -1.090  -5.390  -5.598
  244    HE   ARG  33           HE       ARG  33   0.111  -7.976  -5.621
  245   1HH1  ARG  33          1HH1      ARG  33  -0.443  -5.139  -7.600
  246   2HH1  ARG  33          2HH1      ARG  33   0.928  -5.437  -8.623
  247   1HH2  ARG  33          1HH2      ARG  33   1.878  -8.381  -6.958
  248   2HH2  ARG  33          2HH2      ARG  33   2.259  -7.296  -8.259
  249    H    SER  34           H        SER  34  -3.551 -10.405  -7.133
  250    HA   SER  34           HA       SER  34  -5.306 -12.241  -5.782
  251   1HB   SER  34          1HB       SER  34  -3.665 -12.751  -8.273
  252   2HB   SER  34          2HB       SER  34  -5.130 -13.586  -7.759
  253    HG   SER  34           HG       SER  34  -5.336 -11.866  -9.419
  254    H    ASP  35           H        ASP  35  -1.874 -11.794  -5.999
  255    HA   ASP  35           HA       ASP  35  -1.301 -14.477  -5.142
  256   1HB   ASP  35          1HB       ASP  35   0.394 -12.154  -5.818
  257   2HB   ASP  35          2HB       ASP  35   1.068 -13.625  -5.170
  258    H    GLY  36           H        GLY  36  -2.605 -12.232  -3.452
  259   1HA   GLY  36          1HA       GLY  36  -2.648 -11.632  -1.241
  260   2HA   GLY  36          2HA       GLY  36  -1.797 -13.140  -0.953
  261    H    PHE  37           H        PHE  37  -0.745 -10.175  -2.637
  262    HA   PHE  37           HA       PHE  37   1.639 -10.189  -0.954
  263   1HB   PHE  37          1HB       PHE  37   0.958  -9.034  -3.601
  264   2HB   PHE  37          2HB       PHE  37   2.123  -8.152  -2.627
  265    HD1  PHE  37           HD1      PHE  37   1.439 -11.671  -3.684
  266    HD2  PHE  37           HD2      PHE  37   4.329  -8.629  -2.975
  267    HE1  PHE  37           HE1      PHE  37   3.216 -13.187  -4.455
  268    HE2  PHE  37           HE2      PHE  37   6.112 -10.134  -3.747
  269    HZ   PHE  37           HZ       PHE  37   5.559 -12.417  -4.495
  270    H    LEU  38           H        LEU  38   2.034  -8.713   0.575
  271    HA   LEU  38           HA       LEU  38  -0.088  -6.942   1.357
  272   1HB   LEU  38          1HB       LEU  38   2.625  -7.514   2.475
  273   2HB   LEU  38          2HB       LEU  38   1.624  -6.244   3.126
  274    HG   LEU  38           HG       LEU  38   1.427  -8.199   4.515
  275   1HD1  LEU  38          1HD1      LEU  38  -0.583  -6.858   4.203
  276   2HD1  LEU  38          2HD1      LEU  38  -0.966  -8.559   4.463
  277   3HD1  LEU  38          3HD1      LEU  38  -1.045  -7.882   2.839
  278   1HD2  LEU  38          1HD2      LEU  38   2.073  -9.874   2.824
  279   2HD2  LEU  38          2HD2      LEU  38   0.485  -9.690   2.078
  280   3HD2  LEU  38          3HD2      LEU  38   0.618 -10.321   3.717
  281    H    TRP  39           H        TRP  39  -0.356  -4.968   0.582
  282    HA   TRP  39           HA       TRP  39   2.028  -3.413  -0.147
  283   1HB   TRP  39          1HB       TRP  39   0.953  -2.564  -2.157
  284   2HB   TRP  39          2HB       TRP  39   1.007  -4.320  -2.221
  285    HD1  TRP  39           HD1      TRP  39  -1.390  -5.617  -1.870
  286    HE1  TRP  39           HE1      TRP  39  -3.784  -4.832  -2.331
  287    HE3  TRP  39           HE3      TRP  39  -0.568  -0.569  -2.167
  288    HZ2  TRP  39           HZ2      TRP  39  -5.145  -2.414  -2.767
  289    HZ3  TRP  39           HZ3      TRP  39  -2.493   0.900  -2.627
  290    HH2  TRP  39           HH2      TRP  39  -4.729  -0.012  -2.913
  291    H    CYS  40           H        CYS  40   1.380  -1.059  -0.543
  292    HA   CYS  40           HA       CYS  40  -0.877  -0.144   1.048
  293   1HB   CYS  40          1HB       CYS  40   0.458   1.219   2.532
  294   2HB   CYS  40          2HB       CYS  40   1.042  -0.439   2.644
  295    H    SER  41           H        SER  41  -0.928   2.356   0.930
  296    HA   SER  41           HA       SER  41  -0.019   3.144  -1.757
  297   1HB   SER  41          1HB       SER  41  -2.477   3.095  -1.462
  298   2HB   SER  41          2HB       SER  41  -2.332   4.240  -0.131
  299    HG   SER  41           HG       SER  41  -2.332   5.771  -1.549
  300    H    THR  42           H        THR  42   0.480   5.440  -2.013
  301    HA   THR  42           HA       THR  42   2.113   6.395   0.210
  302    HB   THR  42           HB       THR  42   1.836   7.360  -2.644
  303    HG1  THR  42           HG1      THR  42   3.841   5.793  -1.395
  304   1HG2  THR  42          1HG2      THR  42   4.299   8.169  -1.695
  305   2HG2  THR  42          2HG2      THR  42   3.172   8.565  -0.397
  306   3HG2  THR  42          3HG2      THR  42   2.896   9.187  -2.023
  307    H    THR  43           H        THR  43  -0.571   7.289  -1.833
  308    HA   THR  43           HA       THR  43  -1.102   9.699  -0.261
  309    HB   THR  43           HB       THR  43  -2.678  10.237  -2.074
  310    HG1  THR  43           HG1      THR  43  -3.399   8.690  -3.280
  311   1HG2  THR  43          1HG2      THR  43  -0.368  10.904  -2.454
  312   2HG2  THR  43          2HG2      THR  43  -1.149  10.438  -3.966
  313   3HG2  THR  43          3HG2      THR  43  -0.025   9.333  -3.174
  314    H    TYR  44           H        TYR  44  -3.582  10.031   0.118
  315    HA   TYR  44           HA       TYR  44  -4.464   7.725   1.567
  316   1HB   TYR  44          1HB       TYR  44  -5.417  10.509   1.284
  317   2HB   TYR  44          2HB       TYR  44  -6.579   9.298   1.830
  318    HD1  TYR  44           HD1      TYR  44  -6.116  11.329   3.751
  319    HD2  TYR  44           HD2      TYR  44  -3.644   7.970   2.897
  320    HE1  TYR  44           HE1      TYR  44  -5.185  11.437   6.024
  321    HE2  TYR  44           HE2      TYR  44  -2.712   8.070   5.158
  322    HH   TYR  44           HH       TYR  44  -3.190   8.915   7.313
  323    H    ASN  45           H        ASN  45  -5.862   9.572  -1.159
  324    HA   ASN  45           HA       ASN  45  -7.607   7.310  -1.682
  325   1HB   ASN  45          1HB       ASN  45  -8.326   9.737  -1.971
  326   2HB   ASN  45          2HB       ASN  45  -7.308   9.785  -3.395
  327   1HD2  ASN  45          1HD2      ASN  45  -8.145   6.853  -3.864
  328   2HD2  ASN  45          2HD2      ASN  45  -9.677   7.082  -4.546
  329    H    PHE  46           H        PHE  46  -6.499   5.625  -2.460
  330    HA   PHE  46           HA       PHE  46  -4.140   5.742  -3.987
  331   1HB   PHE  46          1HB       PHE  46  -4.796   3.794  -2.646
  332   2HB   PHE  46          2HB       PHE  46  -6.152   3.476  -3.746
  333    HD1  PHE  46           HD1      PHE  46  -2.422   3.992  -3.907
  334    HD2  PHE  46           HD2      PHE  46  -5.807   1.818  -5.315
  335    HE1  PHE  46           HE1      PHE  46  -0.957   2.594  -5.290
  336    HE2  PHE  46           HE2      PHE  46  -4.342   0.427  -6.697
  337    HZ   PHE  46           HZ       PHE  46  -1.910   0.809  -6.687
  338    H    GLU  47           H        GLU  47  -7.490   5.639  -4.935
  339    HA   GLU  47           HA       GLU  47  -7.284   4.857  -7.588
  340   1HB   GLU  47          1HB       GLU  47  -9.367   5.129  -6.220
  341   2HB   GLU  47          2HB       GLU  47  -9.240   6.862  -6.473
  342   1HG   GLU  47          1HG       GLU  47  -9.395   6.484  -8.905
  343   2HG   GLU  47          2HG       GLU  47  -9.621   4.762  -8.591
  344    H    LYS  48           H        LYS  48  -7.308   8.185  -6.296
  345    HA   LYS  48           HA       LYS  48  -7.073   9.412  -8.824
  346   1HB   LYS  48          1HB       LYS  48  -6.716  11.487  -7.645
  347   2HB   LYS  48          2HB       LYS  48  -8.006  10.573  -6.884
  348   1HG   LYS  48          1HG       LYS  48  -6.501   9.887  -5.102
  349   2HG   LYS  48          2HG       LYS  48  -5.165  10.732  -5.890
  350   1HD   LYS  48          1HD       LYS  48  -7.693  12.027  -4.848
  351   2HD   LYS  48          2HD       LYS  48  -6.120  12.050  -4.048
  352   1HE   LYS  48          1HE       LYS  48  -6.731  13.208  -6.769
  353   2HE   LYS  48          2HE       LYS  48  -6.573  14.130  -5.273
  354   1HZ   LYS  48          1HZ       LYS  48  -4.569  13.620  -7.012
  355   2HZ   LYS  48          2HZ       LYS  48  -4.301  12.436  -5.826
  356   3HZ   LYS  48          3HZ       LYS  48  -4.360  14.076  -5.393
  357    H    ASP  49           H        ASP  49  -4.555   8.393  -6.545
  358    HA   ASP  49           HA       ASP  49  -2.584   9.678  -8.282
  359   1HB   ASP  49          1HB       ASP  49  -2.470   8.709  -5.451
  360   2HB   ASP  49          2HB       ASP  49  -0.982   8.957  -6.360
  361    H    GLY  50           H        GLY  50  -2.694   6.573  -6.514
  362   1HA   GLY  50          1HA       GLY  50  -2.480   4.461  -7.560
  363   2HA   GLY  50          2HA       GLY  50  -1.817   5.265  -8.971
  364    H    LYS  51           H        LYS  51  -0.487   6.401  -6.075
  365    HA   LYS  51           HA       LYS  51   2.053   5.167  -6.659
  366   1HB   LYS  51          1HB       LYS  51   1.168   7.141  -4.582
  367   2HB   LYS  51          2HB       LYS  51   2.816   6.546  -4.702
  368   1HG   LYS  51          1HG       LYS  51   3.263   7.793  -6.511
  369   2HG   LYS  51          2HG       LYS  51   1.646   7.574  -7.186
  370   1HD   LYS  51          1HD       LYS  51   0.757   9.167  -5.609
  371   2HD   LYS  51          2HD       LYS  51   2.355   9.372  -4.890
  372   1HE   LYS  51          1HE       LYS  51   3.214  10.325  -6.924
  373   2HE   LYS  51          2HE       LYS  51   1.712   9.965  -7.780
  374   1HZ   LYS  51          1HZ       LYS  51   2.085  11.924  -5.572
  375   2HZ   LYS  51          2HZ       LYS  51   0.570  11.507  -6.234
  376   3HZ   LYS  51          3HZ       LYS  51   1.744  12.268  -7.198
  377    H    TYR  52           H        TYR  52   2.726   3.275  -5.757
  378    HA   TYR  52           HA       TYR  52   1.694   2.539  -3.128
  379   1HB   TYR  52          1HB       TYR  52   0.858   0.425  -3.829
  380   2HB   TYR  52          2HB       TYR  52   0.184   1.608  -4.944
  381    HD1  TYR  52           HD1      TYR  52   1.844   2.038  -7.069
  382    HD2  TYR  52           HD2      TYR  52   1.600  -1.525  -4.760
  383    HE1  TYR  52           HE1      TYR  52   2.784   0.765  -8.949
  384    HE2  TYR  52           HE2      TYR  52   2.536  -2.810  -6.631
  385    HH   TYR  52           HH       TYR  52   4.154  -1.571  -9.097
  386    H    GLY  53           H        GLY  53   2.621   0.364  -2.487
  387   1HA   GLY  53          1HA       GLY  53   5.110  -0.469  -3.599
  388   2HA   GLY  53          2HA       GLY  53   5.328   0.474  -2.134
  389    H    PHE  54           H        PHE  54   6.007  -2.286  -2.423
  390    HA   PHE  54           HA       PHE  54   3.912  -3.733  -1.037
  391   1HB   PHE  54          1HB       PHE  54   6.619  -4.589  -2.025
  392   2HB   PHE  54          2HB       PHE  54   5.495  -5.661  -1.205
  393    HD1  PHE  54           HD1      PHE  54   6.384  -6.524  -3.742
  394    HD2  PHE  54           HD2      PHE  54   3.301  -3.734  -2.842
  395    HE1  PHE  54           HE1      PHE  54   5.302  -7.030  -5.892
  396    HE2  PHE  54           HE2      PHE  54   2.211  -4.231  -4.986
  397    HZ   PHE  54           HZ       PHE  54   3.211  -5.887  -6.521
  398    H    CYS  55           H        CYS  55   4.224  -4.775   0.975
  399    HA   CYS  55           HA       CYS  55   6.061  -3.286   2.712
  400   1HB   CYS  55          1HB       CYS  55   3.667  -4.965   3.480
  401   2HB   CYS  55          2HB       CYS  55   4.588  -3.895   4.539
  402    HA   PRO  56           HA       PRO  56   8.641  -6.841   3.081
  403   1HB   PRO  56          1HB       PRO  56   9.598  -6.391   5.606
  404   2HB   PRO  56          2HB       PRO  56  10.234  -5.639   4.142
  405   1HG   PRO  56          1HG       PRO  56   8.333  -4.533   6.176
  406   2HG   PRO  56          2HG       PRO  56   9.653  -3.722   5.309
  407   1HD   PRO  56          1HD       PRO  56   7.070  -3.402   4.605
  408   2HD   PRO  56          2HD       PRO  56   8.377  -3.420   3.401
  409    H    HIS  57           H        HIS  57   7.321  -8.614   3.172
  410    HA   HIS  57           HA       HIS  57   6.236  -9.299   5.816
  411   1HB   HIS  57          1HB       HIS  57   4.840 -10.993   4.436
  412   2HB   HIS  57          2HB       HIS  57   4.382  -9.296   4.414
  413    HD1  HIS  57           HD1      HIS  57   6.574 -11.577   2.255
  414    HD2  HIS  57           HD2      HIS  57   3.852  -8.451   1.926
  415    HE1  HIS  57           HE1      HIS  57   6.283 -11.186  -0.215
  416    H    GLU  58           H        GLU  58   8.964  -9.663   4.715
  417    HA   GLU  58           HA       GLU  58   9.195 -12.579   4.844
  418   1HB   GLU  58          1HB       GLU  58  11.504 -12.248   3.992
  419   2HB   GLU  58          2HB       GLU  58  10.275 -11.668   2.883
  420   1HG   GLU  58          1HG       GLU  58  10.728  -9.374   3.554
  421   2HG   GLU  58          2HG       GLU  58  11.904  -9.940   4.741
  422    H    ALA  59           H        ALA  59   8.588 -11.241   7.191
  423    HA   ALA  59           HA       ALA  59  10.968 -10.709   8.711
  424   1HB   ALA  59          1HB       ALA  59   8.562  -9.771   9.038
  425   2HB   ALA  59          2HB       ALA  59   9.570 -10.109  10.448
  426   3HB   ALA  59          3HB       ALA  59   8.313 -11.249   9.967
  Start of MODEL    9
    1   1H    ARG   1          1H        ARG   1  13.392   2.604  10.302
    2   2H    ARG   1          2H        ARG   1  14.031   2.895   8.738
    3   3H    ARG   1          3H        ARG   1  13.841   1.282   9.302
    4    HA   ARG   1           HA       ARG   1  11.486   1.532   9.342
    5   1HB   ARG   1          1HB       ARG   1  11.743   4.064   9.785
    6   2HB   ARG   1          2HB       ARG   1  11.939   4.231   8.046
    7   1HG   ARG   1          1HG       ARG   1   9.696   3.132   7.787
    8   2HG   ARG   1          2HG       ARG   1   9.514   3.242   9.540
    9   1HD   ARG   1          1HD       ARG   1   8.406   5.127   8.530
   10   2HD   ARG   1          2HD       ARG   1   9.849   5.701   9.368
   11    HE   ARG   1           HE       ARG   1  10.494   5.184   6.675
   12   1HH1  ARG   1          1HH1      ARG   1   8.603   7.428   8.583
   13   2HH1  ARG   1          2HH1      ARG   1   8.796   8.736   7.454
   14   1HH2  ARG   1          1HH2      ARG   1  10.710   6.886   5.181
   15   2HH2  ARG   1          2HH2      ARG   1   9.996   8.430   5.523
   16    H    ILE   2           H        ILE   2  10.458   0.680   7.526
   17    HA   ILE   2           HA       ILE   2  11.318   1.225   4.859
   18    HB   ILE   2           HB       ILE   2  13.210  -0.167   5.551
   19   1HG1  ILE   2          1HG1      ILE   2  12.996  -1.976   3.806
   20   2HG1  ILE   2          2HG1      ILE   2  11.312  -1.500   3.617
   21   1HG2  ILE   2          1HG2      ILE   2  11.167  -1.694   6.835
   22   2HG2  ILE   2          2HG2      ILE   2  12.924  -1.820   7.000
   23   3HG2  ILE   2          3HG2      ILE   2  12.088  -2.745   5.750
   24   1HD1  ILE   2          1HD1      ILE   2  12.688   0.874   3.329
   25   2HD1  ILE   2          2HD1      ILE   2  12.024  -0.123   2.033
   26   3HD1  ILE   2          3HD1      ILE   2  13.710  -0.311   2.517
   27    HA   PRO   3           HA       PRO   3   7.112  -0.743   5.440
   28   1HB   PRO   3          1HB       PRO   3   5.922   1.840   4.820
   29   2HB   PRO   3          2HB       PRO   3   5.779   0.880   6.296
   30   1HG   PRO   3          1HG       PRO   3   7.109   3.220   6.270
   31   2HG   PRO   3          2HG       PRO   3   7.612   1.863   7.293
   32   1HD   PRO   3          1HD       PRO   3   8.693   2.652   4.586
   33   2HD   PRO   3          2HD       PRO   3   9.588   2.323   6.091
   34    H    VAL   4           H        VAL   4   8.510   1.276   2.968
   35    HA   VAL   4           HA       VAL   4   6.907  -0.184   0.972
   36    HB   VAL   4           HB       VAL   4   7.688   2.738   0.611
   37   1HG1  VAL   4          1HG1      VAL   4   7.197   1.008  -1.310
   38   2HG1  VAL   4          2HG1      VAL   4   6.594   2.665  -1.389
   39   3HG1  VAL   4          3HG1      VAL   4   5.522   1.359  -0.884
   40   1HG2  VAL   4          1HG2      VAL   4   5.323   1.571   1.927
   41   2HG2  VAL   4          2HG2      VAL   4   4.990   2.801   0.707
   42   3HG2  VAL   4          3HG2      VAL   4   6.035   3.174   2.082
   43    H    LYS   5           H        LYS   5   8.041  -0.832  -0.848
   44    HA   LYS   5           HA       LYS   5  10.763   0.147  -1.207
   45   1HB   LYS   5          1HB       LYS   5  10.542  -2.066   0.277
   46   2HB   LYS   5          2HB       LYS   5  10.456  -2.817  -1.308
   47   1HG   LYS   5          1HG       LYS   5  12.691  -1.005  -0.395
   48   2HG   LYS   5          2HG       LYS   5  12.738  -2.770  -0.353
   49   1HD   LYS   5          1HD       LYS   5  12.716  -2.939  -2.693
   50   2HD   LYS   5          2HD       LYS   5  12.179  -1.271  -2.895
   51   1HE   LYS   5          1HE       LYS   5  14.869  -2.129  -1.828
   52   2HE   LYS   5          2HE       LYS   5  14.553  -1.560  -3.470
   53   1HZ   LYS   5          1HZ       LYS   5  15.217   0.370  -2.492
   54   2HZ   LYS   5          2HZ       LYS   5  14.628  -0.049  -0.955
   55   3HZ   LYS   5          3HZ       LYS   5  13.552   0.469  -2.167
   56    H    TYR   6           H        TYR   6   8.924  -2.651  -2.421
   57    HA   TYR   6           HA       TYR   6   9.662  -2.041  -5.126
   58   1HB   TYR   6          1HB       TYR   6   7.589  -4.053  -4.260
   59   2HB   TYR   6          2HB       TYR   6   8.572  -4.063  -5.720
   60    HD1  TYR   6           HD1      TYR   6  11.274  -3.909  -5.048
   61    HD2  TYR   6           HD2      TYR   6   8.175  -5.707  -2.745
   62    HE1  TYR   6           HE1      TYR   6  12.927  -5.328  -3.928
   63    HE2  TYR   6           HE2      TYR   6   9.823  -7.122  -1.620
   64    HH   TYR   6           HH       TYR   6  13.259  -6.680  -2.063
   65    H    GLY   7           H        GLY   7   8.094  -1.824  -6.880
   66   1HA   GLY   7          1HA       GLY   7   5.838  -1.265  -7.597
   67   2HA   GLY   7          2HA       GLY   7   5.606  -0.428  -6.076
   68    H    ASN   8           H        ASN   8   5.022   1.494  -7.250
   69    HA   ASN   8           HA       ASN   8   7.217   2.661  -8.785
   70   1HB   ASN   8          1HB       ASN   8   5.681   4.180  -9.783
   71   2HB   ASN   8          2HB       ASN   8   4.929   2.594  -9.802
   72   1HD2  ASN   8          1HD2      ASN   8   3.728   5.187 -10.041
   73   2HD2  ASN   8          2HD2      ASN   8   2.576   5.313  -8.764
   74    H    ALA   9           H        ALA   9   6.246   2.669  -5.673
   75    HA   ALA   9           HA       ALA   9   6.760   5.437  -5.050
   76   1HB   ALA   9          1HB       ALA   9   6.750   3.255  -3.018
   77   2HB   ALA   9          2HB       ALA   9   5.238   3.796  -3.750
   78   3HB   ALA   9          3HB       ALA   9   6.240   4.937  -2.853
   79    H    ASP  10           H        ASP  10   8.670   6.263  -4.283
   80    HA   ASP  10           HA       ASP  10  11.044   4.883  -4.955
   81   1HB   ASP  10          1HB       ASP  10  10.654   7.422  -3.364
   82   2HB   ASP  10          2HB       ASP  10  12.217   6.817  -3.912
   83    H    GLY  11           H        GLY  11   9.295   5.262  -1.960
   84   1HA   GLY  11          1HA       GLY  11   9.918   3.172  -0.549
   85   2HA   GLY  11          2HA       GLY  11  11.495   3.947  -0.521
   86    H    GLU  12           H        GLU  12   8.240   5.333  -0.217
   87    HA   GLU  12           HA       GLU  12   9.061   6.883   2.069
   88   1HB   GLU  12          1HB       GLU  12   6.455   6.597   0.575
   89   2HB   GLU  12          2HB       GLU  12   6.578   7.537   2.055
   90   1HG   GLU  12          1HG       GLU  12   6.743   9.078   0.305
   91   2HG   GLU  12          2HG       GLU  12   8.386   8.875   0.901
   92    H    TYR  13           H        TYR  13   6.599   6.814   3.531
   93    HA   TYR  13           HA       TYR  13   6.732   4.138   4.661
   94   1HB   TYR  13          1HB       TYR  13   7.617   5.342   6.377
   95   2HB   TYR  13          2HB       TYR  13   6.955   6.847   5.759
   96    HD1  TYR  13           HD1      TYR  13   5.772   3.704   7.362
   97    HD2  TYR  13           HD2      TYR  13   5.395   7.904   6.947
   98    HE1  TYR  13           HE1      TYR  13   4.050   3.705   9.075
   99    HE2  TYR  13           HE2      TYR  13   3.674   7.943   8.659
  100    HH   TYR  13           HH       TYR  13   1.921   6.040   9.587
  101    H    CYS  14           H        CYS  14   4.804   3.106   4.888
  102    HA   CYS  14           HA       CYS  14   2.615   3.648   3.392
  103   1HB   CYS  14          1HB       CYS  14   2.713   2.228   6.050
  104   2HB   CYS  14          2HB       CYS  14   1.342   2.171   4.950
  105    H    LYS  15           H        LYS  15   0.927   4.979   3.414
  106    HA   LYS  15           HA       LYS  15   0.664   6.826   5.650
  107   1HB   LYS  15          1HB       LYS  15   0.622   7.710   3.321
  108   2HB   LYS  15          2HB       LYS  15  -0.860   6.805   3.034
  109   1HG   LYS  15          1HG       LYS  15  -2.058   8.102   4.649
  110   2HG   LYS  15          2HG       LYS  15  -0.574   8.907   5.171
  111   1HD   LYS  15          1HD       LYS  15  -0.360   9.941   2.967
  112   2HD   LYS  15          2HD       LYS  15  -1.834   9.117   2.440
  113   1HE   LYS  15          1HE       LYS  15  -3.140  10.309   4.094
  114   2HE   LYS  15          2HE       LYS  15  -1.684  11.066   4.744
  115   1HZ   LYS  15          1HZ       LYS  15  -1.748  12.628   3.189
  116   2HZ   LYS  15          2HZ       LYS  15  -3.315  12.091   2.812
  117   3HZ   LYS  15          3HZ       LYS  15  -1.985  11.517   1.927
  118    H    PHE  16           H        PHE  16  -0.465   6.097   7.294
  119    HA   PHE  16           HA       PHE  16  -2.878   4.492   6.776
  120   1HB   PHE  16          1HB       PHE  16  -1.070   4.615   9.200
  121   2HB   PHE  16          2HB       PHE  16  -2.587   3.723   9.155
  122    HD1  PHE  16           HD1      PHE  16   0.095   2.529   9.758
  123    HD2  PHE  16           HD2      PHE  16  -2.018   2.995   6.097
  124    HE1  PHE  16           HE1      PHE  16   1.285   0.596   8.835
  125    HE2  PHE  16           HE2      PHE  16  -0.840   1.064   5.160
  126    HZ   PHE  16           HZ       PHE  16   0.839  -0.156   6.516
  127    HA   PRO  17           HA       PRO  17  -4.580   4.095   7.051
  128   1HB   PRO  17          1HB       PRO  17  -7.210   4.878   6.699
  129   2HB   PRO  17          2HB       PRO  17  -6.586   4.008   8.102
  130   1HG   PRO  17          1HG       PRO  17  -7.583   6.699   8.007
  131   2HG   PRO  17          2HG       PRO  17  -6.955   5.819   9.408
  132   1HD   PRO  17          1HD       PRO  17  -5.631   7.816   7.684
  133   2HD   PRO  17          2HD       PRO  17  -5.245   7.325   9.348
  134    H    PHE  18           H        PHE  18  -4.925   3.585   4.888
  135    HA   PHE  18           HA       PHE  18  -4.992   5.900   3.087
  136   1HB   PHE  18          1HB       PHE  18  -3.914   4.564   1.409
  137   2HB   PHE  18          2HB       PHE  18  -3.003   4.427   2.901
  138    HD1  PHE  18           HD1      PHE  18  -5.385   2.665   0.690
  139    HD2  PHE  18           HD2      PHE  18  -2.580   2.344   3.868
  140    HE1  PHE  18           HE1      PHE  18  -5.432   0.227   0.467
  141    HE2  PHE  18           HE2      PHE  18  -2.623  -0.110   3.658
  142    HZ   PHE  18           HZ       PHE  18  -4.047  -1.186   1.950
  143    H    LEU  19           H        LEU  19  -6.211   5.625   1.052
  144    HA   LEU  19           HA       LEU  19  -8.730   4.248   1.653
  145   1HB   LEU  19          1HB       LEU  19  -8.622   6.747   1.234
  146   2HB   LEU  19          2HB       LEU  19  -8.256   6.363  -0.436
  147    HG   LEU  19           HG       LEU  19 -10.428   5.142  -0.577
  148   1HD1  LEU  19          1HD1      LEU  19 -11.695   6.441   1.639
  149   2HD1  LEU  19          2HD1      LEU  19 -10.357   5.447   2.220
  150   3HD1  LEU  19          3HD1      LEU  19 -11.633   4.726   1.238
  151   1HD2  LEU  19          1HD2      LEU  19 -10.867   7.114  -1.540
  152   2HD2  LEU  19          2HD2      LEU  19 -10.013   8.020  -0.293
  153   3HD2  LEU  19          3HD2      LEU  19 -11.683   7.525  -0.028
  154    H    PHE  20           H        PHE  20  -9.237   2.472   0.628
  155    HA   PHE  20           HA       PHE  20  -8.197   1.997  -2.099
  156   1HB   PHE  20          1HB       PHE  20  -7.176   0.532  -0.239
  157   2HB   PHE  20          2HB       PHE  20  -8.786  -0.163  -0.095
  158    HD1  PHE  20           HD1      PHE  20  -7.760  -2.297  -0.499
  159    HD2  PHE  20           HD2      PHE  20  -7.778   0.764  -3.452
  160    HE1  PHE  20           HE1      PHE  20  -7.268  -3.984  -2.212
  161    HE2  PHE  20           HE2      PHE  20  -7.293  -0.924  -5.183
  162    HZ   PHE  20           HZ       PHE  20  -7.042  -3.294  -4.572
  163    H    ASN  21           H        ASN  21  -9.976   2.344  -3.331
  164    HA   ASN  21           HA       ASN  21 -12.085   2.188  -4.178
  165   1HB   ASN  21          1HB       ASN  21 -11.952  -0.473  -2.755
  166   2HB   ASN  21          2HB       ASN  21 -13.252  -0.016  -3.846
  167   1HD2  ASN  21          1HD2      ASN  21 -10.615  -1.822  -3.699
  168   2HD2  ASN  21          2HD2      ASN  21 -10.057  -1.728  -5.332
  169    H    GLY  22           H        GLY  22 -11.736   3.363  -1.437
  170   1HA   GLY  22          1HA       GLY  22 -13.466   4.596  -0.366
  171   2HA   GLY  22          2HA       GLY  22 -14.584   3.298  -0.736
  172    H    LYS  23           H        LYS  23 -11.795   1.881   0.410
  173    HA   LYS  23           HA       LYS  23 -12.885   1.905   3.159
  174   1HB   LYS  23          1HB       LYS  23 -13.087  -0.285   1.969
  175   2HB   LYS  23          2HB       LYS  23 -11.334  -0.333   1.835
  176   1HG   LYS  23          1HG       LYS  23 -11.192  -0.287   4.318
  177   2HG   LYS  23          2HG       LYS  23 -12.954  -0.387   4.384
  178   1HD   LYS  23          1HD       LYS  23 -11.068  -2.414   3.186
  179   2HD   LYS  23          2HD       LYS  23 -11.965  -2.575   4.697
  180   1HE   LYS  23          1HE       LYS  23 -14.075  -2.475   3.438
  181   2HE   LYS  23          2HE       LYS  23 -13.152  -2.363   1.935
  182   1HZ   LYS  23          1HZ       LYS  23 -12.815  -4.543   1.923
  183   2HZ   LYS  23          2HZ       LYS  23 -13.966  -4.663   3.170
  184   3HZ   LYS  23          3HZ       LYS  23 -12.313  -4.563   3.551
  185    H    GLU  24           H        GLU  24 -11.526   2.384   4.822
  186    HA   GLU  24           HA       GLU  24  -8.831   3.233   4.078
  187   1HB   GLU  24          1HB       GLU  24 -10.318   3.577   6.682
  188   2HB   GLU  24          2HB       GLU  24  -8.799   4.344   6.248
  189   1HG   GLU  24          1HG       GLU  24  -9.927   5.572   4.481
  190   2HG   GLU  24          2HG       GLU  24 -11.448   4.781   4.893
  191    H    TYR  25           H        TYR  25  -7.011   2.208   4.707
  192    HA   TYR  25           HA       TYR  25  -7.330  -0.111   6.490
  193   1HB   TYR  25          1HB       TYR  25  -5.429   0.322   4.206
  194   2HB   TYR  25          2HB       TYR  25  -5.273  -1.017   5.326
  195    HD1  TYR  25           HD1      TYR  25  -7.581   0.541   2.889
  196    HD2  TYR  25           HD2      TYR  25  -6.477  -3.000   4.968
  197    HE1  TYR  25           HE1      TYR  25  -9.163  -0.749   1.501
  198    HE2  TYR  25           HE2      TYR  25  -8.053  -4.303   3.579
  199    HH   TYR  25           HH       TYR  25  -9.864  -2.805   0.940
  200    H    ASN  26           H        ASN  26  -6.127  -0.263   8.252
  201    HA   ASN  26           HA       ASN  26  -4.304   1.956   8.841
  202   1HB   ASN  26          1HB       ASN  26  -5.577  -0.124  10.638
  203   2HB   ASN  26          2HB       ASN  26  -4.360   1.016  11.193
  204   1HD2  ASN  26          1HD2      ASN  26  -6.514   2.202   8.809
  205   2HD2  ASN  26          2HD2      ASN  26  -7.522   3.128   9.867
  206    H    SER  27           H        SER  27  -3.956  -0.803   7.320
  207    HA   SER  27           HA       SER  27  -1.199  -1.100   8.099
  208   1HB   SER  27          1HB       SER  27  -1.481  -3.609   8.423
  209   2HB   SER  27          2HB       SER  27  -2.105  -2.593   9.726
  210    HG   SER  27           HG       SER  27  -3.778  -3.443   7.601
  211    H    CYS  28           H        CYS  28  -0.424  -3.287   6.790
  212    HA   CYS  28           HA       CYS  28  -0.951  -2.608   4.022
  213   1HB   CYS  28          1HB       CYS  28   0.785  -4.815   5.156
  214   2HB   CYS  28          2HB       CYS  28   0.806  -4.206   3.505
  215    H    THR  29           H        THR  29  -2.235  -3.740   2.654
  216    HA   THR  29           HA       THR  29  -3.407  -6.216   3.680
  217    HB   THR  29           HB       THR  29  -4.995  -4.332   3.715
  218    HG1  THR  29           HG1      THR  29  -6.092  -6.138   3.444
  219   1HG2  THR  29          1HG2      THR  29  -5.729  -3.160   1.874
  220   2HG2  THR  29          2HG2      THR  29  -5.081  -4.334   0.728
  221   3HG2  THR  29          3HG2      THR  29  -3.991  -3.248   1.590
  222    H    ASP  30           H        ASP  30  -4.117  -7.770   2.066
  223    HA   ASP  30           HA       ASP  30  -2.403  -7.683  -0.302
  224   1HB   ASP  30          1HB       ASP  30  -3.760 -10.190   0.168
  225   2HB   ASP  30          2HB       ASP  30  -2.079  -9.889  -0.166
  226    H    THR  31           H        THR  31  -5.239  -6.651   0.432
  227    HA   THR  31           HA       THR  31  -7.091  -7.907  -1.268
  228    HB   THR  31           HB       THR  31  -7.009  -5.016  -0.379
  229    HG1  THR  31           HG1      THR  31  -7.023  -6.120   1.479
  230   1HG2  THR  31          1HG2      THR  31  -8.726  -5.726  -2.161
  231   2HG2  THR  31          2HG2      THR  31  -9.286  -4.828  -0.751
  232   3HG2  THR  31          3HG2      THR  31  -9.522  -6.575  -0.836
  233    H    GLY  32           H        GLY  32  -7.630  -7.562  -3.406
  234   1HA   GLY  32          1HA       GLY  32  -7.551  -6.555  -5.515
  235   2HA   GLY  32          2HA       GLY  32  -6.345  -5.435  -4.898
  236    H    ARG  33           H        ARG  33  -4.968  -7.874  -3.725
  237    HA   ARG  33           HA       ARG  33  -3.431  -8.529  -6.129
  238   1HB   ARG  33          1HB       ARG  33  -2.699  -9.071  -3.248
  239   2HB   ARG  33          2HB       ARG  33  -1.635  -9.131  -4.642
  240   1HG   ARG  33          1HG       ARG  33  -2.945  -6.651  -3.543
  241   2HG   ARG  33          2HG       ARG  33  -1.266  -7.130  -3.285
  242   1HD   ARG  33          1HD       ARG  33  -2.529  -6.546  -5.970
  243   2HD   ARG  33          2HD       ARG  33  -1.520  -5.417  -5.059
  244    HE   ARG  33           HE       ARG  33  -0.249  -7.954  -5.567
  245   1HH1  ARG  33          1HH1      ARG  33  -0.898  -4.752  -6.832
  246   2HH1  ARG  33          2HH1      ARG  33   0.459  -4.768  -7.925
  247   1HH2  ARG  33          1HH2      ARG  33   1.463  -8.031  -7.061
  248   2HH2  ARG  33          2HH2      ARG  33   1.789  -6.659  -8.077
  249    H    SER  34           H        SER  34  -3.124 -10.653  -6.768
  250    HA   SER  34           HA       SER  34  -4.944 -12.585  -5.525
  251   1HB   SER  34          1HB       SER  34  -3.526 -12.815  -8.185
  252   2HB   SER  34          2HB       SER  34  -4.868 -13.801  -7.601
  253    HG   SER  34           HG       SER  34  -4.921 -11.019  -8.217
  254    H    ASP  35           H        ASP  35  -1.705 -11.759  -5.527
  255    HA   ASP  35           HA       ASP  35  -0.824 -14.485  -5.048
  256   1HB   ASP  35          1HB       ASP  35   0.595 -12.008  -5.810
  257   2HB   ASP  35          2HB       ASP  35   1.468 -13.376  -5.181
  258    H    GLY  36           H        GLY  36  -2.207 -12.491  -3.175
  259   1HA   GLY  36          1HA       GLY  36  -2.128 -11.966  -0.941
  260   2HA   GLY  36          2HA       GLY  36  -1.075 -13.360  -0.789
  261    H    PHE  37           H        PHE  37  -0.527 -10.262  -2.465
  262    HA   PHE  37           HA       PHE  37   1.916  -9.977  -0.866
  263   1HB   PHE  37          1HB       PHE  37   1.080  -8.943  -3.545
  264   2HB   PHE  37          2HB       PHE  37   2.299  -8.064  -2.632
  265    HD1  PHE  37           HD1      PHE  37   4.085  -9.851  -1.532
  266    HD2  PHE  37           HD2      PHE  37   1.920 -10.304  -5.172
  267    HE1  PHE  37           HE1      PHE  37   5.817 -11.392  -2.371
  268    HE2  PHE  37           HE2      PHE  37   3.645 -11.845  -6.013
  269    HZ   PHE  37           HZ       PHE  37   5.599 -12.393  -4.605
  270    H    LEU  38           H        LEU  38   1.995  -8.536   0.727
  271    HA   LEU  38           HA       LEU  38  -0.264  -6.837   1.227
  272   1HB   LEU  38          1HB       LEU  38   2.343  -7.012   2.692
  273   2HB   LEU  38          2HB       LEU  38   0.910  -6.189   3.261
  274    HG   LEU  38           HG       LEU  38  -0.122  -8.643   2.927
  275   1HD1  LEU  38          1HD1      LEU  38   1.506 -10.307   3.716
  276   2HD1  LEU  38          2HD1      LEU  38   2.789  -9.104   3.574
  277   3HD1  LEU  38          3HD1      LEU  38   1.928  -9.650   2.134
  278   1HD2  LEU  38          1HD2      LEU  38   1.395  -7.519   5.265
  279   2HD2  LEU  38          2HD2      LEU  38   0.455  -9.007   5.361
  280   3HD2  LEU  38          3HD2      LEU  38  -0.343  -7.486   4.964
  281    H    TRP  39           H        TRP  39  -0.481  -4.744   0.792
  282    HA   TRP  39           HA       TRP  39   1.917  -3.215   0.115
  283   1HB   TRP  39          1HB       TRP  39   0.881  -2.301  -1.904
  284   2HB   TRP  39          2HB       TRP  39   1.003  -4.050  -2.013
  285    HD1  TRP  39           HD1      TRP  39  -1.347  -5.452  -1.710
  286    HE1  TRP  39           HE1      TRP  39  -3.757  -4.764  -2.257
  287    HE3  TRP  39           HE3      TRP  39  -0.727  -0.365  -1.963
  288    HZ2  TRP  39           HZ2      TRP  39  -5.200  -2.391  -2.725
  289    HZ3  TRP  39           HZ3      TRP  39  -2.692   1.025  -2.472
  290    HH2  TRP  39           HH2      TRP  39  -4.877   0.023  -2.835
  291    H    CYS  40           H        CYS  40   1.312  -0.865  -0.236
  292    HA   CYS  40           HA       CYS  40  -1.019   0.123   1.166
  293   1HB   CYS  40          1HB       CYS  40   0.186   1.349   2.858
  294   2HB   CYS  40          2HB       CYS  40   0.654  -0.345   2.986
  295    H    SER  41           H        SER  41  -1.149   2.525   0.843
  296    HA   SER  41           HA       SER  41   0.418   3.258  -1.521
  297   1HB   SER  41          1HB       SER  41  -1.384   5.014  -1.847
  298   2HB   SER  41          2HB       SER  41  -1.918   3.347  -2.016
  299    HG   SER  41           HG       SER  41  -2.604   5.238  -0.139
  300    H    THR  42           H        THR  42   1.357   5.364  -1.675
  301    HA   THR  42           HA       THR  42   2.280   6.377   0.876
  302    HB   THR  42           HB       THR  42   2.855   7.406  -1.919
  303    HG1  THR  42           HG1      THR  42   4.902   6.078  -1.205
  304   1HG2  THR  42          1HG2      THR  42   4.021   7.977   0.747
  305   2HG2  THR  42          2HG2      THR  42   3.795   9.031  -0.648
  306   3HG2  THR  42          3HG2      THR  42   5.121   7.870  -0.629
  307    H    THR  43           H        THR  43  -0.139   6.964  -1.409
  308    HA   THR  43           HA       THR  43  -0.687   9.650  -0.359
  309    HB   THR  43           HB       THR  43  -2.183   9.804  -2.380
  310    HG1  THR  43           HG1      THR  43  -2.460   8.092  -3.540
  311   1HG2  THR  43          1HG2      THR  43   0.648   9.155  -3.132
  312   2HG2  THR  43          2HG2      THR  43   0.168  10.659  -2.347
  313   3HG2  THR  43          3HG2      THR  43  -0.471  10.253  -3.943
  314    H    TYR  44           H        TYR  44  -3.291   9.986  -0.640
  315    HA   TYR  44           HA       TYR  44  -4.393   8.136   1.289
  316   1HB   TYR  44          1HB       TYR  44  -4.730  10.648   1.357
  317   2HB   TYR  44          2HB       TYR  44  -5.802  10.462  -0.031
  318    HD1  TYR  44           HD1      TYR  44  -5.311   8.986   3.390
  319    HD2  TYR  44           HD2      TYR  44  -8.086  10.284   0.429
  320    HE1  TYR  44           HE1      TYR  44  -7.168   8.509   4.927
  321    HE2  TYR  44           HE2      TYR  44  -9.948   9.808   1.964
  322    HH   TYR  44           HH       TYR  44 -10.063   7.993   4.238
  323    H    ASN  45           H        ASN  45  -5.669   9.453  -1.772
  324    HA   ASN  45           HA       ASN  45  -7.311   7.081  -2.081
  325   1HB   ASN  45          1HB       ASN  45  -8.075   9.455  -2.601
  326   2HB   ASN  45          2HB       ASN  45  -7.045   9.390  -4.012
  327   1HD2  ASN  45          1HD2      ASN  45  -7.871   6.419  -4.241
  328   2HD2  ASN  45          2HD2      ASN  45  -9.404   6.594  -4.951
  329    H    PHE  46           H        PHE  46  -6.365   5.300  -2.908
  330    HA   PHE  46           HA       PHE  46  -3.946   5.296  -4.349
  331   1HB   PHE  46          1HB       PHE  46  -4.761   3.355  -3.070
  332   2HB   PHE  46          2HB       PHE  46  -6.079   3.142  -4.247
  333    HD1  PHE  46           HD1      PHE  46  -5.449   0.919  -4.925
  334    HD2  PHE  46           HD2      PHE  46  -2.603   4.082  -5.164
  335    HE1  PHE  46           HE1      PHE  46  -3.976  -0.505  -6.277
  336    HE2  PHE  46           HE2      PHE  46  -1.137   2.665  -6.516
  337    HZ   PHE  46           HZ       PHE  46  -1.820   0.357  -7.072
  338    H    GLU  47           H        GLU  47  -7.285   4.804  -5.487
  339    HA   GLU  47           HA       GLU  47  -6.752   4.344  -8.173
  340   1HB   GLU  47          1HB       GLU  47  -8.954   4.156  -6.910
  341   2HB   GLU  47          2HB       GLU  47  -9.139   5.878  -7.167
  342   1HG   GLU  47          1HG       GLU  47  -9.201   5.592  -9.538
  343   2HG   GLU  47          2HG       GLU  47  -8.810   3.879  -9.386
  344    H    LYS  48           H        LYS  48  -7.239   7.409  -6.504
  345    HA   LYS  48           HA       LYS  48  -7.184   9.014  -8.826
  346   1HB   LYS  48          1HB       LYS  48  -8.224  10.122  -7.116
  347   2HB   LYS  48          2HB       LYS  48  -7.127   9.497  -5.894
  348   1HG   LYS  48          1HG       LYS  48  -5.405  11.085  -6.655
  349   2HG   LYS  48          2HG       LYS  48  -6.537  11.740  -7.837
  350   1HD   LYS  48          1HD       LYS  48  -8.009  12.497  -6.106
  351   2HD   LYS  48          2HD       LYS  48  -7.049  11.679  -4.872
  352   1HE   LYS  48          1HE       LYS  48  -6.068  13.937  -6.618
  353   2HE   LYS  48          2HE       LYS  48  -6.659  14.118  -4.968
  354   1HZ   LYS  48          1HZ       LYS  48  -4.593  12.122  -5.229
  355   2HZ   LYS  48          2HZ       LYS  48  -4.735  13.405  -4.124
  356   3HZ   LYS  48          3HZ       LYS  48  -4.080  13.682  -5.668
  357    H    ASP  49           H        ASP  49  -4.644   8.489  -6.339
  358    HA   ASP  49           HA       ASP  49  -2.757   9.996  -7.926
  359   1HB   ASP  49          1HB       ASP  49  -2.406   8.486  -5.331
  360   2HB   ASP  49          2HB       ASP  49  -1.154   9.458  -6.095
  361    H    GLY  50           H        GLY  50  -2.859   6.624  -6.764
  362   1HA   GLY  50          1HA       GLY  50  -2.340   4.756  -8.102
  363   2HA   GLY  50          2HA       GLY  50  -1.527   5.831  -9.224
  364    H    LYS  51           H        LYS  51  -0.520   6.661  -6.171
  365    HA   LYS  51           HA       LYS  51   2.028   5.339  -6.575
  366   1HB   LYS  51          1HB       LYS  51   1.055   7.411  -4.631
  367   2HB   LYS  51          2HB       LYS  51   2.593   6.607  -4.398
  368   1HG   LYS  51          1HG       LYS  51   3.096   8.610  -5.471
  369   2HG   LYS  51          2HG       LYS  51   3.184   7.374  -6.727
  370   1HD   LYS  51          1HD       LYS  51   0.907   8.007  -7.451
  371   2HD   LYS  51          2HD       LYS  51   0.901   9.295  -6.243
  372   1HE   LYS  51          1HE       LYS  51   2.929  10.242  -7.335
  373   2HE   LYS  51          2HE       LYS  51   2.770   9.029  -8.600
  374   1HZ   LYS  51          1HZ       LYS  51   1.807  11.313  -9.042
  375   2HZ   LYS  51          2HZ       LYS  51   0.575  10.907  -7.951
  376   3HZ   LYS  51          3HZ       LYS  51   0.794   9.985  -9.369
  377    H    TYR  52           H        TYR  52   2.557   3.443  -5.699
  378    HA   TYR  52           HA       TYR  52   1.489   2.697  -3.097
  379   1HB   TYR  52          1HB       TYR  52   0.598   0.591  -3.854
  380   2HB   TYR  52          2HB       TYR  52  -0.114   1.855  -4.854
  381    HD1  TYR  52           HD1      TYR  52   2.212  -0.974  -4.791
  382    HD2  TYR  52           HD2      TYR  52   0.468   2.059  -7.212
  383    HE1  TYR  52           HE1      TYR  52   3.026  -2.124  -6.804
  384    HE2  TYR  52           HE2      TYR  52   1.275   0.917  -9.229
  385    HH   TYR  52           HH       TYR  52   3.027  -0.649  -9.876
  386    H    GLY  53           H        GLY  53   2.425   0.485  -2.506
  387   1HA   GLY  53          1HA       GLY  53   4.788  -0.415  -3.759
  388   2HA   GLY  53          2HA       GLY  53   5.173   0.593  -2.376
  389    H    PHE  54           H        PHE  54   5.858  -2.107  -2.490
  390    HA   PHE  54           HA       PHE  54   3.842  -3.417  -0.861
  391   1HB   PHE  54          1HB       PHE  54   6.373  -4.541  -2.032
  392   2HB   PHE  54          2HB       PHE  54   5.136  -5.467  -1.196
  393    HD1  PHE  54           HD1      PHE  54   2.657  -4.857  -2.202
  394    HD2  PHE  54           HD2      PHE  54   6.349  -4.772  -4.308
  395    HE1  PHE  54           HE1      PHE  54   1.449  -5.138  -4.325
  396    HE2  PHE  54           HE2      PHE  54   5.153  -5.053  -6.433
  397    HZ   PHE  54           HZ       PHE  54   2.701  -5.237  -6.447
  398    H    CYS  55           H        CYS  55   4.141  -4.132   1.183
  399    HA   CYS  55           HA       CYS  55   6.137  -2.732   2.727
  400   1HB   CYS  55          1HB       CYS  55   4.124  -4.754   3.738
  401   2HB   CYS  55          2HB       CYS  55   4.921  -3.468   4.646
  402    HA   PRO  56           HA       PRO  56   8.789  -6.337   2.336
  403   1HB   PRO  56          1HB       PRO  56  10.923  -4.834   3.391
  404   2HB   PRO  56          2HB       PRO  56  10.643  -5.280   1.716
  405   1HG   PRO  56          1HG       PRO  56  10.531  -2.696   2.749
  406   2HG   PRO  56          2HG       PRO  56   9.849  -3.226   1.203
  407   1HD   PRO  56          1HD       PRO  56   8.509  -2.713   3.800
  408   2HD   PRO  56          2HD       PRO  56   7.888  -2.528   2.146
  409    H    HIS  57           H        HIS  57   8.382  -7.823   3.832
  410    HA   HIS  57           HA       HIS  57   8.688  -7.247   6.660
  411   1HB   HIS  57          1HB       HIS  57   6.930  -8.821   5.554
  412   2HB   HIS  57          2HB       HIS  57   8.247  -9.987   5.489
  413    HD1  HIS  57           HD1      HIS  57   9.489 -10.105   8.117
  414    HD2  HIS  57           HD2      HIS  57   5.436  -9.220   7.738
  415    HE1  HIS  57           HE1      HIS  57   8.458 -10.654  10.346
  416    H    GLU  58           H        GLU  58  10.174  -9.217   4.155
  417    HA   GLU  58           HA       GLU  58  12.701  -9.141   5.557
  418   1HB   GLU  58          1HB       GLU  58  12.984 -11.608   4.938
  419   2HB   GLU  58          2HB       GLU  58  12.001 -11.227   6.338
  420   1HG   GLU  58          1HG       GLU  58   9.985 -11.504   4.939
  421   2HG   GLU  58          2HG       GLU  58  11.020 -11.985   3.597
  422    H    ALA  59           H        ALA  59  13.909  -8.111   4.112
  423    HA   ALA  59           HA       ALA  59  14.225  -9.248   1.459
  424   1HB   ALA  59          1HB       ALA  59  14.061  -6.656   0.712
  425   2HB   ALA  59          2HB       ALA  59  12.813  -6.715   1.955
  426   3HB   ALA  59          3HB       ALA  59  12.734  -7.810   0.573
  Start of MODEL   10
    1   1H    ARG   1          1H        ARG   1  11.245  -0.310  11.621
    2   2H    ARG   1          2H        ARG   1  11.229   1.198  12.447
    3   3H    ARG   1          3H        ARG   1  12.055   1.044  10.945
    4    HA   ARG   1           HA       ARG   1   9.298   0.284  10.868
    5   1HB   ARG   1          1HB       ARG   1   9.674   2.350  12.495
    6   2HB   ARG   1          2HB       ARG   1   9.840   3.225  10.982
    7   1HG   ARG   1          1HG       ARG   1   7.448   1.549  11.708
    8   2HG   ARG   1          2HG       ARG   1   7.564   3.288  11.974
    9   1HD   ARG   1          1HD       ARG   1   7.750   1.902   9.301
   10   2HD   ARG   1          2HD       ARG   1   6.324   2.725   9.930
   11    HE   ARG   1           HE       ARG   1   8.553   3.923   8.663
   12   1HH1  ARG   1          1HH1      ARG   1   6.136   4.495  11.146
   13   2HH1  ARG   1          2HH1      ARG   1   6.329   6.224  11.084
   14   1HH2  ARG   1          1HH2      ARG   1   8.773   6.174   8.583
   15   2HH2  ARG   1          2HH2      ARG   1   7.808   7.171   9.629
   16    H    ILE   2           H        ILE   2   9.826  -0.506   8.845
   17    HA   ILE   2           HA       ILE   2  11.308   1.067   6.970
   18    HB   ILE   2           HB       ILE   2  10.701  -0.762   5.339
   19   1HG1  ILE   2          1HG1      ILE   2   9.314  -1.952   7.752
   20   2HG1  ILE   2          2HG1      ILE   2   8.528  -1.346   6.297
   21   1HG2  ILE   2          1HG2      ILE   2  12.741  -1.405   6.260
   22   2HG2  ILE   2          2HG2      ILE   2  11.738  -2.688   6.939
   23   3HG2  ILE   2          3HG2      ILE   2  12.132  -1.275   7.911
   24   1HD1  ILE   2          1HD1      ILE   2  10.559  -3.375   5.779
   25   2HD1  ILE   2          2HD1      ILE   2   8.910  -3.232   5.175
   26   3HD1  ILE   2          3HD1      ILE   2   9.215  -3.948   6.759
   27    HA   PRO   3           HA       PRO   3   7.947   3.058   4.976
   28   1HB   PRO   3          1HB       PRO   3   9.441   3.596   2.640
   29   2HB   PRO   3          2HB       PRO   3   9.354   4.595   4.089
   30   1HG   PRO   3          1HG       PRO   3  11.626   3.249   3.156
   31   2HG   PRO   3          2HG       PRO   3  11.412   3.937   4.776
   32   1HD   PRO   3          1HD       PRO   3  11.090   1.104   3.858
   33   2HD   PRO   3          2HD       PRO   3  11.725   1.732   5.398
   34    H    VAL   4           H        VAL   4   9.485   2.083   2.032
   35    HA   VAL   4           HA       VAL   4   7.396   0.099   1.428
   36    HB   VAL   4           HB       VAL   4   8.220   2.372  -0.434
   37   1HG1  VAL   4          1HG1      VAL   4   7.676   0.254  -1.588
   38   2HG1  VAL   4          2HG1      VAL   4   6.538   1.553  -1.953
   39   3HG1  VAL   4          3HG1      VAL   4   6.091   0.279  -0.820
   40   1HG2  VAL   4          1HG2      VAL   4   5.523   2.591  -0.084
   41   2HG2  VAL   4          2HG2      VAL   4   6.735   3.551   0.768
   42   3HG2  VAL   4          3HG2      VAL   4   6.058   2.108   1.526
   43    H    LYS   5           H        LYS   5   8.029  -1.413  -0.253
   44    HA   LYS   5           HA       LYS   5  10.950  -1.572  -0.459
   45   1HB   LYS   5          1HB       LYS   5   8.856  -3.536   0.056
   46   2HB   LYS   5          2HB       LYS   5   9.969  -4.051  -1.200
   47   1HG   LYS   5          1HG       LYS   5  10.707  -3.239   1.607
   48   2HG   LYS   5          2HG       LYS   5  10.658  -4.886   0.959
   49   1HD   LYS   5          1HD       LYS   5  12.452  -4.385  -0.582
   50   2HD   LYS   5          2HD       LYS   5  12.476  -2.698  -0.063
   51   1HE   LYS   5          1HE       LYS   5  13.160  -5.120   1.616
   52   2HE   LYS   5          2HE       LYS   5  14.290  -3.917   0.995
   53   1HZ   LYS   5          1HZ       LYS   5  13.975  -3.195   3.126
   54   2HZ   LYS   5          2HZ       LYS   5  12.352  -3.692   3.196
   55   3HZ   LYS   5          3HZ       LYS   5  12.777  -2.284   2.332
   56    H    TYR   6           H        TYR   6   8.644  -3.364  -2.393
   57    HA   TYR   6           HA       TYR   6   9.976  -2.411  -4.817
   58   1HB   TYR   6          1HB       TYR   6   7.923  -4.621  -4.584
   59   2HB   TYR   6          2HB       TYR   6   9.075  -4.355  -5.888
   60    HD1  TYR   6           HD1      TYR   6   8.513  -6.833  -3.977
   61    HD2  TYR   6           HD2      TYR   6  11.557  -3.858  -4.162
   62    HE1  TYR   6           HE1      TYR   6  10.070  -8.365  -2.872
   63    HE2  TYR   6           HE2      TYR   6  13.119  -5.389  -3.053
   64    HH   TYR   6           HH       TYR   6  12.156  -8.192  -1.471
   65    H    GLY   7           H        GLY   7   8.617  -2.016  -6.753
   66   1HA   GLY   7          1HA       GLY   7   6.325  -1.643  -7.531
   67   2HA   GLY   7          2HA       GLY   7   6.028  -0.771  -6.042
   68    H    ASN   8           H        ASN   8   5.357   1.018  -7.269
   69    HA   ASN   8           HA       ASN   8   7.539   2.428  -8.669
   70   1HB   ASN   8          1HB       ASN   8   5.911   3.462 -10.079
   71   2HB   ASN   8          2HB       ASN   8   5.561   1.736 -10.051
   72   1HD2  ASN   8          1HD2      ASN   8   3.788   3.921 -10.729
   73   2HD2  ASN   8          2HD2      ASN   8   2.489   3.870  -9.584
   74    H    ALA   9           H        ALA   9   6.154   2.475  -5.763
   75    HA   ALA   9           HA       ALA   9   5.345   5.157  -5.380
   76   1HB   ALA   9          1HB       ALA   9   6.113   2.926  -3.569
   77   2HB   ALA   9          2HB       ALA   9   4.574   3.774  -3.728
   78   3HB   ALA   9          3HB       ALA   9   5.937   4.557  -2.923
   79    H    ASP  10           H        ASP  10   6.394   6.911  -4.567
   80    HA   ASP  10           HA       ASP  10   9.009   7.367  -5.408
   81   1HB   ASP  10          1HB       ASP  10   8.751   9.408  -3.767
   82   2HB   ASP  10          2HB       ASP  10   7.795   9.312  -5.241
   83    H    GLY  11           H        GLY  11   8.075   7.600  -1.963
   84   1HA   GLY  11          1HA       GLY  11   9.942   5.737  -1.016
   85   2HA   GLY  11          2HA       GLY  11  10.728   7.303  -1.067
   86    H    GLU  12           H        GLU  12   7.307   6.972  -0.350
   87    HA   GLU  12           HA       GLU  12   7.803   8.160   2.263
   88   1HB   GLU  12          1HB       GLU  12   5.220   7.436   0.866
   89   2HB   GLU  12          2HB       GLU  12   5.317   8.190   2.445
   90   1HG   GLU  12          1HG       GLU  12   6.369   9.407  -0.094
   91   2HG   GLU  12          2HG       GLU  12   4.791   9.752   0.617
   92    H    TYR  13           H        TYR  13   6.279   7.248   4.068
   93    HA   TYR  13           HA       TYR  13   6.802   4.381   4.267
   94   1HB   TYR  13          1HB       TYR  13   7.431   4.951   6.344
   95   2HB   TYR  13          2HB       TYR  13   6.962   6.616   6.037
   96    HD1  TYR  13           HD1      TYR  13   5.651   3.338   7.178
   97    HD2  TYR  13           HD2      TYR  13   5.152   7.555   7.097
   98    HE1  TYR  13           HE1      TYR  13   3.839   3.151   8.816
   99    HE2  TYR  13           HE2      TYR  13   3.345   7.391   8.741
  100    HH   TYR  13           HH       TYR  13   2.824   4.931  10.672
  101    H    CYS  14           H        CYS  14   4.979   2.994   4.904
  102    HA   CYS  14           HA       CYS  14   2.727   3.201   3.440
  103   1HB   CYS  14          1HB       CYS  14   3.109   1.949   6.141
  104   2HB   CYS  14          2HB       CYS  14   1.582   1.827   5.277
  105    H    LYS  15           H        LYS  15   1.138   4.613   3.269
  106    HA   LYS  15           HA       LYS  15   0.677   6.594   5.305
  107   1HB   LYS  15          1HB       LYS  15   0.389   6.577   2.587
  108   2HB   LYS  15          2HB       LYS  15  -1.281   6.379   3.102
  109   1HG   LYS  15          1HG       LYS  15   0.569   8.608   3.954
  110   2HG   LYS  15          2HG       LYS  15  -0.690   8.730   2.727
  111   1HD   LYS  15          1HD       LYS  15  -2.388   8.231   4.415
  112   2HD   LYS  15          2HD       LYS  15  -1.129   8.085   5.645
  113   1HE   LYS  15          1HE       LYS  15  -0.495  10.440   5.222
  114   2HE   LYS  15          2HE       LYS  15  -1.815  10.569   4.064
  115   1HZ   LYS  15          1HZ       LYS  15  -2.555  11.468   6.129
  116   2HZ   LYS  15          2HZ       LYS  15  -2.048  10.099   6.998
  117   3HZ   LYS  15          3HZ       LYS  15  -3.353   9.986   5.920
  118    H    PHE  16           H        PHE  16  -0.339   5.970   7.071
  119    HA   PHE  16           HA       PHE  16  -2.682   4.219   6.796
  120   1HB   PHE  16          1HB       PHE  16  -0.751   4.601   9.090
  121   2HB   PHE  16          2HB       PHE  16  -2.254   3.685   9.223
  122    HD1  PHE  16           HD1      PHE  16   0.469   2.565   9.748
  123    HD2  PHE  16           HD2      PHE  16  -1.866   2.730   6.199
  124    HE1  PHE  16           HE1      PHE  16   1.604   0.555   8.913
  125    HE2  PHE  16           HE2      PHE  16  -0.742   0.731   5.351
  126    HZ   PHE  16           HZ       PHE  16   1.011  -0.387   6.698
  127    HA   PRO  17           HA       PRO  17  -4.338   3.959   6.826
  128   1HB   PRO  17          1HB       PRO  17  -6.977   4.660   6.474
  129   2HB   PRO  17          2HB       PRO  17  -6.343   3.824   7.894
  130   1HG   PRO  17          1HG       PRO  17  -7.411   6.491   7.736
  131   2HG   PRO  17          2HG       PRO  17  -6.810   5.637   9.166
  132   1HD   PRO  17          1HD       PRO  17  -5.458   7.636   7.456
  133   2HD   PRO  17          2HD       PRO  17  -5.124   7.174   9.140
  134    H    PHE  18           H        PHE  18  -4.988   3.531   4.642
  135    HA   PHE  18           HA       PHE  18  -5.000   5.931   2.949
  136   1HB   PHE  18          1HB       PHE  18  -3.914   4.712   1.166
  137   2HB   PHE  18          2HB       PHE  18  -2.942   4.593   2.625
  138    HD1  PHE  18           HD1      PHE  18  -3.286   2.420   4.037
  139    HD2  PHE  18           HD2      PHE  18  -4.385   2.835  -0.051
  140    HE1  PHE  18           HE1      PHE  18  -3.238  -0.023   3.773
  141    HE2  PHE  18           HE2      PHE  18  -4.343   0.396  -0.326
  142    HZ   PHE  18           HZ       PHE  18  -3.768  -1.057   1.597
  143    H    LEU  19           H        LEU  19  -6.405   6.016   1.208
  144    HA   LEU  19           HA       LEU  19  -8.822   4.501   1.633
  145   1HB   LEU  19          1HB       LEU  19  -8.885   6.926   1.234
  146   2HB   LEU  19          2HB       LEU  19  -8.202   6.680  -0.360
  147    HG   LEU  19           HG       LEU  19 -10.275   5.220  -0.813
  148   1HD1  LEU  19          1HD1      LEU  19 -11.599   6.886   1.268
  149   2HD1  LEU  19          2HD1      LEU  19 -10.815   5.376   1.739
  150   3HD1  LEU  19          3HD1      LEU  19 -12.110   5.361   0.543
  151   1HD2  LEU  19          1HD2      LEU  19 -10.266   7.129  -2.056
  152   2HD2  LEU  19          2HD2      LEU  19 -10.096   8.180  -0.652
  153   3HD2  LEU  19          3HD2      LEU  19 -11.661   7.461  -1.034
  154    H    PHE  20           H        PHE  20  -9.000   2.553   0.783
  155    HA   PHE  20           HA       PHE  20  -8.023   2.107  -1.969
  156   1HB   PHE  20          1HB       PHE  20  -7.108   0.594  -0.094
  157   2HB   PHE  20          2HB       PHE  20  -8.748  -0.041   0.014
  158    HD1  PHE  20           HD1      PHE  20  -7.667  -2.202  -0.389
  159    HD2  PHE  20           HD2      PHE  20  -7.782   0.865  -3.330
  160    HE1  PHE  20           HE1      PHE  20  -7.228  -3.883  -2.123
  161    HE2  PHE  20           HE2      PHE  20  -7.337  -0.815  -5.082
  162    HZ   PHE  20           HZ       PHE  20  -7.064  -3.186  -4.484
  163    H    ASN  21           H        ASN  21  -9.746   2.648  -3.181
  164    HA   ASN  21           HA       ASN  21 -11.823   2.665  -4.098
  165   1HB   ASN  21          1HB       ASN  21 -11.543  -0.189  -3.198
  166   2HB   ASN  21          2HB       ASN  21 -12.970   0.364  -4.068
  167   1HD2  ASN  21          1HD2      ASN  21 -12.856  -0.182  -6.113
  168   2HD2  ASN  21          2HD2      ASN  21 -11.444  -0.135  -7.110
  169    H    GLY  22           H        GLY  22 -11.744   3.504  -1.254
  170   1HA   GLY  22          1HA       GLY  22 -13.737   4.491  -0.307
  171   2HA   GLY  22          2HA       GLY  22 -14.593   3.023  -0.709
  172    H    LYS  23           H        LYS  23 -11.676   2.058   0.576
  173    HA   LYS  23           HA       LYS  23 -12.729   2.154   3.324
  174   1HB   LYS  23          1HB       LYS  23 -13.129  -0.088   2.311
  175   2HB   LYS  23          2HB       LYS  23 -11.398  -0.248   2.052
  176   1HG   LYS  23          1HG       LYS  23 -11.038  -0.108   4.479
  177   2HG   LYS  23          2HG       LYS  23 -12.783  -0.007   4.717
  178   1HD   LYS  23          1HD       LYS  23 -13.040  -2.204   3.633
  179   2HD   LYS  23          2HD       LYS  23 -11.283  -2.307   3.462
  180   1HE   LYS  23          1HE       LYS  23 -11.033  -2.190   5.887
  181   2HE   LYS  23          2HE       LYS  23 -12.783  -2.085   6.078
  182   1HZ   LYS  23          1HZ       LYS  23 -12.969  -4.273   5.904
  183   2HZ   LYS  23          2HZ       LYS  23 -11.283  -4.362   6.054
  184   3HZ   LYS  23          3HZ       LYS  23 -12.001  -4.341   4.510
  185    H    GLU  24           H        GLU  24 -11.303   2.698   4.868
  186    HA   GLU  24           HA       GLU  24  -8.578   3.314   4.026
  187   1HB   GLU  24          1HB       GLU  24  -9.980   3.975   6.623
  188   2HB   GLU  24          2HB       GLU  24  -8.424   4.591   6.108
  189   1HG   GLU  24          1HG       GLU  24  -9.679   6.359   5.524
  190   2HG   GLU  24          2HG       GLU  24  -9.912   5.412   4.055
  191    H    TYR  25           H        TYR  25  -6.919   2.053   4.503
  192    HA   TYR  25           HA       TYR  25  -7.315  -0.087   6.476
  193   1HB   TYR  25          1HB       TYR  25  -5.371   0.184   4.205
  194   2HB   TYR  25          2HB       TYR  25  -5.292  -1.118   5.376
  195    HD1  TYR  25           HD1      TYR  25  -7.450  -2.549   5.645
  196    HD2  TYR  25           HD2      TYR  25  -6.627  -0.044   2.311
  197    HE1  TYR  25           HE1      TYR  25  -9.102  -3.793   4.291
  198    HE2  TYR  25           HE2      TYR  25  -8.273  -1.279   0.947
  199    HH   TYR  25           HH       TYR  25 -10.177  -2.706   1.206
  200    H    ASN  26           H        ASN  26  -6.136  -0.229   8.264
  201    HA   ASN  26           HA       ASN  26  -4.288   1.948   8.858
  202   1HB   ASN  26          1HB       ASN  26  -5.456  -0.236  10.597
  203   2HB   ASN  26          2HB       ASN  26  -4.289   0.948  11.171
  204   1HD2  ASN  26          1HD2      ASN  26  -6.265   2.357   8.885
  205   2HD2  ASN  26          2HD2      ASN  26  -7.406   3.098   9.948
  206    H    SER  27           H        SER  27  -4.030  -0.993   7.442
  207    HA   SER  27           HA       SER  27  -1.195  -1.155   8.042
  208   1HB   SER  27          1HB       SER  27  -1.315  -3.590   8.549
  209   2HB   SER  27          2HB       SER  27  -2.108  -2.594   9.772
  210    HG   SER  27           HG       SER  27  -3.196  -4.598   8.760
  211    H    CYS  28           H        CYS  28  -0.516  -3.464   6.832
  212    HA   CYS  28           HA       CYS  28  -1.046  -2.864   4.051
  213   1HB   CYS  28          1HB       CYS  28   0.629  -5.083   5.249
  214   2HB   CYS  28          2HB       CYS  28   0.651  -4.545   3.573
  215    H    THR  29           H        THR  29  -2.413  -3.953   2.734
  216    HA   THR  29           HA       THR  29  -3.623  -6.412   3.763
  217    HB   THR  29           HB       THR  29  -5.221  -4.538   3.812
  218    HG1  THR  29           HG1      THR  29  -6.271  -6.380   3.437
  219   1HG2  THR  29          1HG2      THR  29  -5.820  -4.232   1.051
  220   2HG2  THR  29          2HG2      THR  29  -4.124  -3.819   1.301
  221   3HG2  THR  29          3HG2      THR  29  -5.382  -3.000   2.232
  222    H    ASP  30           H        ASP  30  -4.408  -7.921   2.052
  223    HA   ASP  30           HA       ASP  30  -2.613  -7.790  -0.244
  224   1HB   ASP  30          1HB       ASP  30  -4.025 -10.272  -0.036
  225   2HB   ASP  30          2HB       ASP  30  -2.319 -10.001  -0.159
  226    H    THR  31           H        THR  31  -5.446  -6.718   0.439
  227    HA   THR  31           HA       THR  31  -7.284  -7.829  -1.371
  228    HB   THR  31           HB       THR  31  -7.126  -4.986  -0.357
  229    HG1  THR  31           HG1      THR  31  -7.218  -6.191   1.450
  230   1HG2  THR  31          1HG2      THR  31  -8.833  -5.677  -2.213
  231   2HG2  THR  31          2HG2      THR  31  -9.330  -4.676  -0.849
  232   3HG2  THR  31          3HG2      THR  31  -9.689  -6.401  -0.855
  233    H    GLY  32           H        GLY  32  -7.650  -7.486  -3.497
  234   1HA   GLY  32          1HA       GLY  32  -7.495  -6.427  -5.566
  235   2HA   GLY  32          2HA       GLY  32  -6.363  -5.283  -4.867
  236    H    ARG  33           H        ARG  33  -4.899  -7.656  -3.697
  237    HA   ARG  33           HA       ARG  33  -3.253  -8.198  -6.052
  238   1HB   ARG  33          1HB       ARG  33  -2.709  -8.591  -3.103
  239   2HB   ARG  33          2HB       ARG  33  -1.570  -8.960  -4.381
  240   1HG   ARG  33          1HG       ARG  33  -2.650  -6.238  -3.699
  241   2HG   ARG  33          2HG       ARG  33  -1.047  -6.854  -3.300
  242   1HD   ARG  33          1HD       ARG  33  -2.154  -6.356  -6.068
  243   2HD   ARG  33          2HD       ARG  33  -0.944  -5.384  -5.232
  244    HE   ARG  33           HE       ARG  33  -0.178  -8.148  -5.567
  245   1HH1  ARG  33          1HH1      ARG  33  -0.096  -4.927  -6.886
  246   2HH1  ARG  33          2HH1      ARG  33   1.129  -5.283  -8.068
  247   1HH2  ARG  33          1HH2      ARG  33   1.515  -8.627  -7.043
  248   2HH2  ARG  33          2HH2      ARG  33   2.050  -7.408  -8.158
  249    H    SER  34           H        SER  34  -3.629 -10.056  -7.071
  250    HA   SER  34           HA       SER  34  -5.034 -12.212  -5.770
  251   1HB   SER  34          1HB       SER  34  -3.805 -12.073  -8.536
  252   2HB   SER  34          2HB       SER  34  -4.917 -13.314  -7.957
  253    HG   SER  34           HG       SER  34  -6.356 -11.994  -8.771
  254    H    ASP  35           H        ASP  35  -1.866 -11.247  -5.829
  255    HA   ASP  35           HA       ASP  35  -0.730 -13.881  -5.821
  256   1HB   ASP  35          1HB       ASP  35   1.069 -11.776  -5.095
  257   2HB   ASP  35          2HB       ASP  35   1.202 -12.918  -6.393
  258    H    GLY  36           H        GLY  36  -2.206 -12.028  -3.617
  259   1HA   GLY  36          1HA       GLY  36  -2.354 -12.131  -1.323
  260   2HA   GLY  36          2HA       GLY  36  -1.347 -13.570  -1.409
  261    H    PHE  37           H        PHE  37  -0.637 -10.258  -2.420
  262    HA   PHE  37           HA       PHE  37   1.672 -10.293  -0.604
  263   1HB   PHE  37          1HB       PHE  37   1.205  -9.107  -3.298
  264   2HB   PHE  37          2HB       PHE  37   2.263  -8.232  -2.197
  265    HD1  PHE  37           HD1      PHE  37   1.760 -11.800  -3.199
  266    HD2  PHE  37           HD2      PHE  37   4.473  -8.589  -2.550
  267    HE1  PHE  37           HE1      PHE  37   3.630 -13.254  -3.857
  268    HE2  PHE  37           HE2      PHE  37   6.354 -10.037  -3.201
  269    HZ   PHE  37           HZ       PHE  37   5.936 -12.372  -3.850
  270    H    LEU  38           H        LEU  38   1.864  -8.791   0.952
  271    HA   LEU  38           HA       LEU  38  -0.397  -7.098   1.499
  272   1HB   LEU  38          1HB       LEU  38   2.219  -7.402   2.929
  273   2HB   LEU  38          2HB       LEU  38   0.896  -6.420   3.505
  274    HG   LEU  38           HG       LEU  38  -0.458  -8.652   3.408
  275   1HD1  LEU  38          1HD1      LEU  38   2.335  -9.555   3.058
  276   2HD1  LEU  38          2HD1      LEU  38   0.825 -10.284   2.516
  277   3HD1  LEU  38          3HD1      LEU  38   1.331 -10.460   4.196
  278   1HD2  LEU  38          1HD2      LEU  38   1.464  -7.665   5.448
  279   2HD2  LEU  38          2HD2      LEU  38   0.690  -9.227   5.713
  280   3HD2  LEU  38          3HD2      LEU  38  -0.293  -7.780   5.506
  281    H    TRP  39           H        TRP  39  -0.597  -4.995   0.996
  282    HA   TRP  39           HA       TRP  39   1.841  -3.515   0.356
  283   1HB   TRP  39          1HB       TRP  39   0.897  -2.608  -1.694
  284   2HB   TRP  39          2HB       TRP  39   0.939  -4.361  -1.774
  285    HD1  TRP  39           HD1      TRP  39  -1.480  -5.646  -1.498
  286    HE1  TRP  39           HE1      TRP  39  -3.838  -4.865  -2.126
  287    HE3  TRP  39           HE3      TRP  39  -0.639  -0.603  -1.816
  288    HZ2  TRP  39           HZ2      TRP  39  -5.164  -2.453  -2.685
  289    HZ3  TRP  39           HZ3      TRP  39  -2.521   0.862  -2.406
  290    HH2  TRP  39           HH2      TRP  39  -4.736  -0.051  -2.827
  291    H    CYS  40           H        CYS  40   1.359  -1.181  -0.022
  292    HA   CYS  40           HA       CYS  40  -0.961  -0.093   1.325
  293   1HB   CYS  40          1HB       CYS  40   0.273   1.149   2.985
  294   2HB   CYS  40          2HB       CYS  40   0.709  -0.550   3.155
  295    H    SER  41           H        SER  41  -0.828   2.388   1.125
  296    HA   SER  41           HA       SER  41   0.609   3.008  -1.368
  297   1HB   SER  41          1HB       SER  41  -1.937   3.132  -1.390
  298   2HB   SER  41          2HB       SER  41  -1.783   4.513  -0.303
  299    HG   SER  41           HG       SER  41  -0.531   4.345  -2.852
  300    H    THR  42           H        THR  42   1.337   5.263  -1.580
  301    HA   THR  42           HA       THR  42   2.581   6.145   0.878
  302    HB   THR  42           HB       THR  42   3.567   7.737  -0.991
  303    HG1  THR  42           HG1      THR  42   2.882   7.257  -2.879
  304   1HG2  THR  42          1HG2      THR  42   4.506   4.938  -1.256
  305   2HG2  THR  42          2HG2      THR  42   4.683   5.759   0.293
  306   3HG2  THR  42          3HG2      THR  42   5.436   6.433  -1.152
  307    H    THR  43           H        THR  43   0.026   6.883  -1.228
  308    HA   THR  43           HA       THR  43  -0.360   9.529  -0.039
  309    HB   THR  43           HB       THR  43  -0.055   9.673  -2.421
  310    HG1  THR  43           HG1      THR  43  -1.965  10.656  -2.995
  311   1HG2  THR  43          1HG2      THR  43  -2.039   7.469  -2.511
  312   2HG2  THR  43          2HG2      THR  43  -0.482   7.621  -3.324
  313   3HG2  THR  43          3HG2      THR  43  -1.860   8.579  -3.869
  314    H    TYR  44           H        TYR  44  -2.890  10.041  -0.154
  315    HA   TYR  44           HA       TYR  44  -4.100   8.043   1.537
  316   1HB   TYR  44          1HB       TYR  44  -4.343  10.503   1.948
  317   2HB   TYR  44          2HB       TYR  44  -5.338  10.603   0.494
  318    HD1  TYR  44           HD1      TYR  44  -5.185   8.415   3.546
  319    HD2  TYR  44           HD2      TYR  44  -7.613  10.716   0.914
  320    HE1  TYR  44           HE1      TYR  44  -7.166   7.846   4.884
  321    HE2  TYR  44           HE2      TYR  44  -9.595  10.151   2.248
  322    HH   TYR  44           HH       TYR  44 -10.404   8.858   3.877
  323    H    ASN  45           H        ASN  45  -5.428   9.761  -1.299
  324    HA   ASN  45           HA       ASN  45  -7.157   7.550  -1.905
  325   1HB   ASN  45          1HB       ASN  45  -7.727   9.959  -2.393
  326   2HB   ASN  45          2HB       ASN  45  -6.512   9.945  -3.650
  327   1HD2  ASN  45          1HD2      ASN  45  -7.459   7.030  -4.176
  328   2HD2  ASN  45          2HD2      ASN  45  -8.842   7.344  -5.106
  329    H    PHE  46           H        PHE  46  -6.140   5.743  -2.520
  330    HA   PHE  46           HA       PHE  46  -3.679   5.592  -3.836
  331   1HB   PHE  46          1HB       PHE  46  -4.497   3.744  -2.530
  332   2HB   PHE  46          2HB       PHE  46  -5.903   3.551  -3.606
  333    HD1  PHE  46           HD1      PHE  46  -2.153   3.728  -3.915
  334    HD2  PHE  46           HD2      PHE  46  -5.758   1.788  -5.088
  335    HE1  PHE  46           HE1      PHE  46  -0.867   2.173  -5.301
  336    HE2  PHE  46           HE2      PHE  46  -4.467   0.224  -6.472
  337    HZ   PHE  46           HZ       PHE  46  -2.019   0.414  -6.584
  338    H    GLU  47           H        GLU  47  -6.907   4.932  -5.192
  339    HA   GLU  47           HA       GLU  47  -6.196   4.342  -7.776
  340   1HB   GLU  47          1HB       GLU  47  -8.493   4.339  -6.578
  341   2HB   GLU  47          2HB       GLU  47  -8.643   5.977  -7.196
  342   1HG   GLU  47          1HG       GLU  47  -8.304   5.095  -9.482
  343   2HG   GLU  47          2HG       GLU  47  -8.287   3.462  -8.818
  344    H    LYS  48           H        LYS  48  -6.750   7.560  -6.422
  345    HA   LYS  48           HA       LYS  48  -6.675   8.999  -8.812
  346   1HB   LYS  48          1HB       LYS  48  -7.508  10.123  -6.902
  347   2HB   LYS  48          2HB       LYS  48  -6.093   9.727  -5.940
  348   1HG   LYS  48          1HG       LYS  48  -4.767  11.329  -7.330
  349   2HG   LYS  48          2HG       LYS  48  -6.265  11.801  -8.145
  350   1HD   LYS  48          1HD       LYS  48  -5.655  12.047  -5.198
  351   2HD   LYS  48          2HD       LYS  48  -5.727  13.365  -6.370
  352   1HE   LYS  48          1HE       LYS  48  -8.029  11.575  -5.585
  353   2HE   LYS  48          2HE       LYS  48  -7.768  13.223  -5.015
  354   1HZ   LYS  48          1HZ       LYS  48  -8.362  12.354  -7.798
  355   2HZ   LYS  48          2HZ       LYS  48  -7.903  13.939  -7.379
  356   3HZ   LYS  48          3HZ       LYS  48  -9.345  13.282  -6.768
  357    H    ASP  49           H        ASP  49  -4.016   8.435  -6.481
  358    HA   ASP  49           HA       ASP  49  -2.114   9.674  -8.250
  359   1HB   ASP  49          1HB       ASP  49  -2.036   8.522  -5.511
  360   2HB   ASP  49          2HB       ASP  49  -0.517   8.672  -6.389
  361    H    GLY  50           H        GLY  50  -2.521   6.364  -6.985
  362   1HA   GLY  50          1HA       GLY  50  -2.226   4.399  -8.208
  363   2HA   GLY  50          2HA       GLY  50  -1.463   5.329  -9.478
  364    H    LYS  51           H        LYS  51  -0.354   5.777  -6.222
  365    HA   LYS  51           HA       LYS  51   2.146   4.449  -6.954
  366   1HB   LYS  51          1HB       LYS  51   1.510   6.441  -4.789
  367   2HB   LYS  51          2HB       LYS  51   3.055   5.620  -4.905
  368   1HG   LYS  51          1HG       LYS  51   3.734   7.234  -6.233
  369   2HG   LYS  51          2HG       LYS  51   2.561   6.688  -7.433
  370   1HD   LYS  51          1HD       LYS  51   0.874   8.147  -6.426
  371   2HD   LYS  51          2HD       LYS  51   2.057   8.699  -5.241
  372   1HE   LYS  51          1HE       LYS  51   2.147   9.097  -8.228
  373   2HE   LYS  51          2HE       LYS  51   1.886  10.336  -7.000
  374   1HZ   LYS  51          1HZ       LYS  51   4.219  10.027  -8.043
  375   2HZ   LYS  51          2HZ       LYS  51   4.358   8.731  -6.958
  376   3HZ   LYS  51          3HZ       LYS  51   4.088  10.298  -6.370
  377    H    TYR  52           H        TYR  52   2.533   2.458  -6.211
  378    HA   TYR  52           HA       TYR  52   1.415   1.716  -3.604
  379   1HB   TYR  52          1HB       TYR  52   0.674  -0.405  -4.393
  380   2HB   TYR  52          2HB       TYR  52   0.071   0.779  -5.546
  381    HD1  TYR  52           HD1      TYR  52   2.468  -1.948  -5.014
  382    HD2  TYR  52           HD2      TYR  52   0.918   0.852  -7.817
  383    HE1  TYR  52           HE1      TYR  52   3.554  -3.184  -6.829
  384    HE2  TYR  52           HE2      TYR  52   1.993  -0.386  -9.648
  385    HH   TYR  52           HH       TYR  52   3.904  -3.332  -9.004
  386    H    GLY  53           H        GLY  53   2.429  -0.365  -2.828
  387   1HA   GLY  53          1HA       GLY  53   4.935  -1.222  -3.768
  388   2HA   GLY  53          2HA       GLY  53   5.151  -0.059  -2.474
  389    H    PHE  54           H        PHE  54   5.973  -2.717  -2.202
  390    HA   PHE  54           HA       PHE  54   3.881  -3.936  -0.566
  391   1HB   PHE  54          1HB       PHE  54   6.519  -5.080  -1.473
  392   2HB   PHE  54          2HB       PHE  54   5.275  -5.956  -0.587
  393    HD1  PHE  54           HD1      PHE  54   2.832  -5.522  -1.751
  394    HD2  PHE  54           HD2      PHE  54   6.604  -5.606  -3.719
  395    HE1  PHE  54           HE1      PHE  54   1.707  -6.060  -3.867
  396    HE2  PHE  54           HE2      PHE  54   5.481  -6.149  -5.849
  397    HZ   PHE  54           HZ       PHE  54   3.030  -6.375  -5.919
  398    H    CYS  55           H        CYS  55   4.120  -4.351   1.607
  399    HA   CYS  55           HA       CYS  55   6.453  -3.084   2.874
  400   1HB   CYS  55          1HB       CYS  55   4.630  -2.678   4.762
  401   2HB   CYS  55          2HB       CYS  55   4.843  -1.553   3.420
  402    HA   PRO  56           HA       PRO  56   6.341  -7.258   4.726
  403   1HB   PRO  56          1HB       PRO  56   9.144  -7.367   4.673
  404   2HB   PRO  56          2HB       PRO  56   8.040  -8.188   3.580
  405   1HG   PRO  56          1HG       PRO  56   9.819  -6.130   2.890
  406   2HG   PRO  56          2HG       PRO  56   8.483  -6.737   1.901
  407   1HD   PRO  56          1HD       PRO  56   8.632  -4.301   3.598
  408   2HD   PRO  56          2HD       PRO  56   7.709  -4.588   2.109
  409    H    HIS  57           H        HIS  57   5.727  -5.395   6.345
  410    HA   HIS  57           HA       HIS  57   7.536  -4.236   8.088
  411   1HB   HIS  57          1HB       HIS  57   5.573  -4.121   9.678
  412   2HB   HIS  57          2HB       HIS  57   5.287  -3.470   8.069
  413    HD1  HIS  57           HD1      HIS  57   4.337  -6.353  10.295
  414    HD2  HIS  57           HD2      HIS  57   3.401  -4.820   6.544
  415    HE1  HIS  57           HE1      HIS  57   2.348  -7.677   9.499
  416    H    GLU  58           H        GLU  58   5.963  -7.407   8.405
  417    HA   GLU  58           HA       GLU  58   7.363  -7.889  10.883
  418   1HB   GLU  58          1HB       GLU  58   6.262 -10.137  10.794
  419   2HB   GLU  58          2HB       GLU  58   5.157  -8.776  10.811
  420   1HG   GLU  58          1HG       GLU  58   4.957  -9.040   8.320
  421   2HG   GLU  58          2HG       GLU  58   5.883 -10.532   8.478
  422    H    ALA  59           H        ALA  59   9.495  -7.926  10.465
  423    HA   ALA  59           HA       ALA  59  10.497 -10.257   8.998
  424   1HB   ALA  59          1HB       ALA  59  10.780  -7.548   8.145
  425   2HB   ALA  59          2HB       ALA  59  11.400  -9.019   7.393
  426   3HB   ALA  59          3HB       ALA  59  12.363  -8.175   8.606
  Start of MODEL   11
    1   1H    ARG   1          1H        ARG   1   4.664   4.043  11.884
    2   2H    ARG   1          2H        ARG   1   3.453   2.897  11.477
    3   3H    ARG   1          3H        ARG   1   3.077   4.577  11.499
    4    HA   ARG   1           HA       ARG   1   3.345   3.691   9.284
    5   1HB   ARG   1          1HB       ARG   1   3.907   6.070  10.118
    6   2HB   ARG   1          2HB       ARG   1   5.588   5.586   9.970
    7   1HG   ARG   1          1HG       ARG   1   5.448   5.374   7.640
    8   2HG   ARG   1          2HG       ARG   1   3.682   5.360   7.664
    9   1HD   ARG   1          1HD       ARG   1   3.828   7.736   8.568
   10   2HD   ARG   1          2HD       ARG   1   5.537   7.686   8.144
   11    HE   ARG   1           HE       ARG   1   4.032   6.948   5.882
   12   1HH1  ARG   1          1HH1      ARG   1   4.635   9.727   7.904
   13   2HH1  ARG   1          2HH1      ARG   1   4.333  10.883   6.640
   14   1HH2  ARG   1          1HH2      ARG   1   3.674   8.441   4.189
   15   2HH2  ARG   1          2HH2      ARG   1   3.820  10.146   4.496
   16    H    ILE   2           H        ILE   2   4.611   2.604   7.777
   17    HA   ILE   2           HA       ILE   2   7.228   1.664   8.658
   18    HB   ILE   2           HB       ILE   2   5.415  -0.055   9.197
   19   1HG1  ILE   2          1HG1      ILE   2   7.606  -0.956   7.317
   20   2HG1  ILE   2          2HG1      ILE   2   7.807  -0.620   9.034
   21   1HG2  ILE   2          1HG2      ILE   2   5.466  -0.617   6.244
   22   2HG2  ILE   2          2HG2      ILE   2   4.181   0.308   7.025
   23   3HG2  ILE   2          3HG2      ILE   2   4.464  -1.375   7.481
   24   1HD1  ILE   2          1HD1      ILE   2   5.728  -2.569   8.246
   25   2HD1  ILE   2          2HD1      ILE   2   6.769  -2.538   9.672
   26   3HD1  ILE   2          3HD1      ILE   2   7.414  -3.058   8.113
   27    HA   PRO   3           HA       PRO   3   8.602   2.864   4.657
   28   1HB   PRO   3          1HB       PRO   3  10.456   0.842   4.207
   29   2HB   PRO   3          2HB       PRO   3  10.761   2.351   5.071
   30   1HG   PRO   3          1HG       PRO   3  10.136  -0.359   6.141
   31   2HG   PRO   3          2HG       PRO   3  11.240   0.877   6.773
   32   1HD   PRO   3          1HD       PRO   3   8.845   0.456   7.899
   33   2HD   PRO   3          2HD       PRO   3   9.512   2.096   7.765
   34    H    VAL   4           H        VAL   4   9.285   1.812   2.482
   35    HA   VAL   4           HA       VAL   4   7.322  -0.272   1.736
   36    HB   VAL   4           HB       VAL   4   8.045   2.220   0.122
   37   1HG1  VAL   4          1HG1      VAL   4   6.453  -0.219  -0.531
   38   2HG1  VAL   4          2HG1      VAL   4   7.597   0.687  -1.524
   39   3HG1  VAL   4          3HG1      VAL   4   5.989   1.340  -1.212
   40   1HG2  VAL   4          1HG2      VAL   4   5.961   1.687   2.082
   41   2HG2  VAL   4          2HG2      VAL   4   5.309   2.183   0.518
   42   3HG2  VAL   4          3HG2      VAL   4   6.474   3.209   1.356
   43    H    LYS   5           H        LYS   5   7.943  -1.539  -0.169
   44    HA   LYS   5           HA       LYS   5  10.867  -1.619  -0.496
   45   1HB   LYS   5          1HB       LYS   5   9.000  -3.652   0.210
   46   2HB   LYS   5          2HB       LYS   5   9.690  -4.066  -1.351
   47   1HG   LYS   5          1HG       LYS   5  11.255  -3.452   1.151
   48   2HG   LYS   5          2HG       LYS   5  10.920  -5.065   0.510
   49   1HD   LYS   5          1HD       LYS   5  12.960  -4.791  -0.440
   50   2HD   LYS   5          2HD       LYS   5  12.022  -3.942  -1.669
   51   1HE   LYS   5          1HE       LYS   5  12.463  -1.837  -0.323
   52   2HE   LYS   5          2HE       LYS   5  13.636  -2.770   0.595
   53   1HZ   LYS   5          1HZ       LYS   5  13.906  -1.576  -1.976
   54   2HZ   LYS   5          2HZ       LYS   5  14.247  -3.232  -2.060
   55   3HZ   LYS   5          3HZ       LYS   5  15.103  -2.242  -0.967
   56    H    TYR   6           H        TYR   6   8.727  -3.510  -2.476
   57    HA   TYR   6           HA       TYR   6   9.883  -2.324  -4.843
   58   1HB   TYR   6          1HB       TYR   6   7.801  -4.511  -4.703
   59   2HB   TYR   6          2HB       TYR   6   8.899  -4.150  -6.034
   60    HD1  TYR   6           HD1      TYR   6  11.524  -4.099  -5.159
   61    HD2  TYR   6           HD2      TYR   6   8.352  -6.420  -3.498
   62    HE1  TYR   6           HE1      TYR   6  13.152  -5.679  -4.233
   63    HE2  TYR   6           HE2      TYR   6   9.980  -7.996  -2.580
   64    HH   TYR   6           HH       TYR   6  12.375  -8.709  -3.158
   65    H    GLY   7           H        GLY   7   8.170  -2.339  -6.795
   66   1HA   GLY   7          1HA       GLY   7   5.983  -1.613  -7.511
   67   2HA   GLY   7          2HA       GLY   7   5.822  -0.727  -6.002
   68    H    ASN   8           H        ASN   8   5.343   1.177  -7.212
   69    HA   ASN   8           HA       ASN   8   7.627   2.230  -8.716
   70   1HB   ASN   8          1HB       ASN   8   6.087   3.939  -9.615
   71   2HB   ASN   8          2HB       ASN   8   5.590   2.302  -9.997
   72   1HD2  ASN   8          1HD2      ASN   8   3.515   2.797 -10.350
   73   2HD2  ASN   8          2HD2      ASN   8   2.435   3.335  -9.124
   74    H    ALA   9           H        ALA   9   6.262   2.445  -5.714
   75    HA   ALA   9           HA       ALA   9   6.632   5.188  -5.140
   76   1HB   ALA   9          1HB       ALA   9   6.893   3.531  -2.808
   77   2HB   ALA   9          2HB       ALA   9   5.555   2.981  -3.817
   78   3HB   ALA   9          3HB       ALA   9   5.604   4.651  -3.251
   79    H    ASP  10           H        ASP  10   8.313   6.265  -4.275
   80    HA   ASP  10           HA       ASP  10  10.917   5.155  -4.711
   81   1HB   ASP  10          1HB       ASP  10  10.018   7.836  -3.641
   82   2HB   ASP  10          2HB       ASP  10  11.703   7.407  -3.925
   83    H    GLY  11           H        GLY  11  10.180   7.089  -1.860
   84   1HA   GLY  11          1HA       GLY  11  10.983   4.830  -0.183
   85   2HA   GLY  11          2HA       GLY  11  11.852   6.348  -0.043
   86    H    GLU  12           H        GLU  12   8.570   6.808  -0.727
   87    HA   GLU  12           HA       GLU  12   8.106   7.973   1.842
   88   1HB   GLU  12          1HB       GLU  12   6.302   7.437  -0.517
   89   2HB   GLU  12          2HB       GLU  12   5.736   8.204   0.955
   90   1HG   GLU  12          1HG       GLU  12   6.189   9.859  -0.737
   91   2HG   GLU  12          2HG       GLU  12   7.310  10.041   0.606
   92    H    TYR  13           H        TYR  13   7.546   6.886   3.624
   93    HA   TYR  13           HA       TYR  13   6.991   4.130   3.604
   94   1HB   TYR  13          1HB       TYR  13   6.140   5.790   5.938
   95   2HB   TYR  13          2HB       TYR  13   6.900   4.201   5.906
   96    HD1  TYR  13           HD1      TYR  13   9.363   4.299   4.760
   97    HD2  TYR  13           HD2      TYR  13   7.409   7.481   6.789
   98    HE1  TYR  13           HE1      TYR  13  11.543   5.316   5.241
   99    HE2  TYR  13           HE2      TYR  13   9.580   8.516   7.274
  100    HH   TYR  13           HH       TYR  13  12.076   8.293   5.982
  101    H    CYS  14           H        CYS  14   5.080   3.047   4.465
  102    HA   CYS  14           HA       CYS  14   2.794   3.537   2.991
  103   1HB   CYS  14          1HB       CYS  14   3.089   2.067   5.613
  104   2HB   CYS  14          2HB       CYS  14   1.650   2.009   4.603
  105    H    LYS  15           H        LYS  15   1.050   4.756   3.192
  106    HA   LYS  15           HA       LYS  15   0.938   6.601   5.452
  107   1HB   LYS  15          1HB       LYS  15   0.821   7.463   3.097
  108   2HB   LYS  15          2HB       LYS  15  -0.705   6.609   2.909
  109   1HG   LYS  15          1HG       LYS  15  -1.698   7.957   4.674
  110   2HG   LYS  15          2HG       LYS  15  -0.165   8.802   4.904
  111   1HD   LYS  15          1HD       LYS  15  -0.285   9.661   2.617
  112   2HD   LYS  15          2HD       LYS  15  -1.801   8.791   2.363
  113   1HE   LYS  15          1HE       LYS  15  -2.187  11.163   2.849
  114   2HE   LYS  15          2HE       LYS  15  -2.877  10.118   4.096
  115   1HZ   LYS  15          1HZ       LYS  15  -1.061  10.611   5.550
  116   2HZ   LYS  15          2HZ       LYS  15  -1.665  12.090   4.969
  117   3HZ   LYS  15          3HZ       LYS  15  -0.230  11.450   4.328
  118    H    PHE  16           H        PHE  16  -0.153   5.834   7.138
  119    HA   PHE  16           HA       PHE  16  -2.623   4.313   6.632
  120   1HB   PHE  16          1HB       PHE  16  -0.876   4.364   9.098
  121   2HB   PHE  16          2HB       PHE  16  -2.357   3.428   8.923
  122    HD1  PHE  16           HD1      PHE  16  -2.217   2.133   6.422
  123    HD2  PHE  16           HD2      PHE  16   0.947   3.021   9.118
  124    HE1  PHE  16           HE1      PHE  16  -0.925   0.259   5.504
  125    HE2  PHE  16           HE2      PHE  16   2.254   1.156   8.215
  126    HZ   PHE  16           HZ       PHE  16   1.335  -0.257   6.396
  127    HA   PRO  17           HA       PRO  17  -4.335   3.969   6.971
  128   1HB   PRO  17          1HB       PRO  17  -6.966   4.788   6.795
  129   2HB   PRO  17          2HB       PRO  17  -6.268   3.900   8.152
  130   1HG   PRO  17          1HG       PRO  17  -7.233   6.604   8.130
  131   2HG   PRO  17          2HG       PRO  17  -6.546   5.702   9.486
  132   1HD   PRO  17          1HD       PRO  17  -5.271   7.692   7.717
  133   2HD   PRO  17          2HD       PRO  17  -4.817   7.171   9.354
  134    H    PHE  18           H        PHE  18  -4.712   3.546   4.800
  135    HA   PHE  18           HA       PHE  18  -4.934   5.932   3.097
  136   1HB   PHE  18          1HB       PHE  18  -3.942   4.683   1.285
  137   2HB   PHE  18          2HB       PHE  18  -2.905   4.581   2.696
  138    HD1  PHE  18           HD1      PHE  18  -3.057   2.442   4.103
  139    HD2  PHE  18           HD2      PHE  18  -4.619   2.787   0.165
  140    HE1  PHE  18           HE1      PHE  18  -3.006  -0.001   3.876
  141    HE2  PHE  18           HE2      PHE  18  -4.571   0.345  -0.081
  142    HZ   PHE  18           HZ       PHE  18  -3.750  -1.073   1.773
  143    H    LEU  19           H        LEU  19  -6.325   5.864   1.241
  144    HA   LEU  19           HA       LEU  19  -8.715   4.270   1.781
  145   1HB   LEU  19          1HB       LEU  19  -8.813   6.769   1.554
  146   2HB   LEU  19          2HB       LEU  19  -8.395   6.571  -0.136
  147    HG   LEU  19           HG       LEU  19 -10.462   5.159  -0.388
  148   1HD1  LEU  19          1HD1      LEU  19 -11.069   4.452   1.720
  149   2HD1  LEU  19          2HD1      LEU  19 -12.198   5.779   1.443
  150   3HD1  LEU  19          3HD1      LEU  19 -10.771   6.026   2.450
  151   1HD2  LEU  19          1HD2      LEU  19 -11.536   6.986  -1.099
  152   2HD2  LEU  19          2HD2      LEU  19 -10.115   7.869  -0.538
  153   3HD2  LEU  19          3HD2      LEU  19 -11.533   7.725   0.504
  154    H    PHE  20           H        PHE  20  -8.818   2.400   0.769
  155    HA   PHE  20           HA       PHE  20  -7.816   2.166  -1.992
  156   1HB   PHE  20          1HB       PHE  20  -7.008   0.528  -0.250
  157   2HB   PHE  20          2HB       PHE  20  -8.672  -0.021  -0.108
  158    HD1  PHE  20           HD1      PHE  20  -7.930  -2.232  -0.602
  159    HD2  PHE  20           HD2      PHE  20  -7.519   0.903  -3.450
  160    HE1  PHE  20           HE1      PHE  20  -7.598  -3.914  -2.358
  161    HE2  PHE  20           HE2      PHE  20  -7.190  -0.783  -5.230
  162    HZ   PHE  20           HZ       PHE  20  -7.235  -3.180  -4.693
  163    H    ASN  21           H        ASN  21  -9.465   2.845  -3.251
  164    HA   ASN  21           HA       ASN  21 -11.506   3.009  -4.232
  165   1HB   ASN  21          1HB       ASN  21 -11.378   0.092  -3.524
  166   2HB   ASN  21          2HB       ASN  21 -12.748   0.768  -4.402
  167   1HD2  ASN  21          1HD2      ASN  21 -12.615   0.475  -6.481
  168   2HD2  ASN  21          2HD2      ASN  21 -11.171   0.481  -7.431
  169    H    GLY  22           H        GLY  22 -11.485   3.656  -1.357
  170   1HA   GLY  22          1HA       GLY  22 -13.406   4.623  -0.300
  171   2HA   GLY  22          2HA       GLY  22 -14.367   3.297  -0.926
  172    H    LYS  23           H        LYS  23 -11.450   2.116   0.337
  173    HA   LYS  23           HA       LYS  23 -12.715   1.708   2.967
  174   1HB   LYS  23          1HB       LYS  23 -12.780  -0.304   1.372
  175   2HB   LYS  23          2HB       LYS  23 -11.038  -0.384   1.582
  176   1HG   LYS  23          1HG       LYS  23 -11.345  -0.725   3.988
  177   2HG   LYS  23          2HG       LYS  23 -13.097  -0.654   3.771
  178   1HD   LYS  23          1HD       LYS  23 -12.891  -2.583   2.187
  179   2HD   LYS  23          2HD       LYS  23 -11.192  -2.709   2.653
  180   1HE   LYS  23          1HE       LYS  23 -12.541  -4.280   3.926
  181   2HE   LYS  23          2HE       LYS  23 -11.851  -3.049   4.987
  182   1HZ   LYS  23          1HZ       LYS  23 -13.925  -1.950   5.137
  183   2HZ   LYS  23          2HZ       LYS  23 -14.251  -3.601   5.376
  184   3HZ   LYS  23          3HZ       LYS  23 -14.603  -2.878   3.880
  185    H    GLU  24           H        GLU  24 -11.493   2.425   4.578
  186    HA   GLU  24           HA       GLU  24  -8.742   3.165   4.080
  187   1HB   GLU  24          1HB       GLU  24 -10.297   3.413   6.656
  188   2HB   GLU  24          2HB       GLU  24  -8.801   4.230   6.253
  189   1HG   GLU  24          1HG       GLU  24 -10.148   5.931   5.776
  190   2HG   GLU  24          2HG       GLU  24 -10.407   5.075   4.257
  191    H    TYR  25           H        TYR  25  -6.980   2.097   4.715
  192    HA   TYR  25           HA       TYR  25  -7.338  -0.243   6.465
  193   1HB   TYR  25          1HB       TYR  25  -5.361   0.214   4.254
  194   2HB   TYR  25          2HB       TYR  25  -5.273  -1.145   5.358
  195    HD1  TYR  25           HD1      TYR  25  -7.658  -2.424   5.561
  196    HD2  TYR  25           HD2      TYR  25  -6.282  -0.191   2.221
  197    HE1  TYR  25           HE1      TYR  25  -9.211  -3.669   4.093
  198    HE2  TYR  25           HE2      TYR  25  -7.822  -1.425   0.742
  199    HH   TYR  25           HH       TYR  25  -9.247  -4.255   1.541
  200    H    ASN  26           H        ASN  26  -6.227  -0.315   8.305
  201    HA   ASN  26           HA       ASN  26  -4.455   1.922   8.939
  202   1HB   ASN  26          1HB       ASN  26  -5.615  -0.279  10.676
  203   2HB   ASN  26          2HB       ASN  26  -4.513   0.955  11.272
  204   1HD2  ASN  26          1HD2      ASN  26  -6.454   2.268   8.909
  205   2HD2  ASN  26          2HD2      ASN  26  -7.665   2.976   9.920
  206    H    SER  27           H        SER  27  -4.300  -1.184   7.782
  207    HA   SER  27           HA       SER  27  -1.429  -1.339   8.302
  208   1HB   SER  27          1HB       SER  27  -1.704  -3.842   8.587
  209   2HB   SER  27          2HB       SER  27  -2.338  -2.871   9.923
  210    HG   SER  27           HG       SER  27  -3.646  -4.552   8.194
  211    H    CYS  28           H        CYS  28  -0.481  -3.131   6.809
  212    HA   CYS  28           HA       CYS  28  -1.316  -2.479   4.135
  213   1HB   CYS  28          1HB       CYS  28   0.774  -4.434   5.135
  214   2HB   CYS  28          2HB       CYS  28   0.539  -3.977   3.449
  215    H    THR  29           H        THR  29  -2.483  -3.713   2.722
  216    HA   THR  29           HA       THR  29  -3.492  -6.266   3.744
  217    HB   THR  29           HB       THR  29  -5.186  -4.473   3.775
  218    HG1  THR  29           HG1      THR  29  -6.177  -6.343   3.477
  219   1HG2  THR  29          1HG2      THR  29  -4.184  -3.372   1.625
  220   2HG2  THR  29          2HG2      THR  29  -5.907  -3.263   1.979
  221   3HG2  THR  29          3HG2      THR  29  -5.323  -4.439   0.805
  222    H    ASP  30           H        ASP  30  -4.372  -7.709   1.981
  223    HA   ASP  30           HA       ASP  30  -2.546  -7.647  -0.298
  224   1HB   ASP  30          1HB       ASP  30  -3.969 -10.116  -0.044
  225   2HB   ASP  30          2HB       ASP  30  -2.261  -9.860  -0.158
  226    H    THR  31           H        THR  31  -5.442  -6.652   0.417
  227    HA   THR  31           HA       THR  31  -7.247  -7.833  -1.372
  228    HB   THR  31           HB       THR  31  -7.225  -4.951  -0.488
  229    HG1  THR  31           HG1      THR  31  -7.078  -6.126   1.379
  230   1HG2  THR  31          1HG2      THR  31  -9.663  -5.149  -0.525
  231   2HG2  THR  31          2HG2      THR  31  -9.506  -6.782  -1.173
  232   3HG2  THR  31          3HG2      THR  31  -8.942  -5.406  -2.122
  233    H    GLY  32           H        GLY  32  -7.686  -7.509  -3.489
  234   1HA   GLY  32          1HA       GLY  32  -7.650  -6.478  -5.560
  235   2HA   GLY  32          2HA       GLY  32  -6.638  -5.217  -4.886
  236    H    ARG  33           H        ARG  33  -5.067  -7.833  -3.897
  237    HA   ARG  33           HA       ARG  33  -3.239  -7.732  -6.164
  238   1HB   ARG  33          1HB       ARG  33  -2.936  -9.062  -3.465
  239   2HB   ARG  33          2HB       ARG  33  -1.679  -8.957  -4.693
  240   1HG   ARG  33          1HG       ARG  33  -2.956  -6.659  -3.225
  241   2HG   ARG  33          2HG       ARG  33  -1.319  -7.272  -2.994
  242   1HD   ARG  33          1HD       ARG  33  -2.412  -6.032  -5.519
  243   2HD   ARG  33          2HD       ARG  33  -1.350  -5.231  -4.361
  244    HE   ARG  33           HE       ARG  33  -0.186  -7.655  -5.316
  245   1HH1  ARG  33          1HH1      ARG  33  -0.767  -4.307  -6.128
  246   2HH1  ARG  33          2HH1      ARG  33   0.480  -4.253  -7.338
  247   1HH2  ARG  33          1HH2      ARG  33   1.521  -7.562  -6.851
  248   2HH2  ARG  33          2HH2      ARG  33   1.791  -6.095  -7.742
  249    H    SER  34           H        SER  34  -2.021 -10.108  -6.249
  250    HA   SER  34           HA       SER  34  -4.191 -12.018  -6.818
  251   1HB   SER  34          1HB       SER  34  -1.651 -11.716  -8.429
  252   2HB   SER  34          2HB       SER  34  -3.045 -12.728  -8.810
  253    HG   SER  34           HG       SER  34  -4.262 -10.687  -8.874
  254    H    ASP  35           H        ASP  35  -0.893 -11.572  -5.654
  255    HA   ASP  35           HA       ASP  35  -0.795 -14.414  -5.045
  256   1HB   ASP  35          1HB       ASP  35   1.322 -12.402  -5.475
  257   2HB   ASP  35          2HB       ASP  35   1.668 -13.932  -4.716
  258    H    GLY  36           H        GLY  36  -2.038 -12.142  -3.440
  259   1HA   GLY  36          1HA       GLY  36  -2.341 -11.724  -1.213
  260   2HA   GLY  36          2HA       GLY  36  -1.434 -13.194  -0.905
  261    H    PHE  37           H        PHE  37  -0.272 -10.242  -2.513
  262    HA   PHE  37           HA       PHE  37   1.865 -10.132  -0.526
  263   1HB   PHE  37          1HB       PHE  37   1.478  -8.645  -3.129
  264   2HB   PHE  37          2HB       PHE  37   2.813  -8.340  -2.029
  265    HD1  PHE  37           HD1      PHE  37   3.718 -10.960  -1.250
  266    HD2  PHE  37           HD2      PHE  37   2.292  -9.611  -5.027
  267    HE1  PHE  37           HE1      PHE  37   5.028 -12.714  -2.363
  268    HE2  PHE  37           HE2      PHE  37   3.597 -11.370  -6.149
  269    HZ   PHE  37           HZ       PHE  37   4.969 -12.922  -4.821
  270    H    LEU  38           H        LEU  38   2.052  -8.564   0.973
  271    HA   LEU  38           HA       LEU  38  -0.241  -6.900   1.462
  272   1HB   LEU  38          1HB       LEU  38   2.408  -7.073   2.853
  273   2HB   LEU  38          2HB       LEU  38   1.063  -6.108   3.415
  274    HG   LEU  38           HG       LEU  38   0.967  -9.105   3.102
  275   1HD1  LEU  38          1HD1      LEU  38   2.468  -7.796   4.953
  276   2HD1  LEU  38          2HD1      LEU  38   1.731  -9.379   5.191
  277   3HD1  LEU  38          3HD1      LEU  38   0.917  -7.935   5.786
  278   1HD2  LEU  38          1HD2      LEU  38  -1.180  -7.837   2.977
  279   2HD2  LEU  38          2HD2      LEU  38  -0.859  -7.244   4.604
  280   3HD2  LEU  38          3HD2      LEU  38  -1.075  -8.970   4.325
  281    H    TRP  39           H        TRP  39  -0.522  -4.839   0.867
  282    HA   TRP  39           HA       TRP  39   1.854  -3.294   0.124
  283   1HB   TRP  39          1HB       TRP  39   0.806  -2.467  -1.912
  284   2HB   TRP  39          2HB       TRP  39   0.883  -4.221  -1.951
  285    HD1  TRP  39           HD1      TRP  39  -1.463  -5.552  -1.610
  286    HE1  TRP  39           HE1      TRP  39  -3.868  -4.854  -2.147
  287    HE3  TRP  39           HE3      TRP  39  -0.788  -0.499  -1.948
  288    HZ2  TRP  39           HZ2      TRP  39  -5.296  -2.478  -2.640
  289    HZ3  TRP  39           HZ3      TRP  39  -2.736   0.914  -2.453
  290    HH2  TRP  39           HH2      TRP  39  -4.946  -0.066  -2.788
  291    H    CYS  40           H        CYS  40   1.192  -0.964  -0.321
  292    HA   CYS  40           HA       CYS  40  -1.059   0.004   1.238
  293   1HB   CYS  40          1HB       CYS  40   0.368   1.455   2.629
  294   2HB   CYS  40          2HB       CYS  40   0.733  -0.243   2.914
  295    H    SER  41           H        SER  41  -1.068   2.506   1.050
  296    HA   SER  41           HA       SER  41  -0.111   3.172  -1.650
  297   1HB   SER  41          1HB       SER  41  -2.623   3.273  -1.101
  298   2HB   SER  41          2HB       SER  41  -2.233   4.697  -0.139
  299    HG   SER  41           HG       SER  41  -1.254   4.623  -2.753
  300    H    THR  42           H        THR  42   0.612   5.368  -1.990
  301    HA   THR  42           HA       THR  42   2.230   6.315   0.244
  302    HB   THR  42           HB       THR  42   2.214   7.228  -2.644
  303    HG1  THR  42           HG1      THR  42   4.129   5.484  -1.539
  304   1HG2  THR  42          1HG2      THR  42   4.387   7.483  -0.580
  305   2HG2  THR  42          2HG2      THR  42   3.318   8.785  -1.100
  306   3HG2  THR  42          3HG2      THR  42   4.434   8.048  -2.250
  307    H    THR  43           H        THR  43  -0.408   7.205  -1.815
  308    HA   THR  43           HA       THR  43  -0.651   9.828  -0.542
  309    HB   THR  43           HB       THR  43  -2.369  10.178  -2.367
  310    HG1  THR  43           HG1      THR  43  -2.928   8.521  -3.500
  311   1HG2  THR  43          1HG2      THR  43   0.298   9.365  -3.489
  312   2HG2  THR  43          2HG2      THR  43   0.024  10.875  -2.620
  313   3HG2  THR  43          3HG2      THR  43  -0.837  10.558  -4.126
  314    H    TYR  44           H        TYR  44  -3.297  10.300  -0.527
  315    HA   TYR  44           HA       TYR  44  -4.240   8.426   1.461
  316   1HB   TYR  44          1HB       TYR  44  -4.545  10.908   1.714
  317   2HB   TYR  44          2HB       TYR  44  -5.690  10.853   0.372
  318    HD1  TYR  44           HD1      TYR  44  -5.139   8.757   3.440
  319    HD2  TYR  44           HD2      TYR  44  -7.868  11.047   1.116
  320    HE1  TYR  44           HE1      TYR  44  -6.941   8.189   5.009
  321    HE2  TYR  44           HE2      TYR  44  -9.681  10.483   2.674
  322    HH   TYR  44           HH       TYR  44 -10.275   9.287   4.457
  323    H    ASN  45           H        ASN  45  -5.423   9.678  -1.658
  324    HA   ASN  45           HA       ASN  45  -7.293   7.443  -1.796
  325   1HB   ASN  45          1HB       ASN  45  -7.986   9.820  -2.372
  326   2HB   ASN  45          2HB       ASN  45  -6.969   9.702  -3.792
  327   1HD2  ASN  45          1HD2      ASN  45  -7.889   6.746  -3.895
  328   2HD2  ASN  45          2HD2      ASN  45  -9.411   6.929  -4.615
  329    H    PHE  46           H        PHE  46  -6.292   5.600  -2.459
  330    HA   PHE  46           HA       PHE  46  -4.009   5.541  -4.137
  331   1HB   PHE  46          1HB       PHE  46  -4.340   3.733  -2.609
  332   2HB   PHE  46          2HB       PHE  46  -5.940   3.367  -3.299
  333    HD1  PHE  46           HD1      PHE  46  -6.112   1.786  -5.016
  334    HD2  PHE  46           HD2      PHE  46  -2.296   3.472  -4.159
  335    HE1  PHE  46           HE1      PHE  46  -5.072   0.211  -6.582
  336    HE2  PHE  46           HE2      PHE  46  -1.254   1.896  -5.726
  337    HZ   PHE  46           HZ       PHE  46  -2.634   0.266  -6.942
  338    H    GLU  47           H        GLU  47  -7.455   5.161  -4.803
  339    HA   GLU  47           HA       GLU  47  -7.244   4.174  -7.421
  340   1HB   GLU  47          1HB       GLU  47  -9.308   4.287  -5.990
  341   2HB   GLU  47          2HB       GLU  47  -9.402   5.999  -6.358
  342   1HG   GLU  47          1HG       GLU  47  -9.571   5.447  -8.751
  343   2HG   GLU  47          2HG       GLU  47  -9.582   3.736  -8.324
  344    H    LYS  48           H        LYS  48  -7.486   7.496  -6.222
  345    HA   LYS  48           HA       LYS  48  -7.532   8.709  -8.771
  346   1HB   LYS  48          1HB       LYS  48  -8.408  10.068  -7.100
  347   2HB   LYS  48          2HB       LYS  48  -7.124   9.691  -5.965
  348   1HG   LYS  48          1HG       LYS  48  -5.582  11.093  -7.355
  349   2HG   LYS  48          2HG       LYS  48  -6.976  11.568  -8.330
  350   1HD   LYS  48          1HD       LYS  48  -8.048  12.540  -6.395
  351   2HD   LYS  48          2HD       LYS  48  -6.738  11.971  -5.351
  352   1HE   LYS  48          1HE       LYS  48  -6.537  14.002  -7.580
  353   2HE   LYS  48          2HE       LYS  48  -6.427  14.314  -5.847
  354   1HZ   LYS  48          1HZ       LYS  48  -4.436  13.219  -7.660
  355   2HZ   LYS  48          2HZ       LYS  48  -4.502  12.493  -6.126
  356   3HZ   LYS  48          3HZ       LYS  48  -4.231  14.161  -6.268
  357    H    ASP  49           H        ASP  49  -4.878   8.544  -6.367
  358    HA   ASP  49           HA       ASP  49  -3.002   9.649  -8.236
  359   1HB   ASP  49          1HB       ASP  49  -2.772   8.598  -5.431
  360   2HB   ASP  49          2HB       ASP  49  -1.348   9.068  -6.351
  361    H    GLY  50           H        GLY  50  -3.078   6.520  -6.528
  362   1HA   GLY  50          1HA       GLY  50  -2.771   4.434  -7.609
  363   2HA   GLY  50          2HA       GLY  50  -2.039   5.279  -8.958
  364    H    LYS  51           H        LYS  51  -0.857   6.280  -5.922
  365    HA   LYS  51           HA       LYS  51   1.697   5.021  -6.489
  366   1HB   LYS  51          1HB       LYS  51   0.815   7.004  -4.397
  367   2HB   LYS  51          2HB       LYS  51   2.414   6.285  -4.395
  368   1HG   LYS  51          1HG       LYS  51   2.834   8.230  -5.479
  369   2HG   LYS  51          2HG       LYS  51   2.463   7.188  -6.852
  370   1HD   LYS  51          1HD       LYS  51   0.258   8.091  -7.025
  371   2HD   LYS  51          2HD       LYS  51   0.436   8.957  -5.497
  372   1HE   LYS  51          1HE       LYS  51   2.304  10.251  -6.524
  373   2HE   LYS  51          2HE       LYS  51   1.935   9.468  -8.062
  374   1HZ   LYS  51          1HZ       LYS  51  -0.285  10.791  -6.701
  375   2HZ   LYS  51          2HZ       LYS  51   0.085  10.714  -8.359
  376   3HZ   LYS  51          3HZ       LYS  51   0.918  11.800  -7.347
  377    H    TYR  52           H        TYR  52   2.372   3.161  -5.580
  378    HA   TYR  52           HA       TYR  52   1.430   2.366  -2.958
  379   1HB   TYR  52          1HB       TYR  52   0.488   0.300  -3.627
  380   2HB   TYR  52          2HB       TYR  52  -0.178   1.469  -4.767
  381    HD1  TYR  52           HD1      TYR  52   1.318   1.771  -6.981
  382    HD2  TYR  52           HD2      TYR  52   1.323  -1.648  -4.450
  383    HE1  TYR  52           HE1      TYR  52   2.212   0.406  -8.824
  384    HE2  TYR  52           HE2      TYR  52   2.214  -3.018  -6.285
  385    HH   TYR  52           HH       TYR  52   2.058  -2.298  -9.337
  386    H    GLY  53           H        GLY  53   2.392   0.132  -2.493
  387   1HA   GLY  53          1HA       GLY  53   4.723  -0.749  -3.792
  388   2HA   GLY  53          2HA       GLY  53   5.156   0.258  -2.416
  389    H    PHE  54           H        PHE  54   5.897  -2.391  -2.317
  390    HA   PHE  54           HA       PHE  54   3.807  -3.812  -0.911
  391   1HB   PHE  54          1HB       PHE  54   6.593  -4.620  -1.682
  392   2HB   PHE  54          2HB       PHE  54   5.468  -5.669  -0.817
  393    HD1  PHE  54           HD1      PHE  54   3.008  -5.618  -1.956
  394    HD2  PHE  54           HD2      PHE  54   6.714  -4.982  -3.946
  395    HE1  PHE  54           HE1      PHE  54   1.963  -6.250  -4.089
  396    HE2  PHE  54           HE2      PHE  54   5.681  -5.617  -6.085
  397    HZ   PHE  54           HZ       PHE  54   3.299  -6.250  -6.162
  398    H    CYS  55           H        CYS  55   3.982  -4.658   1.137
  399    HA   CYS  55           HA       CYS  55   5.256  -2.848   3.014
  400   1HB   CYS  55          1HB       CYS  55   2.811  -3.970   2.941
  401   2HB   CYS  55          2HB       CYS  55   3.645  -5.154   3.936
  402    HA   PRO  56           HA       PRO  56   8.301  -6.085   3.843
  403   1HB   PRO  56          1HB       PRO  56  10.270  -4.478   4.619
  404   2HB   PRO  56          2HB       PRO  56   9.794  -4.534   2.919
  405   1HG   PRO  56          1HG       PRO  56   9.212  -2.462   4.981
  406   2HG   PRO  56          2HG       PRO  56   9.506  -2.263   3.248
  407   1HD   PRO  56          1HD       PRO  56   6.996  -2.345   4.534
  408   2HD   PRO  56          2HD       PRO  56   7.288  -2.422   2.782
  409    H    HIS  57           H        HIS  57   9.878  -6.163   5.967
  410    HA   HIS  57           HA       HIS  57   8.191  -5.395   8.247
  411   1HB   HIS  57          1HB       HIS  57   8.822  -7.428   9.454
  412   2HB   HIS  57          2HB       HIS  57   7.988  -7.814   7.961
  413    HD1  HIS  57           HD1      HIS  57   9.349 -10.112   8.968
  414    HD2  HIS  57           HD2      HIS  57  11.464  -7.252   6.811
  415    HE1  HIS  57           HE1      HIS  57  11.377 -11.299   8.073
  416    H    GLU  58           H        GLU  58   9.305  -4.954  10.226
  417    HA   GLU  58           HA       GLU  58  12.002  -3.932   9.683
  418   1HB   GLU  58          1HB       GLU  58  11.634  -2.426  11.592
  419   2HB   GLU  58          2HB       GLU  58  10.421  -2.216  10.346
  420   1HG   GLU  58          1HG       GLU  58   8.827  -3.495  11.677
  421   2HG   GLU  58          2HG       GLU  58  10.055  -3.741  12.916
  422    H    ALA  59           H        ALA  59  10.170  -6.018  11.792
  423    HA   ALA  59           HA       ALA  59  12.540  -7.363  12.651
  424   1HB   ALA  59          1HB       ALA  59  12.960  -6.303  14.560
  425   2HB   ALA  59          2HB       ALA  59  11.346  -6.725  15.135
  426   3HB   ALA  59          3HB       ALA  59  11.607  -5.210  14.272
  Start of MODEL   12
    1   1H    ARG   1          1H        ARG   1   2.387   2.913  10.985
    2   2H    ARG   1          2H        ARG   1   3.578   3.937  11.676
    3   3H    ARG   1          3H        ARG   1   3.820   2.236  11.649
    4    HA   ARG   1           HA       ARG   1   3.331   3.260   9.066
    5   1HB   ARG   1          1HB       ARG   1   4.472   5.190  10.457
    6   2HB   ARG   1          2HB       ARG   1   5.909   4.193  10.287
    7   1HG   ARG   1          1HG       ARG   1   6.108   5.674   8.534
    8   2HG   ARG   1          2HG       ARG   1   5.381   4.265   7.762
    9   1HD   ARG   1          1HD       ARG   1   3.155   5.327   8.002
   10   2HD   ARG   1          2HD       ARG   1   3.931   6.751   8.688
   11    HE   ARG   1           HE       ARG   1   3.715   6.068   5.922
   12   1HH1  ARG   1          1HH1      ARG   1   5.743   7.742   8.232
   13   2HH1  ARG   1          2HH1      ARG   1   6.473   8.756   7.027
   14   1HH2  ARG   1          1HH2      ARG   1   4.666   7.398   4.358
   15   2HH2  ARG   1          2HH2      ARG   1   5.860   8.573   4.830
   16    H    ILE   2           H        ILE   2   4.702   2.093   7.585
   17    HA   ILE   2           HA       ILE   2   6.696   0.334   8.706
   18    HB   ILE   2           HB       ILE   2   4.537  -0.913   8.879
   19   1HG1  ILE   2          1HG1      ILE   2   6.593  -2.076   7.001
   20   2HG1  ILE   2          2HG1      ILE   2   6.636  -2.138   8.759
   21   1HG2  ILE   2          1HG2      ILE   2   4.604  -0.774   5.877
   22   2HG2  ILE   2          2HG2      ILE   2   3.362  -0.123   6.955
   23   3HG2  ILE   2          3HG2      ILE   2   3.579  -1.870   6.806
   24   1HD1  ILE   2          1HD1      ILE   2   5.512  -4.029   8.706
   25   2HD1  ILE   2          2HD1      ILE   2   5.421  -3.943   6.944
   26   3HD1  ILE   2          3HD1      ILE   2   4.158  -3.207   7.929
   27    HA   PRO   3           HA       PRO   3   8.968   1.473   5.125
   28   1HB   PRO   3          1HB       PRO   3  10.315  -0.940   4.760
   29   2HB   PRO   3          2HB       PRO   3  10.827   0.403   5.790
   30   1HG   PRO   3          1HG       PRO   3   9.343  -2.089   6.510
   31   2HG   PRO   3          2HG       PRO   3  10.634  -1.250   7.395
   32   1HD   PRO   3          1HD       PRO   3   8.103  -1.002   8.182
   33   2HD   PRO   3          2HD       PRO   3   9.176   0.417   8.172
   34    H    VAL   4           H        VAL   4   9.408   1.025   2.946
   35    HA   VAL   4           HA       VAL   4   7.672  -0.939   1.581
   36    HB   VAL   4           HB       VAL   4   8.168   1.925   0.611
   37   1HG1  VAL   4          1HG1      VAL   4   7.810   0.794  -1.332
   38   2HG1  VAL   4          2HG1      VAL   4   6.147   1.162  -0.879
   39   3HG1  VAL   4          3HG1      VAL   4   6.810  -0.441  -0.568
   40   1HG2  VAL   4          1HG2      VAL   4   6.324   1.099   2.538
   41   2HG2  VAL   4          2HG2      VAL   4   5.403   1.301   1.048
   42   3HG2  VAL   4          3HG2      VAL   4   6.370   2.636   1.678
   43    H    LYS   5           H        LYS   5   8.502  -1.672  -0.456
   44    HA   LYS   5           HA       LYS   5  11.289  -0.920  -0.835
   45   1HB   LYS   5          1HB       LYS   5  11.423  -3.521  -1.455
   46   2HB   LYS   5          2HB       LYS   5  11.962  -2.764   0.034
   47   1HG   LYS   5          1HG       LYS   5   9.713  -3.315   0.994
   48   2HG   LYS   5          2HG       LYS   5   9.441  -4.309  -0.452
   49   1HD   LYS   5          1HD       LYS   5  11.524  -5.468  -0.064
   50   2HD   LYS   5          2HD       LYS   5  11.801  -4.492   1.378
   51   1HE   LYS   5          1HE       LYS   5   9.350  -6.222   1.085
   52   2HE   LYS   5          2HE       LYS   5  10.866  -6.883   1.692
   53   1HZ   LYS   5          1HZ       LYS   5  10.814  -5.178   3.454
   54   2HZ   LYS   5          2HZ       LYS   5   9.502  -6.250   3.520
   55   3HZ   LYS   5          3HZ       LYS   5   9.280  -4.678   2.909
   56    H    TYR   6           H        TYR   6   8.857  -3.049  -2.435
   57    HA   TYR   6           HA       TYR   6   9.929  -2.051  -4.984
   58   1HB   TYR   6          1HB       TYR   6   8.014  -4.361  -4.632
   59   2HB   TYR   6          2HB       TYR   6   8.990  -3.971  -6.045
   60    HD1  TYR   6           HD1      TYR   6  11.660  -3.695  -5.263
   61    HD2  TYR   6           HD2      TYR   6   8.737  -6.269  -3.542
   62    HE1  TYR   6           HE1      TYR   6  13.437  -5.157  -4.422
   63    HE2  TYR   6           HE2      TYR   6  10.509  -7.734  -2.698
   64    HH   TYR   6           HH       TYR   6  13.013  -7.437  -2.083
   65    H    GLY   7           H        GLY   7   8.446  -1.557  -6.731
   66   1HA   GLY   7          1HA       GLY   7   6.062  -1.220  -7.323
   67   2HA   GLY   7          2HA       GLY   7   5.879  -0.413  -5.776
   68    H    ASN   8           H        ASN   8   5.184   1.503  -6.815
   69    HA   ASN   8           HA       ASN   8   7.306   2.902  -8.329
   70   1HB   ASN   8          1HB       ASN   8   5.661   4.019  -9.604
   71   2HB   ASN   8          2HB       ASN   8   5.128   2.344  -9.521
   72   1HD2  ASN   8          1HD2      ASN   8   3.613   4.853  -9.965
   73   2HD2  ASN   8          2HD2      ASN   8   2.417   4.871  -8.712
   74    H    ALA   9           H        ALA   9   6.145   2.780  -5.355
   75    HA   ALA   9           HA       ALA   9   5.393   5.343  -4.564
   76   1HB   ALA   9          1HB       ALA   9   7.043   3.795  -2.706
   77   2HB   ALA   9          2HB       ALA   9   5.605   2.995  -3.342
   78   3HB   ALA   9          3HB       ALA   9   5.458   4.535  -2.494
   79    H    ASP  10           H        ASP  10   6.473   7.120  -3.852
   80    HA   ASP  10           HA       ASP  10   8.912   7.790  -5.038
   81   1HB   ASP  10          1HB       ASP  10   7.134   9.386  -4.217
   82   2HB   ASP  10          2HB       ASP  10   7.728   9.103  -2.582
   83    H    GLY  11           H        GLY  11   8.194   6.699  -1.747
   84   1HA   GLY  11          1HA       GLY  11  10.347   5.248  -1.145
   85   2HA   GLY  11          2HA       GLY  11  11.010   6.870  -1.017
   86    H    GLU  12           H        GLU  12   7.902   7.239  -0.204
   87    HA   GLU  12           HA       GLU  12   8.461   7.415   2.606
   88   1HB   GLU  12          1HB       GLU  12   6.043   7.977   0.907
   89   2HB   GLU  12          2HB       GLU  12   5.933   7.985   2.660
   90   1HG   GLU  12          1HG       GLU  12   7.872   9.670   1.109
   91   2HG   GLU  12          2HG       GLU  12   6.265  10.211   1.594
   92    H    TYR  13           H        TYR  13   7.262   6.316   4.265
   93    HA   TYR  13           HA       TYR  13   6.877   3.544   3.626
   94   1HB   TYR  13          1HB       TYR  13   6.329   4.944   6.245
   95   2HB   TYR  13          2HB       TYR  13   6.513   3.207   5.989
   96    HD1  TYR  13           HD1      TYR  13   8.885   3.103   4.256
   97    HD2  TYR  13           HD2      TYR  13   8.095   5.510   7.673
   98    HE1  TYR  13           HE1      TYR  13  11.290   3.215   4.721
   99    HE2  TYR  13           HE2      TYR  13  10.504   5.632   8.146
  100    HH   TYR  13           HH       TYR  13  12.742   3.595   6.833
  101    H    CYS  14           H        CYS  14   4.856   2.492   4.735
  102    HA   CYS  14           HA       CYS  14   2.655   3.067   3.179
  103   1HB   CYS  14          1HB       CYS  14   2.847   1.692   5.845
  104   2HB   CYS  14          2HB       CYS  14   1.374   1.723   4.882
  105    H    LYS  15           H        LYS  15   1.152   4.558   3.167
  106    HA   LYS  15           HA       LYS  15   0.969   6.460   5.351
  107   1HB   LYS  15          1HB       LYS  15   0.931   7.078   2.870
  108   2HB   LYS  15          2HB       LYS  15  -0.688   6.395   2.810
  109   1HG   LYS  15          1HG       LYS  15   0.083   8.622   4.686
  110   2HG   LYS  15          2HG       LYS  15  -0.536   8.904   3.056
  111   1HD   LYS  15          1HD       LYS  15  -2.581   7.666   3.630
  112   2HD   LYS  15          2HD       LYS  15  -1.952   7.410   5.263
  113   1HE   LYS  15          1HE       LYS  15  -1.870   9.873   5.559
  114   2HE   LYS  15          2HE       LYS  15  -2.623  10.054   3.974
  115   1HZ   LYS  15          1HZ       LYS  15  -3.837   9.492   6.480
  116   2HZ   LYS  15          2HZ       LYS  15  -4.225   8.286   5.342
  117   3HZ   LYS  15          3HZ       LYS  15  -4.563   9.908   5.005
  118    H    PHE  16           H        PHE  16  -0.321   6.048   7.036
  119    HA   PHE  16           HA       PHE  16  -2.752   4.450   6.546
  120   1HB   PHE  16          1HB       PHE  16  -0.994   4.518   9.006
  121   2HB   PHE  16          2HB       PHE  16  -2.543   3.698   8.917
  122    HD1  PHE  16           HD1      PHE  16   0.189   2.483   9.546
  123    HD2  PHE  16           HD2      PHE  16  -2.063   2.825   5.959
  124    HE1  PHE  16           HE1      PHE  16   1.267   0.454   8.691
  125    HE2  PHE  16           HE2      PHE  16  -1.002   0.801   5.086
  126    HZ   PHE  16           HZ       PHE  16   0.680  -0.417   6.435
  127    HA   PRO  17           HA       PRO  17  -4.426   4.164   6.784
  128   1HB   PRO  17          1HB       PRO  17  -7.014   4.865   6.440
  129   2HB   PRO  17          2HB       PRO  17  -6.382   4.240   7.967
  130   1HG   PRO  17          1HG       PRO  17  -7.265   6.960   7.307
  131   2HG   PRO  17          2HG       PRO  17  -7.025   6.216   8.894
  132   1HD   PRO  17          1HD       PRO  17  -5.258   7.988   7.439
  133   2HD   PRO  17          2HD       PRO  17  -5.078   7.352   9.087
  134    H    PHE  18           H        PHE  18  -4.918   3.642   4.619
  135    HA   PHE  18           HA       PHE  18  -4.906   5.960   2.807
  136   1HB   PHE  18          1HB       PHE  18  -3.845   4.602   1.108
  137   2HB   PHE  18          2HB       PHE  18  -2.894   4.554   2.582
  138    HD1  PHE  18           HD1      PHE  18  -2.884   2.503   3.972
  139    HD2  PHE  18           HD2      PHE  18  -4.767   2.659   0.162
  140    HE1  PHE  18           HE1      PHE  18  -2.873   0.049   3.869
  141    HE2  PHE  18           HE2      PHE  18  -4.763   0.212   0.047
  142    HZ   PHE  18           HZ       PHE  18  -3.796  -1.121   1.894
  143    H    LEU  19           H        LEU  19  -6.241   5.872   0.909
  144    HA   LEU  19           HA       LEU  19  -8.693   4.402   1.455
  145   1HB   LEU  19          1HB       LEU  19  -8.723   6.830   0.974
  146   2HB   LEU  19          2HB       LEU  19  -8.144   6.492  -0.644
  147    HG   LEU  19           HG       LEU  19 -10.239   5.055  -0.921
  148   1HD1  LEU  19          1HD1      LEU  19 -10.777   6.404   1.689
  149   2HD1  LEU  19          2HD1      LEU  19 -11.085   4.737   1.200
  150   3HD1  LEU  19          3HD1      LEU  19 -12.109   6.039   0.592
  151   1HD2  LEU  19          1HD2      LEU  19 -11.547   6.935  -1.615
  152   2HD2  LEU  19          2HD2      LEU  19  -9.851   7.299  -1.930
  153   3HD2  LEU  19          3HD2      LEU  19 -10.658   8.013  -0.537
  154    H    PHE  20           H        PHE  20  -9.170   2.581   0.531
  155    HA   PHE  20           HA       PHE  20  -8.223   2.020  -2.210
  156   1HB   PHE  20          1HB       PHE  20  -7.079   0.627  -0.350
  157   2HB   PHE  20          2HB       PHE  20  -8.670  -0.060  -0.090
  158    HD1  PHE  20           HD1      PHE  20  -7.259  -2.132  -0.468
  159    HD2  PHE  20           HD2      PHE  20  -8.284   0.629  -3.537
  160    HE1  PHE  20           HE1      PHE  20  -6.903  -3.897  -2.147
  161    HE2  PHE  20           HE2      PHE  20  -7.930  -1.133  -5.225
  162    HZ   PHE  20           HZ       PHE  20  -7.247  -3.394  -4.536
  163    H    ASN  21           H        ASN  21 -10.106   2.320  -3.330
  164    HA   ASN  21           HA       ASN  21 -12.276   2.143  -3.994
  165   1HB   ASN  21          1HB       ASN  21 -11.698  -0.546  -2.808
  166   2HB   ASN  21          2HB       ASN  21 -13.332  -0.175  -3.349
  167   1HD2  ASN  21          1HD2      ASN  21 -13.694  -0.973  -5.288
  168   2HD2  ASN  21          2HD2      ASN  21 -12.566  -1.028  -6.597
  169    H    GLY  22           H        GLY  22 -11.918   3.538  -1.536
  170   1HA   GLY  22          1HA       GLY  22 -13.543   4.614  -0.241
  171   2HA   GLY  22          2HA       GLY  22 -14.644   3.286  -0.551
  172    H    LYS  23           H        LYS  23 -11.719   1.989   0.428
  173    HA   LYS  23           HA       LYS  23 -12.648   1.959   3.224
  174   1HB   LYS  23          1HB       LYS  23 -12.872  -0.240   2.050
  175   2HB   LYS  23          2HB       LYS  23 -11.130  -0.247   1.814
  176   1HG   LYS  23          1HG       LYS  23 -10.827  -0.227   4.258
  177   2HG   LYS  23          2HG       LYS  23 -12.569  -0.276   4.467
  178   1HD   LYS  23          1HD       LYS  23 -11.115  -2.366   2.882
  179   2HD   LYS  23          2HD       LYS  23 -11.244  -2.472   4.638
  180   1HE   LYS  23          1HE       LYS  23 -13.019  -3.740   3.739
  181   2HE   LYS  23          2HE       LYS  23 -13.714  -2.257   4.387
  182   1HZ   LYS  23          1HZ       LYS  23 -12.986  -2.330   1.541
  183   2HZ   LYS  23          2HZ       LYS  23 -14.232  -1.473   2.321
  184   3HZ   LYS  23          3HZ       LYS  23 -14.393  -3.141   2.044
  185    H    GLU  24           H        GLU  24 -11.253   2.702   4.708
  186    HA   GLU  24           HA       GLU  24  -8.559   3.382   3.824
  187   1HB   GLU  24          1HB       GLU  24 -10.174   4.221   6.229
  188   2HB   GLU  24          2HB       GLU  24  -8.502   4.695   5.975
  189   1HG   GLU  24          1HG       GLU  24  -9.140   5.800   3.891
  190   2HG   GLU  24          2HG       GLU  24 -10.815   5.323   4.154
  191    H    TYR  25           H        TYR  25  -6.897   2.160   4.312
  192    HA   TYR  25           HA       TYR  25  -7.191   0.120   6.400
  193   1HB   TYR  25          1HB       TYR  25  -5.249   0.335   4.118
  194   2HB   TYR  25          2HB       TYR  25  -5.205  -0.940   5.320
  195    HD1  TYR  25           HD1      TYR  25  -7.347   0.580   2.715
  196    HD2  TYR  25           HD2      TYR  25  -6.482  -2.885   5.020
  197    HE1  TYR  25           HE1      TYR  25  -8.927  -0.713   1.328
  198    HE2  TYR  25           HE2      TYR  25  -8.058  -4.197   3.633
  199    HH   TYR  25           HH       TYR  25 -10.119  -2.678   1.234
  200    H    ASN  26           H        ASN  26  -5.901  -0.015   8.119
  201    HA   ASN  26           HA       ASN  26  -3.840   2.076   8.441
  202   1HB   ASN  26          1HB       ASN  26  -5.577   0.641  10.443
  203   2HB   ASN  26          2HB       ASN  26  -4.084   1.429  10.932
  204   1HD2  ASN  26          1HD2      ASN  26  -7.327   1.827  10.571
  205   2HD2  ASN  26          2HD2      ASN  26  -7.402   3.552  10.524
  206    H    SER  27           H        SER  27  -3.846  -0.669   7.194
  207    HA   SER  27           HA       SER  27  -1.268  -1.493   8.185
  208   1HB   SER  27          1HB       SER  27  -2.057  -3.890   8.470
  209   2HB   SER  27          2HB       SER  27  -2.605  -2.763   9.722
  210    HG   SER  27           HG       SER  27  -4.059  -4.068   7.716
  211    H    CYS  28           H        CYS  28  -0.595  -3.551   6.854
  212    HA   CYS  28           HA       CYS  28  -1.048  -2.880   4.079
  213   1HB   CYS  28          1HB       CYS  28   0.625  -5.081   5.325
  214   2HB   CYS  28          2HB       CYS  28   0.611  -4.657   3.615
  215    H    THR  29           H        THR  29  -2.312  -4.004   2.657
  216    HA   THR  29           HA       THR  29  -3.613  -6.407   3.699
  217    HB   THR  29           HB       THR  29  -5.145  -4.480   3.689
  218    HG1  THR  29           HG1      THR  29  -6.346  -6.181   3.372
  219   1HG2  THR  29          1HG2      THR  29  -4.077  -3.360   1.650
  220   2HG2  THR  29          2HG2      THR  29  -5.832  -3.306   1.808
  221   3HG2  THR  29          3HG2      THR  29  -5.077  -4.447   0.694
  222    H    ASP  30           H        ASP  30  -4.428  -7.907   2.012
  223    HA   ASP  30           HA       ASP  30  -2.601  -7.913  -0.266
  224   1HB   ASP  30          1HB       ASP  30  -4.148 -10.314   0.012
  225   2HB   ASP  30          2HB       ASP  30  -2.430 -10.140  -0.134
  226    H    THR  31           H        THR  31  -5.474  -6.817   0.445
  227    HA   THR  31           HA       THR  31  -7.304  -7.863  -1.389
  228    HB   THR  31           HB       THR  31  -7.092  -5.016  -0.381
  229    HG1  THR  31           HG1      THR  31  -7.313  -6.135   1.435
  230   1HG2  THR  31          1HG2      THR  31  -9.415  -4.783  -0.744
  231   2HG2  THR  31          2HG2      THR  31  -9.575  -6.484  -1.194
  232   3HG2  THR  31          3HG2      THR  31  -8.703  -5.368  -2.247
  233    H    GLY  32           H        GLY  32  -7.588  -7.584  -3.533
  234   1HA   GLY  32          1HA       GLY  32  -7.401  -6.512  -5.605
  235   2HA   GLY  32          2HA       GLY  32  -6.205  -5.432  -4.907
  236    H    ARG  33           H        ARG  33  -4.842  -7.792  -3.689
  237    HA   ARG  33           HA       ARG  33  -3.277  -8.560  -6.047
  238   1HB   ARG  33          1HB       ARG  33  -2.590  -8.889  -3.115
  239   2HB   ARG  33          2HB       ARG  33  -1.518  -9.165  -4.477
  240   1HG   ARG  33          1HG       ARG  33  -2.707  -6.498  -3.753
  241   2HG   ARG  33          2HG       ARG  33  -1.099  -7.043  -3.274
  242   1HD   ARG  33          1HD       ARG  33  -2.083  -6.678  -6.106
  243   2HD   ARG  33          2HD       ARG  33  -1.027  -5.570  -5.232
  244    HE   ARG  33           HE       ARG  33   0.044  -8.223  -5.376
  245   1HH1  ARG  33          1HH1      ARG  33  -0.279  -5.174  -7.065
  246   2HH1  ARG  33          2HH1      ARG  33   1.062  -5.485  -8.128
  247   1HH2  ARG  33          1HH2      ARG  33   1.811  -8.619  -6.766
  248   2HH2  ARG  33          2HH2      ARG  33   2.219  -7.440  -7.974
  249    H    SER  34           H        SER  34  -3.917 -10.465  -6.913
  250    HA   SER  34           HA       SER  34  -5.258 -12.453  -5.306
  251   1HB   SER  34          1HB       SER  34  -4.251 -12.677  -8.161
  252   2HB   SER  34          2HB       SER  34  -5.426 -13.731  -7.369
  253    HG   SER  34           HG       SER  34  -6.116 -11.815  -8.804
  254    H    ASP  35           H        ASP  35  -2.134 -11.543  -5.729
  255    HA   ASP  35           HA       ASP  35  -0.911 -14.135  -5.638
  256   1HB   ASP  35          1HB       ASP  35   0.761 -11.827  -5.118
  257   2HB   ASP  35          2HB       ASP  35   0.973 -13.099  -6.293
  258    H    GLY  36           H        GLY  36  -2.317 -12.141  -3.486
  259   1HA   GLY  36          1HA       GLY  36  -2.417 -12.115  -1.190
  260   2HA   GLY  36          2HA       GLY  36  -1.480 -13.599  -1.224
  261    H    PHE  37           H        PHE  37  -0.697 -10.268  -2.241
  262    HA   PHE  37           HA       PHE  37   1.629 -10.417  -0.437
  263   1HB   PHE  37          1HB       PHE  37   1.301  -9.263  -3.170
  264   2HB   PHE  37          2HB       PHE  37   2.421  -8.480  -2.065
  265    HD1  PHE  37           HD1      PHE  37   1.581 -11.967  -3.125
  266    HD2  PHE  37           HD2      PHE  37   4.607  -9.100  -2.266
  267    HE1  PHE  37           HE1      PHE  37   3.310 -13.616  -3.711
  268    HE2  PHE  37           HE2      PHE  37   6.341 -10.745  -2.852
  269    HZ   PHE  37           HZ       PHE  37   5.690 -13.008  -3.579
  270    H    LEU  38           H        LEU  38   2.063  -8.752   0.930
  271    HA   LEU  38           HA       LEU  38  -0.135  -7.006   1.562
  272   1HB   LEU  38          1HB       LEU  38   2.598  -7.242   2.753
  273   2HB   LEU  38          2HB       LEU  38   1.321  -6.245   3.404
  274    HG   LEU  38           HG       LEU  38   1.249  -9.252   3.171
  275   1HD1  LEU  38          1HD1      LEU  38   2.496  -9.185   5.018
  276   2HD1  LEU  38          2HD1      LEU  38   1.056  -8.574   5.830
  277   3HD1  LEU  38          3HD1      LEU  38   2.266  -7.447   5.219
  278   1HD2  LEU  38          1HD2      LEU  38  -0.892  -9.237   3.884
  279   2HD2  LEU  38          2HD2      LEU  38  -0.906  -7.645   3.133
  280   3HD2  LEU  38          3HD2      LEU  38  -0.671  -7.794   4.874
  281    H    TRP  39           H        TRP  39  -0.403  -4.959   0.930
  282    HA   TRP  39           HA       TRP  39   1.941  -3.408   0.139
  283   1HB   TRP  39          1HB       TRP  39   0.960  -2.683  -1.952
  284   2HB   TRP  39          2HB       TRP  39   1.003  -4.438  -1.928
  285    HD1  TRP  39           HD1      TRP  39  -1.379  -5.707  -1.549
  286    HE1  TRP  39           HE1      TRP  39  -3.759  -4.971  -2.161
  287    HE3  TRP  39           HE3      TRP  39  -0.565  -0.697  -2.137
  288    HZ2  TRP  39           HZ2      TRP  39  -5.108  -2.588  -2.798
  289    HZ3  TRP  39           HZ3      TRP  39  -2.470   0.736  -2.744
  290    HH2  TRP  39           HH2      TRP  39  -4.695  -0.201  -3.065
  291    H    CYS  40           H        CYS  40   1.202  -1.097  -0.412
  292    HA   CYS  40           HA       CYS  40  -1.139  -0.094   0.938
  293   1HB   CYS  40          1HB       CYS  40   0.125   1.295   2.539
  294   2HB   CYS  40          2HB       CYS  40   0.401  -0.419   2.843
  295    H    SER  41           H        SER  41  -1.108   2.408   0.712
  296    HA   SER  41           HA       SER  41   0.342   3.040  -1.762
  297   1HB   SER  41          1HB       SER  41  -1.333   4.824  -2.118
  298   2HB   SER  41          2HB       SER  41  -2.080   3.232  -2.005
  299    HG   SER  41           HG       SER  41  -2.279   5.419  -0.325
  300    H    THR  42           H        THR  42   1.102   5.283  -2.003
  301    HA   THR  42           HA       THR  42   2.413   6.139   0.456
  302    HB   THR  42           HB       THR  42   2.799   7.309  -2.296
  303    HG1  THR  42           HG1      THR  42   3.485   4.810  -1.354
  304   1HG2  THR  42          1HG2      THR  42   4.855   6.886  -0.151
  305   2HG2  THR  42          2HG2      THR  42   3.901   8.365  -0.288
  306   3HG2  THR  42          3HG2      THR  42   4.968   7.879  -1.607
  307    H    THR  43           H        THR  43  -0.114   7.043  -1.688
  308    HA   THR  43           HA       THR  43  -0.351   9.697  -0.460
  309    HB   THR  43           HB       THR  43  -1.904  10.146  -2.367
  310    HG1  THR  43           HG1      THR  43  -2.533   8.572  -3.595
  311   1HG2  THR  43          1HG2      THR  43   0.606  10.531  -2.545
  312   2HG2  THR  43          2HG2      THR  43  -0.303  10.409  -4.052
  313   3HG2  THR  43          3HG2      THR  43   0.650   9.039  -3.479
  314    H    TYR  44           H        TYR  44  -2.862  10.335  -0.424
  315    HA   TYR  44           HA       TYR  44  -4.052   8.513   1.462
  316   1HB   TYR  44          1HB       TYR  44  -4.186  11.164   1.325
  317   2HB   TYR  44          2HB       TYR  44  -5.591  10.809   0.317
  318    HD1  TYR  44           HD1      TYR  44  -6.777   8.471   1.669
  319    HD2  TYR  44           HD2      TYR  44  -5.013  11.965   3.350
  320    HE1  TYR  44           HE1      TYR  44  -8.127   8.170   3.700
  321    HE2  TYR  44           HE2      TYR  44  -6.364  11.671   5.382
  322    HH   TYR  44           HH       TYR  44  -8.430   8.820   5.828
  323    H    ASN  45           H        ASN  45  -4.922   9.751  -1.765
  324    HA   ASN  45           HA       ASN  45  -6.934   7.629  -1.980
  325   1HB   ASN  45          1HB       ASN  45  -7.490  10.033  -2.573
  326   2HB   ASN  45          2HB       ASN  45  -6.404   9.880  -3.933
  327   1HD2  ASN  45          1HD2      ASN  45  -7.439   6.979  -4.186
  328   2HD2  ASN  45          2HD2      ASN  45  -8.924   7.261  -4.969
  329    H    PHE  46           H        PHE  46  -6.012   5.760  -2.621
  330    HA   PHE  46           HA       PHE  46  -3.676   5.618  -4.245
  331   1HB   PHE  46          1HB       PHE  46  -4.124   3.856  -2.656
  332   2HB   PHE  46          2HB       PHE  46  -5.688   3.497  -3.436
  333    HD1  PHE  46           HD1      PHE  46  -2.073   3.829  -4.479
  334    HD2  PHE  46           HD2      PHE  46  -5.695   1.599  -4.741
  335    HE1  PHE  46           HE1      PHE  46  -0.976   2.210  -5.960
  336    HE2  PHE  46           HE2      PHE  46  -4.594  -0.025  -6.215
  337    HZ   PHE  46           HZ       PHE  46  -2.227   0.279  -6.825
  338    H    GLU  47           H        GLU  47  -7.105   5.115  -4.863
  339    HA   GLU  47           HA       GLU  47  -7.043   4.128  -7.444
  340   1HB   GLU  47          1HB       GLU  47  -8.998   4.531  -5.815
  341   2HB   GLU  47          2HB       GLU  47  -9.075   6.135  -6.515
  342   1HG   GLU  47          1HG       GLU  47  -9.614   5.282  -8.648
  343   2HG   GLU  47          2HG       GLU  47  -9.257   3.625  -8.148
  344    H    LYS  48           H        LYS  48  -6.853   7.488  -6.375
  345    HA   LYS  48           HA       LYS  48  -6.900   8.507  -9.060
  346   1HB   LYS  48          1HB       LYS  48  -7.914   9.785  -7.277
  347   2HB   LYS  48          2HB       LYS  48  -6.390   9.853  -6.412
  348   1HG   LYS  48          1HG       LYS  48  -6.693  11.968  -7.393
  349   2HG   LYS  48          2HG       LYS  48  -5.466  11.151  -8.359
  350   1HD   LYS  48          1HD       LYS  48  -8.314  10.920  -9.205
  351   2HD   LYS  48          2HD       LYS  48  -7.484  12.453  -9.472
  352   1HE   LYS  48          1HE       LYS  48  -6.588   9.742 -10.463
  353   2HE   LYS  48          2HE       LYS  48  -7.335  11.010 -11.434
  354   1HZ   LYS  48          1HZ       LYS  48  -5.392  12.052 -11.661
  355   2HZ   LYS  48          2HZ       LYS  48  -4.657  10.650 -11.043
  356   3HZ   LYS  48          3HZ       LYS  48  -5.028  11.936 -10.007
  357    H    ASP  49           H        ASP  49  -4.402   8.555  -6.472
  358    HA   ASP  49           HA       ASP  49  -2.428   9.589  -8.245
  359   1HB   ASP  49          1HB       ASP  49  -2.234   8.443  -5.461
  360   2HB   ASP  49          2HB       ASP  49  -0.838   9.049  -6.345
  361    H    GLY  50           H        GLY  50  -2.734   6.424  -6.667
  362   1HA   GLY  50          1HA       GLY  50  -2.314   4.349  -7.680
  363   2HA   GLY  50          2HA       GLY  50  -1.541   5.192  -9.010
  364    H    LYS  51           H        LYS  51  -0.407   6.336  -6.028
  365    HA   LYS  51           HA       LYS  51   2.137   5.023  -6.477
  366   1HB   LYS  51          1HB       LYS  51   1.218   7.123  -4.522
  367   2HB   LYS  51          2HB       LYS  51   2.791   6.363  -4.383
  368   1HG   LYS  51          1HG       LYS  51   3.245   8.303  -5.526
  369   2HG   LYS  51          2HG       LYS  51   3.113   7.116  -6.821
  370   1HD   LYS  51          1HD       LYS  51   0.836   7.856  -7.280
  371   2HD   LYS  51          2HD       LYS  51   0.931   9.016  -5.950
  372   1HE   LYS  51          1HE       LYS  51   2.782  10.151  -7.095
  373   2HE   LYS  51          2HE       LYS  51   2.644   9.009  -8.433
  374   1HZ   LYS  51          1HZ       LYS  51   1.186  10.400  -9.322
  375   2HZ   LYS  51          2HZ       LYS  51   1.157  11.374  -7.932
  376   3HZ   LYS  51          3HZ       LYS  51   0.115  10.046  -8.056
  377    H    TYR  52           H        TYR  52   2.696   3.145  -5.573
  378    HA   TYR  52           HA       TYR  52   1.732   2.453  -2.917
  379   1HB   TYR  52          1HB       TYR  52   0.778   0.368  -3.573
  380   2HB   TYR  52          2HB       TYR  52   0.071   1.580  -4.639
  381    HD1  TYR  52           HD1      TYR  52   1.432   1.943  -6.909
  382    HD2  TYR  52           HD2      TYR  52   1.592  -1.572  -4.516
  383    HE1  TYR  52           HE1      TYR  52   2.256   0.674  -8.839
  384    HE2  TYR  52           HE2      TYR  52   2.413  -2.855  -6.443
  385    HH   TYR  52           HH       TYR  52   3.563  -2.467  -8.568
  386    H    GLY  53           H        GLY  53   2.628   0.202  -2.388
  387   1HA   GLY  53          1HA       GLY  53   4.950  -0.720  -3.715
  388   2HA   GLY  53          2HA       GLY  53   5.381   0.230  -2.305
  389    H    PHE  54           H        PHE  54   6.087  -2.398  -2.366
  390    HA   PHE  54           HA       PHE  54   4.014  -3.847  -0.928
  391   1HB   PHE  54          1HB       PHE  54   6.731  -4.735  -1.883
  392   2HB   PHE  54          2HB       PHE  54   5.573  -5.776  -1.064
  393    HD1  PHE  54           HD1      PHE  54   3.093  -5.448  -2.171
  394    HD2  PHE  54           HD2      PHE  54   6.843  -5.071  -4.135
  395    HE1  PHE  54           HE1      PHE  54   2.004  -5.931  -4.315
  396    HE2  PHE  54           HE2      PHE  54   5.765  -5.551  -6.293
  397    HZ   PHE  54           HZ       PHE  54   3.345  -5.986  -6.389
  398    H    CYS  55           H        CYS  55   4.001  -4.242   1.179
  399    HA   CYS  55           HA       CYS  55   6.349  -3.382   2.734
  400   1HB   CYS  55          1HB       CYS  55   4.592  -2.756   4.508
  401   2HB   CYS  55          2HB       CYS  55   4.773  -1.685   3.116
  402    HA   PRO  56           HA       PRO  56   4.862  -7.607   4.152
  403   1HB   PRO  56          1HB       PRO  56   6.634  -9.275   3.022
  404   2HB   PRO  56          2HB       PRO  56   5.168  -8.767   2.174
  405   1HG   PRO  56          1HG       PRO  56   7.978  -7.858   1.819
  406   2HG   PRO  56          2HG       PRO  56   6.699  -8.058   0.610
  407   1HD   PRO  56          1HD       PRO  56   7.484  -5.640   1.766
  408   2HD   PRO  56          2HD       PRO  56   5.966  -5.928   0.899
  409    H    HIS  57           H        HIS  57   5.680  -8.446   6.016
  410    HA   HIS  57           HA       HIS  57   8.326  -7.467   6.834
  411   1HB   HIS  57          1HB       HIS  57   6.191  -6.972   8.193
  412   2HB   HIS  57          2HB       HIS  57   6.249  -8.666   8.666
  413    HD1  HIS  57           HD1      HIS  57   8.850  -9.291   9.651
  414    HD2  HIS  57           HD2      HIS  57   7.389  -5.414  10.009
  415    HE1  HIS  57           HE1      HIS  57  10.201  -8.230  11.488
  416    H    GLU  58           H        GLU  58   9.006  -9.241   5.293
  417    HA   GLU  58           HA       GLU  58   8.656 -11.941   6.047
  418   1HB   GLU  58          1HB       GLU  58  10.412 -12.435   4.387
  419   2HB   GLU  58          2HB       GLU  58   9.158 -11.384   3.750
  420   1HG   GLU  58          1HG       GLU  58  11.802 -10.375   4.769
  421   2HG   GLU  58          2HG       GLU  58  11.512 -10.824   3.091
  422    H    ALA  59           H        ALA  59  11.337  -9.663   6.534
  423    HA   ALA  59           HA       ALA  59  12.115 -11.041   8.938
  424   1HB   ALA  59          1HB       ALA  59  13.273 -12.432   7.308
  425   2HB   ALA  59          2HB       ALA  59  14.426 -11.487   8.249
  426   3HB   ALA  59          3HB       ALA  59  14.027 -11.005   6.600
  Start of MODEL   13
    1   1H    ARG   1          1H        ARG   1   7.570   5.377  10.314
    2   2H    ARG   1          2H        ARG   1   7.606   3.660  10.313
    3   3H    ARG   1          3H        ARG   1   6.340   4.496  11.125
    4    HA   ARG   1           HA       ARG   1   5.785   3.496   8.940
    5   1HB   ARG   1          1HB       ARG   1   4.587   5.333  10.199
    6   2HB   ARG   1          2HB       ARG   1   5.471   6.489   9.215
    7   1HG   ARG   1          1HG       ARG   1   4.446   5.347   7.196
    8   2HG   ARG   1          2HG       ARG   1   3.381   4.520   8.340
    9   1HD   ARG   1          1HD       ARG   1   2.253   6.468   7.549
   10   2HD   ARG   1          2HD       ARG   1   2.721   6.748   9.231
   11    HE   ARG   1           HE       ARG   1   4.639   7.673   7.284
   12   1HH1  ARG   1          1HH1      ARG   1   1.863   8.496   9.250
   13   2HH1  ARG   1          2HH1      ARG   1   2.105  10.207   9.096
   14   1HH2  ARG   1          1HH2      ARG   1   4.972   9.922   7.118
   15   2HH2  ARG   1          2HH2      ARG   1   3.851  11.015   7.877
   16    H    ILE   2           H        ILE   2   7.490   2.944   7.531
   17    HA   ILE   2           HA       ILE   2   7.919   4.699   5.371
   18    HB   ILE   2           HB       ILE   2   9.410   5.655   7.206
   19   1HG1  ILE   2          1HG1      ILE   2  10.713   4.919   4.573
   20   2HG1  ILE   2          2HG1      ILE   2   9.594   6.259   4.819
   21   1HG2  ILE   2          1HG2      ILE   2  10.351   3.054   7.357
   22   2HG2  ILE   2          2HG2      ILE   2  11.079   4.481   8.096
   23   3HG2  ILE   2          3HG2      ILE   2  11.636   3.930   6.518
   24   1HD1  ILE   2          1HD1      ILE   2  11.635   7.314   4.914
   25   2HD1  ILE   2          2HD1      ILE   2  12.416   5.956   5.721
   26   3HD1  ILE   2          3HD1      ILE   2  11.323   7.003   6.626
   27    HA   PRO   3           HA       PRO   3  10.282   0.450   4.862
   28   1HB   PRO   3          1HB       PRO   3   8.276  -1.439   5.829
   29   2HB   PRO   3          2HB       PRO   3  10.009  -1.359   6.173
   30   1HG   PRO   3          1HG       PRO   3   8.150  -0.755   8.021
   31   2HG   PRO   3          2HG       PRO   3   9.723   0.062   7.961
   32   1HD   PRO   3          1HD       PRO   3   7.050   1.015   6.954
   33   2HD   PRO   3          2HD       PRO   3   8.302   1.907   7.847
   34    H    VAL   4           H        VAL   4   9.287   1.524   2.864
   35    HA   VAL   4           HA       VAL   4   7.334  -0.326   1.620
   36    HB   VAL   4           HB       VAL   4   8.079   2.524   0.805
   37   1HG1  VAL   4          1HG1      VAL   4   6.596   0.364  -0.623
   38   2HG1  VAL   4          2HG1      VAL   4   7.696   1.590  -1.256
   39   3HG1  VAL   4          3HG1      VAL   4   6.052   2.030  -0.791
   40   1HG2  VAL   4          1HG2      VAL   4   6.173   3.221   1.772
   41   2HG2  VAL   4          2HG2      VAL   4   6.242   1.705   2.671
   42   3HG2  VAL   4          3HG2      VAL   4   5.264   1.820   1.208
   43    H    LYS   5           H        LYS   5   8.047  -1.570  -0.123
   44    HA   LYS   5           HA       LYS   5  10.826  -1.030  -0.928
   45   1HB   LYS   5          1HB       LYS   5   9.796  -3.312   0.308
   46   2HB   LYS   5          2HB       LYS   5  10.019  -3.777  -1.371
   47   1HG   LYS   5          1HG       LYS   5  12.140  -2.631   0.443
   48   2HG   LYS   5          2HG       LYS   5  11.972  -4.322  -0.018
   49   1HD   LYS   5          1HD       LYS   5  13.587  -3.615  -1.501
   50   2HD   LYS   5          2HD       LYS   5  12.121  -3.371  -2.454
   51   1HE   LYS   5          1HE       LYS   5  12.140  -0.994  -1.537
   52   2HE   LYS   5          2HE       LYS   5  13.785  -1.323  -0.998
   53   1HZ   LYS   5          1HZ       LYS   5  14.562  -1.482  -3.141
   54   2HZ   LYS   5          2HZ       LYS   5  13.420  -0.234  -3.273
   55   3HZ   LYS   5          3HZ       LYS   5  13.027  -1.795  -3.811
   56    H    TYR   6           H        TYR   6   9.095  -3.584  -2.402
   57    HA   TYR   6           HA       TYR   6   9.649  -2.734  -4.996
   58   1HB   TYR   6          1HB       TYR   6   7.507  -4.719  -4.212
   59   2HB   TYR   6          2HB       TYR   6   8.420  -4.653  -5.720
   60    HD1  TYR   6           HD1      TYR   6  11.064  -4.828  -5.428
   61    HD2  TYR   6           HD2      TYR   6   8.221  -6.219  -2.579
   62    HE1  TYR   6           HE1      TYR   6  12.756  -6.307  -4.465
   63    HE2  TYR   6           HE2      TYR   6   9.906  -7.704  -1.613
   64    HH   TYR   6           HH       TYR   6  12.351  -7.864  -1.474
   65    H    GLY   7           H        GLY   7   8.247  -2.164  -6.723
   66   1HA   GLY   7          1HA       GLY   7   6.021  -1.458  -7.465
   67   2HA   GLY   7          2HA       GLY   7   5.810  -0.686  -5.897
   68    H    ASN   8           H        ASN   8   5.459   1.359  -6.947
   69    HA   ASN   8           HA       ASN   8   7.897   2.381  -8.208
   70   1HB   ASN   8          1HB       ASN   8   6.533   4.235  -9.134
   71   2HB   ASN   8          2HB       ASN   8   6.038   2.650  -9.697
   72   1HD2  ASN   8          1HD2      ASN   8   4.015   3.235 -10.231
   73   2HD2  ASN   8          2HD2      ASN   8   2.822   3.729  -9.093
   74    H    ALA   9           H        ALA   9   6.293   2.522  -5.322
   75    HA   ALA   9           HA       ALA   9   6.919   5.241  -4.611
   76   1HB   ALA   9          1HB       ALA   9   6.316   3.198  -2.542
   77   2HB   ALA   9          2HB       ALA   9   5.038   3.622  -3.693
   78   3HB   ALA   9          3HB       ALA   9   5.757   4.873  -2.674
   79    H    ASP  10           H        ASP  10   9.254   4.864  -5.276
   80    HA   ASP  10           HA       ASP  10  10.871   3.236  -3.548
   81   1HB   ASP  10          1HB       ASP  10  11.582   5.251  -5.688
   82   2HB   ASP  10          2HB       ASP  10  12.784   4.345  -4.773
   83    H    GLY  11           H        GLY  11  11.075   3.830  -1.490
   84   1HA   GLY  11          1HA       GLY  11  12.111   5.075   0.202
   85   2HA   GLY  11          2HA       GLY  11  12.288   6.414  -0.922
   86    H    GLU  12           H        GLU  12   9.146   5.213  -1.005
   87    HA   GLU  12           HA       GLU  12   8.227   7.534   0.470
   88   1HB   GLU  12          1HB       GLU  12   6.985   5.642  -1.479
   89   2HB   GLU  12          2HB       GLU  12   5.941   6.584  -0.418
   90   1HG   GLU  12          1HG       GLU  12   6.529   8.584  -1.380
   91   2HG   GLU  12          2HG       GLU  12   8.087   7.986  -1.928
   92    H    TYR  13           H        TYR  13   6.162   7.192   1.796
   93    HA   TYR  13           HA       TYR  13   6.594   4.973   3.637
   94   1HB   TYR  13          1HB       TYR  13   5.952   6.432   5.361
   95   2HB   TYR  13          2HB       TYR  13   7.133   7.266   4.360
   96    HD1  TYR  13           HD1      TYR  13   3.498   6.961   5.041
   97    HD2  TYR  13           HD2      TYR  13   6.641   9.292   3.390
   98    HE1  TYR  13           HE1      TYR  13   1.941   8.848   4.784
   99    HE2  TYR  13           HE2      TYR  13   5.097  11.196   3.116
  100    HH   TYR  13           HH       TYR  13   2.159  11.178   2.905
  101    H    CYS  14           H        CYS  14   4.744   3.960   4.620
  102    HA   CYS  14           HA       CYS  14   2.502   3.755   2.850
  103   1HB   CYS  14          1HB       CYS  14   3.004   2.588   5.592
  104   2HB   CYS  14          2HB       CYS  14   1.574   2.245   4.634
  105    H    LYS  15           H        LYS  15   0.729   4.982   2.884
  106    HA   LYS  15           HA       LYS  15   0.381   6.871   5.080
  107   1HB   LYS  15          1HB       LYS  15   0.173   7.205   2.408
  108   2HB   LYS  15          2HB       LYS  15  -1.503   6.832   2.786
  109   1HG   LYS  15          1HG       LYS  15   0.076   9.014   4.128
  110   2HG   LYS  15          2HG       LYS  15  -0.955   9.258   2.720
  111   1HD   LYS  15          1HD       LYS  15  -2.881   8.441   4.002
  112   2HD   LYS  15          2HD       LYS  15  -1.840   8.240   5.416
  113   1HE   LYS  15          1HE       LYS  15  -1.401  10.614   5.486
  114   2HE   LYS  15          2HE       LYS  15  -2.294  10.858   3.983
  115   1HZ   LYS  15          1HZ       LYS  15  -3.784  11.453   5.643
  116   2HZ   LYS  15          2HZ       LYS  15  -3.350  10.171   6.660
  117   3HZ   LYS  15          3HZ       LYS  15  -4.256   9.872   5.249
  118    H    PHE  16           H        PHE  16  -0.689   6.063   6.777
  119    HA   PHE  16           HA       PHE  16  -3.075   4.418   6.243
  120   1HB   PHE  16          1HB       PHE  16  -1.421   4.564   8.772
  121   2HB   PHE  16          2HB       PHE  16  -2.818   3.530   8.510
  122    HD1  PHE  16           HD1      PHE  16  -2.415   2.279   5.986
  123    HD2  PHE  16           HD2      PHE  16   0.469   3.315   8.933
  124    HE1  PHE  16           HE1      PHE  16  -0.958   0.473   5.191
  125    HE2  PHE  16           HE2      PHE  16   1.940   1.522   8.142
  126    HZ   PHE  16           HZ       PHE  16   1.237   0.066   6.267
  127    HA   PRO  17           HA       PRO  17  -4.775   3.972   6.649
  128   1HB   PRO  17          1HB       PRO  17  -7.452   4.572   6.599
  129   2HB   PRO  17          2HB       PRO  17  -6.624   3.832   7.971
  130   1HG   PRO  17          1HG       PRO  17  -7.785   6.468   7.802
  131   2HG   PRO  17          2HG       PRO  17  -7.030   5.690   9.201
  132   1HD   PRO  17          1HD       PRO  17  -5.903   7.649   7.311
  133   2HD   PRO  17          2HD       PRO  17  -5.370   7.227   8.953
  134    H    PHE  18           H        PHE  18  -4.819   3.625   4.490
  135    HA   PHE  18           HA       PHE  18  -5.394   5.921   2.784
  136   1HB   PHE  18          1HB       PHE  18  -4.357   4.703   0.955
  137   2HB   PHE  18          2HB       PHE  18  -3.292   4.707   2.353
  138    HD1  PHE  18           HD1      PHE  18  -3.209   2.598   3.784
  139    HD2  PHE  18           HD2      PHE  18  -4.968   2.729  -0.087
  140    HE1  PHE  18           HE1      PHE  18  -2.987   0.157   3.605
  141    HE2  PHE  18           HE2      PHE  18  -4.751   0.287  -0.282
  142    HZ   PHE  18           HZ       PHE  18  -3.759  -1.022   1.564
  143    H    LEU  19           H        LEU  19  -7.002   6.034   1.337
  144    HA   LEU  19           HA       LEU  19  -9.266   4.315   1.751
  145   1HB   LEU  19          1HB       LEU  19  -9.416   6.776   1.479
  146   2HB   LEU  19          2HB       LEU  19  -8.905   6.589  -0.188
  147    HG   LEU  19           HG       LEU  19 -10.954   5.116  -0.512
  148   1HD1  LEU  19          1HD1      LEU  19 -12.400   6.419   1.635
  149   2HD1  LEU  19          2HD1      LEU  19 -11.130   5.351   2.238
  150   3HD1  LEU  19          3HD1      LEU  19 -12.374   4.727   1.152
  151   1HD2  LEU  19          1HD2      LEU  19 -11.932   6.910  -1.409
  152   2HD2  LEU  19          2HD2      LEU  19 -10.574   7.833  -0.761
  153   3HD2  LEU  19          3HD2      LEU  19 -12.081   7.720   0.147
  154    H    PHE  20           H        PHE  20  -9.451   2.442   0.774
  155    HA   PHE  20           HA       PHE  20  -8.687   2.198  -2.069
  156   1HB   PHE  20          1HB       PHE  20  -7.323   0.811  -0.301
  157   2HB   PHE  20          2HB       PHE  20  -8.808  -0.116  -0.172
  158    HD1  PHE  20           HD1      PHE  20  -7.428  -2.011  -0.764
  159    HD2  PHE  20           HD2      PHE  20  -8.165   1.170  -3.488
  160    HE1  PHE  20           HE1      PHE  20  -6.809  -3.493  -2.623
  161    HE2  PHE  20           HE2      PHE  20  -7.542  -0.314  -5.361
  162    HZ   PHE  20           HZ       PHE  20  -6.873  -2.636  -4.931
  163    H    ASN  21           H        ASN  21 -10.603   2.267  -3.123
  164    HA   ASN  21           HA       ASN  21 -12.739   1.822  -3.761
  165   1HB   ASN  21          1HB       ASN  21 -12.304  -0.725  -2.195
  166   2HB   ASN  21          2HB       ASN  21 -13.580  -0.452  -3.373
  167   1HD2  ASN  21          1HD2      ASN  21 -10.819  -2.005  -2.965
  168   2HD2  ASN  21          2HD2      ASN  21 -10.173  -1.977  -4.567
  169    H    GLY  22           H        GLY  22 -12.257   3.152  -1.131
  170   1HA   GLY  22          1HA       GLY  22 -13.941   4.220   0.148
  171   2HA   GLY  22          2HA       GLY  22 -14.995   2.846  -0.132
  172    H    LYS  23           H        LYS  23 -12.059   1.590   0.680
  173    HA   LYS  23           HA       LYS  23 -12.791   1.505   3.537
  174   1HB   LYS  23          1HB       LYS  23 -13.022  -0.676   2.339
  175   2HB   LYS  23          2HB       LYS  23 -11.303  -0.617   1.972
  176   1HG   LYS  23          1HG       LYS  23 -10.851  -0.562   4.422
  177   2HG   LYS  23          2HG       LYS  23 -12.570  -0.825   4.695
  178   1HD   LYS  23          1HD       LYS  23 -10.794  -2.675   3.113
  179   2HD   LYS  23          2HD       LYS  23 -11.203  -2.898   4.814
  180   1HE   LYS  23          1HE       LYS  23 -13.574  -3.043   4.227
  181   2HE   LYS  23          2HE       LYS  23 -13.166  -2.811   2.523
  182   1HZ   LYS  23          1HZ       LYS  23 -12.230  -4.897   2.373
  183   2HZ   LYS  23          2HZ       LYS  23 -13.513  -5.191   3.441
  184   3HZ   LYS  23          3HZ       LYS  23 -11.927  -5.013   4.037
  185    H    GLU  24           H        GLU  24 -11.395   2.416   4.874
  186    HA   GLU  24           HA       GLU  24  -8.760   3.158   3.879
  187   1HB   GLU  24          1HB       GLU  24 -10.201   3.893   6.432
  188   2HB   GLU  24          2HB       GLU  24  -8.632   4.519   5.949
  189   1HG   GLU  24          1HG       GLU  24  -9.592   5.628   4.066
  190   2HG   GLU  24          2HG       GLU  24 -11.153   4.864   4.355
  191    H    TYR  25           H        TYR  25  -7.101   1.858   4.175
  192    HA   TYR  25           HA       TYR  25  -7.166  -0.110   6.333
  193   1HB   TYR  25          1HB       TYR  25  -5.256   0.181   4.026
  194   2HB   TYR  25          2HB       TYR  25  -5.202  -1.113   5.204
  195    HD1  TYR  25           HD1      TYR  25  -7.226   0.385   2.508
  196    HD2  TYR  25           HD2      TYR  25  -6.557  -3.029   4.955
  197    HE1  TYR  25           HE1      TYR  25  -8.758  -0.919   1.075
  198    HE2  TYR  25           HE2      TYR  25  -8.091  -4.346   3.530
  199    HH   TYR  25           HH       TYR  25  -9.902  -2.856   0.876
  200    H    ASN  26           H        ASN  26  -5.900  -0.082   8.053
  201    HA   ASN  26           HA       ASN  26  -3.969   2.122   8.305
  202   1HB   ASN  26          1HB       ASN  26  -5.422   0.466  10.368
  203   2HB   ASN  26          2HB       ASN  26  -4.052   1.496  10.776
  204   1HD2  ASN  26          1HD2      ASN  26  -7.375   1.357  10.198
  205   2HD2  ASN  26          2HD2      ASN  26  -7.707   3.052  10.257
  206    H    SER  27           H        SER  27  -4.002  -0.858   7.258
  207    HA   SER  27           HA       SER  27  -1.233  -1.345   7.979
  208   1HB   SER  27          1HB       SER  27  -1.755  -3.789   8.387
  209   2HB   SER  27          2HB       SER  27  -2.326  -2.691   9.644
  210    HG   SER  27           HG       SER  27  -4.213  -3.537   9.292
  211    H    CYS  28           H        CYS  28  -0.298  -3.067   6.558
  212    HA   CYS  28           HA       CYS  28  -0.944  -2.557   3.850
  213   1HB   CYS  28          1HB       CYS  28   0.676  -4.898   4.868
  214   2HB   CYS  28          2HB       CYS  28   0.814  -4.079   3.317
  215    H    THR  29           H        THR  29  -2.265  -3.625   2.443
  216    HA   THR  29           HA       THR  29  -3.579  -6.052   3.432
  217    HB   THR  29           HB       THR  29  -5.110  -4.140   3.309
  218    HG1  THR  29           HG1      THR  29  -5.913  -6.244   2.793
  219   1HG2  THR  29          1HG2      THR  29  -3.790  -3.458   0.951
  220   2HG2  THR  29          2HG2      THR  29  -5.211  -2.683   1.651
  221   3HG2  THR  29          3HG2      THR  29  -5.406  -3.965   0.458
  222    H    ASP  30           H        ASP  30  -4.471  -7.449   1.637
  223    HA   ASP  30           HA       ASP  30  -2.484  -7.629  -0.505
  224   1HB   ASP  30          1HB       ASP  30  -4.171  -9.936  -0.205
  225   2HB   ASP  30          2HB       ASP  30  -2.435  -9.858  -0.286
  226    H    THR  31           H        THR  31  -5.425  -6.504   0.062
  227    HA   THR  31           HA       THR  31  -7.126  -7.525  -1.905
  228    HB   THR  31           HB       THR  31  -6.979  -4.703  -0.843
  229    HG1  THR  31           HG1      THR  31  -7.274  -5.786   0.964
  230   1HG2  THR  31          1HG2      THR  31  -9.438  -6.189  -1.707
  231   2HG2  THR  31          2HG2      THR  31  -8.555  -5.080  -2.761
  232   3HG2  THR  31          3HG2      THR  31  -9.285  -4.488  -1.269
  233    H    GLY  32           H        GLY  32  -7.349  -7.131  -4.068
  234   1HA   GLY  32          1HA       GLY  32  -7.068  -5.910  -6.063
  235   2HA   GLY  32          2HA       GLY  32  -5.821  -4.956  -5.266
  236    H    ARG  33           H        ARG  33  -4.679  -7.510  -4.174
  237    HA   ARG  33           HA       ARG  33  -3.059  -8.191  -6.519
  238   1HB   ARG  33          1HB       ARG  33  -2.620  -8.853  -3.589
  239   2HB   ARG  33          2HB       ARG  33  -1.480  -9.140  -4.899
  240   1HG   ARG  33          1HG       ARG  33  -2.466  -6.418  -4.078
  241   2HG   ARG  33          2HG       ARG  33  -0.967  -7.148  -3.507
  242   1HD   ARG  33          1HD       ARG  33  -1.667  -6.538  -6.382
  243   2HD   ARG  33          2HD       ARG  33  -0.572  -5.599  -5.368
  244    HE   ARG  33           HE       ARG  33   0.332  -8.258  -5.419
  245   1HH1  ARG  33          1HH1      ARG  33  -0.090  -5.582  -7.615
  246   2HH1  ARG  33          2HH1      ARG  33   1.297  -5.978  -8.584
  247   1HH2  ARG  33          1HH2      ARG  33   2.109  -8.850  -6.733
  248   2HH2  ARG  33          2HH2      ARG  33   2.530  -7.866  -8.102
  249    H    SER  34           H        SER  34  -2.293 -10.633  -6.389
  250    HA   SER  34           HA       SER  34  -4.684 -12.268  -5.839
  251   1HB   SER  34          1HB       SER  34  -2.843 -12.684  -8.197
  252   2HB   SER  34          2HB       SER  34  -4.386 -13.474  -7.878
  253    HG   SER  34           HG       SER  34  -4.055 -11.364  -9.319
  254    H    ASP  35           H        ASP  35  -1.345 -11.887  -5.330
  255    HA   ASP  35           HA       ASP  35  -1.090 -14.706  -4.616
  256   1HB   ASP  35          1HB       ASP  35   0.753 -12.778  -5.753
  257   2HB   ASP  35          2HB       ASP  35   1.447 -13.814  -4.522
  258    H    GLY  36           H        GLY  36  -2.222 -12.427  -3.018
  259   1HA   GLY  36          1HA       GLY  36  -2.335 -11.906  -0.790
  260   2HA   GLY  36          2HA       GLY  36  -1.312 -13.302  -0.510
  261    H    PHE  37           H        PHE  37  -0.235 -10.608  -2.484
  262    HA   PHE  37           HA       PHE  37   1.925 -10.180  -0.598
  263   1HB   PHE  37          1HB       PHE  37   1.389  -9.344  -3.400
  264   2HB   PHE  37          2HB       PHE  37   2.418  -8.290  -2.431
  265    HD1  PHE  37           HD1      PHE  37   4.077  -8.890  -4.280
  266    HD2  PHE  37           HD2      PHE  37   2.640 -11.706  -1.429
  267    HE1  PHE  37           HE1      PHE  37   6.002 -10.348  -4.762
  268    HE2  PHE  37           HE2      PHE  37   4.564 -13.168  -1.902
  269    HZ   PHE  37           HZ       PHE  37   6.247 -12.495  -3.568
  270    H    LEU  38           H        LEU  38   1.962  -8.677   0.913
  271    HA   LEU  38           HA       LEU  38  -0.274  -6.901   1.219
  272   1HB   LEU  38          1HB       LEU  38   2.210  -7.302   2.836
  273   2HB   LEU  38          2HB       LEU  38   0.974  -6.144   3.266
  274    HG   LEU  38           HG       LEU  38  -0.630  -8.164   3.274
  275   1HD1  LEU  38          1HD1      LEU  38   0.327 -10.010   2.441
  276   2HD1  LEU  38          2HD1      LEU  38   0.951 -10.189   4.081
  277   3HD1  LEU  38          3HD1      LEU  38   1.962  -9.472   2.824
  278   1HD2  LEU  38          1HD2      LEU  38   0.929  -8.820   5.527
  279   2HD2  LEU  38          2HD2      LEU  38  -0.471  -7.749   5.444
  280   3HD2  LEU  38          3HD2      LEU  38   1.152  -7.095   5.235
  281    H    TRP  39           H        TRP  39  -0.421  -4.848   0.616
  282    HA   TRP  39           HA       TRP  39   2.043  -3.355   0.082
  283   1HB   TRP  39          1HB       TRP  39   1.099  -2.407  -1.968
  284   2HB   TRP  39          2HB       TRP  39   1.188  -4.154  -2.081
  285    HD1  TRP  39           HD1      TRP  39  -1.179  -5.513  -1.913
  286    HE1  TRP  39           HE1      TRP  39  -3.549  -4.777  -2.544
  287    HE3  TRP  39           HE3      TRP  39  -0.487  -0.435  -2.021
  288    HZ2  TRP  39           HZ2      TRP  39  -4.941  -2.378  -3.033
  289    HZ3  TRP  39           HZ3      TRP  39  -2.406   1.001  -2.586
  290    HH2  TRP  39           HH2      TRP  39  -4.586   0.037  -3.077
  291    H    CYS  40           H        CYS  40   1.453  -0.966  -0.330
  292    HA   CYS  40           HA       CYS  40  -0.857  -0.039   1.177
  293   1HB   CYS  40          1HB       CYS  40   0.439   1.240   2.756
  294   2HB   CYS  40          2HB       CYS  40   1.005  -0.423   2.826
  295    H    SER  41           H        SER  41  -1.072   2.356   0.942
  296    HA   SER  41           HA       SER  41   0.162   3.213  -1.584
  297   1HB   SER  41          1HB       SER  41  -2.353   3.150  -1.470
  298   2HB   SER  41          2HB       SER  41  -2.275   4.400  -0.231
  299    HG   SER  41           HG       SER  41  -1.041   4.755  -2.753
  300    H    THR  42           H        THR  42   0.722   5.520  -1.723
  301    HA   THR  42           HA       THR  42   1.945   6.419   0.791
  302    HB   THR  42           HB       THR  42   2.439   7.598  -1.946
  303    HG1  THR  42           HG1      THR  42   4.103   6.108  -2.205
  304   1HG2  THR  42          1HG2      THR  42   3.502   8.905  -0.315
  305   2HG2  THR  42          2HG2      THR  42   4.758   7.860  -0.980
  306   3HG2  THR  42          3HG2      THR  42   4.038   7.485   0.584
  307    H    THR  43           H        THR  43  -0.704   6.955  -1.184
  308    HA   THR  43           HA       THR  43  -1.061   9.702  -0.201
  309    HB   THR  43           HB       THR  43  -2.651   9.923  -2.141
  310    HG1  THR  43           HG1      THR  43  -2.333   7.324  -2.280
  311   1HG2  THR  43          1HG2      THR  43   0.103  10.125  -2.162
  312   2HG2  THR  43          2HG2      THR  43  -1.014  10.742  -3.381
  313   3HG2  THR  43          3HG2      THR  43  -0.272   9.156  -3.590
  314    H    TYR  44           H        TYR  44  -3.386  10.331   0.099
  315    HA   TYR  44           HA       TYR  44  -4.607   8.565   1.925
  316   1HB   TYR  44          1HB       TYR  44  -6.380  10.345   1.927
  317   2HB   TYR  44          2HB       TYR  44  -4.771  10.900   2.342
  318    HD1  TYR  44           HD1      TYR  44  -7.412  10.939  -0.264
  319    HD2  TYR  44           HD2      TYR  44  -3.634  12.500   0.947
  320    HE1  TYR  44           HE1      TYR  44  -7.573  12.671  -1.993
  321    HE2  TYR  44           HE2      TYR  44  -3.802  14.239  -0.783
  322    HH   TYR  44           HH       TYR  44  -6.456  15.179  -2.179
  323    H    ASN  45           H        ASN  45  -5.103   9.294  -1.462
  324    HA   ASN  45           HA       ASN  45  -7.202   7.238  -1.506
  325   1HB   ASN  45          1HB       ASN  45  -8.102   9.584  -1.859
  326   2HB   ASN  45          2HB       ASN  45  -7.151   9.657  -3.324
  327   1HD2  ASN  45          1HD2      ASN  45  -7.894   6.643  -3.618
  328   2HD2  ASN  45          2HD2      ASN  45  -9.442   6.806  -4.296
  329    H    PHE  46           H        PHE  46  -6.142   5.546  -2.360
  330    HA   PHE  46           HA       PHE  46  -3.924   5.656  -4.075
  331   1HB   PHE  46          1HB       PHE  46  -4.399   3.718  -2.686
  332   2HB   PHE  46          2HB       PHE  46  -5.904   3.411  -3.574
  333    HD1  PHE  46           HD1      PHE  46  -2.229   3.881  -4.308
  334    HD2  PHE  46           HD2      PHE  46  -5.807   1.716  -5.127
  335    HE1  PHE  46           HE1      PHE  46  -1.003   2.442  -5.872
  336    HE2  PHE  46           HE2      PHE  46  -4.580   0.275  -6.686
  337    HZ   PHE  46           HZ       PHE  46  -2.174   0.636  -7.065
  338    H    GLU  47           H        GLU  47  -7.340   5.609  -4.764
  339    HA   GLU  47           HA       GLU  47  -7.267   4.770  -7.432
  340   1HB   GLU  47          1HB       GLU  47  -9.241   5.169  -5.768
  341   2HB   GLU  47          2HB       GLU  47  -9.261   6.780  -6.463
  342   1HG   GLU  47          1HG       GLU  47  -9.513   5.737  -8.707
  343   2HG   GLU  47          2HG       GLU  47  -9.681   4.176  -7.900
  344    H    LYS  48           H        LYS  48  -6.957   8.032  -6.057
  345    HA   LYS  48           HA       LYS  48  -7.000   9.266  -8.646
  346   1HB   LYS  48          1HB       LYS  48  -6.586  11.369  -7.469
  347   2HB   LYS  48          2HB       LYS  48  -7.909  10.468  -6.747
  348   1HG   LYS  48          1HG       LYS  48  -6.423   9.734  -4.943
  349   2HG   LYS  48          2HG       LYS  48  -5.088  10.622  -5.677
  350   1HD   LYS  48          1HD       LYS  48  -7.663  11.898  -4.767
  351   2HD   LYS  48          2HD       LYS  48  -6.200  11.816  -3.784
  352   1HE   LYS  48          1HE       LYS  48  -6.409  13.127  -6.494
  353   2HE   LYS  48          2HE       LYS  48  -6.467  13.975  -4.949
  354   1HZ   LYS  48          1HZ       LYS  48  -4.258  13.726  -4.620
  355   2HZ   LYS  48          2HZ       LYS  48  -4.232  13.655  -6.312
  356   3HZ   LYS  48          3HZ       LYS  48  -4.168  12.224  -5.401
  357    H    ASP  49           H        ASP  49  -4.408   8.640  -6.273
  358    HA   ASP  49           HA       ASP  49  -2.483   9.767  -8.151
  359   1HB   ASP  49          1HB       ASP  49  -2.236   8.848  -5.294
  360   2HB   ASP  49          2HB       ASP  49  -0.853   9.357  -6.260
  361    H    GLY  50           H        GLY  50  -2.767   6.712  -6.318
  362   1HA   GLY  50          1HA       GLY  50  -2.464   4.582  -7.245
  363   2HA   GLY  50          2HA       GLY  50  -1.730   5.325  -8.652
  364    H    LYS  51           H        LYS  51  -0.489   6.491  -5.690
  365    HA   LYS  51           HA       LYS  51   2.056   5.268  -6.221
  366   1HB   LYS  51          1HB       LYS  51   1.061   7.009  -3.992
  367   2HB   LYS  51          2HB       LYS  51   2.721   6.442  -4.121
  368   1HG   LYS  51          1HG       LYS  51   3.011   7.618  -6.183
  369   2HG   LYS  51          2HG       LYS  51   1.304   8.088  -6.195
  370   1HD   LYS  51          1HD       LYS  51   1.568   9.426  -4.287
  371   2HD   LYS  51          2HD       LYS  51   3.169   8.760  -3.962
  372   1HE   LYS  51          1HE       LYS  51   3.387  10.995  -4.879
  373   2HE   LYS  51          2HE       LYS  51   4.001   9.810  -6.034
  374   1HZ   LYS  51          1HZ       LYS  51   2.708  11.308  -7.269
  375   2HZ   LYS  51          2HZ       LYS  51   1.445  11.313  -6.135
  376   3HZ   LYS  51          3HZ       LYS  51   1.723   9.933  -7.094
  377    H    TYR  52           H        TYR  52   2.559   3.235  -5.556
  378    HA   TYR  52           HA       TYR  52   1.596   2.344  -2.948
  379   1HB   TYR  52          1HB       TYR  52   0.669   0.320  -3.772
  380   2HB   TYR  52          2HB       TYR  52   0.020   1.592  -4.800
  381    HD1  TYR  52           HD1      TYR  52   2.150  -1.345  -4.634
  382    HD2  TYR  52           HD2      TYR  52   0.811   1.830  -7.126
  383    HE1  TYR  52           HE1      TYR  52   3.002  -2.548  -6.597
  384    HE2  TYR  52           HE2      TYR  52   1.657   0.637  -9.101
  385    HH   TYR  52           HH       TYR  52   3.800  -1.544  -9.178
  386    H    GLY  53           H        GLY  53   2.669   0.432  -2.180
  387   1HA   GLY  53          1HA       GLY  53   5.003  -0.555  -3.514
  388   2HA   GLY  53          2HA       GLY  53   5.368   0.470  -2.128
  389    H    PHE  54           H        PHE  54   5.988  -2.317  -2.340
  390    HA   PHE  54           HA       PHE  54   4.012  -3.602  -0.644
  391   1HB   PHE  54          1HB       PHE  54   6.515  -4.676  -1.920
  392   2HB   PHE  54          2HB       PHE  54   5.410  -5.634  -0.944
  393    HD1  PHE  54           HD1      PHE  54   2.893  -5.570  -1.725
  394    HD2  PHE  54           HD2      PHE  54   6.222  -4.617  -4.198
  395    HE1  PHE  54           HE1      PHE  54   1.535  -6.003  -3.726
  396    HE2  PHE  54           HE2      PHE  54   4.871  -5.049  -6.202
  397    HZ   PHE  54           HZ       PHE  54   2.520  -5.748  -5.969
  398    H    CYS  55           H        CYS  55   4.185  -3.828   1.443
  399    HA   CYS  55           HA       CYS  55   6.162  -2.484   2.917
  400   1HB   CYS  55          1HB       CYS  55   4.286  -4.589   3.981
  401   2HB   CYS  55          2HB       CYS  55   4.997  -3.232   4.858
  402    HA   PRO  56           HA       PRO  56   7.915  -6.901   4.012
  403   1HB   PRO  56          1HB       PRO  56   7.561  -8.787   2.085
  404   2HB   PRO  56          2HB       PRO  56   6.525  -8.640   3.509
  405   1HG   PRO  56          1HG       PRO  56   6.063  -7.648   0.720
  406   2HG   PRO  56          2HG       PRO  56   4.924  -8.435   1.831
  407   1HD   PRO  56          1HD       PRO  56   4.917  -5.774   1.464
  408   2HD   PRO  56          2HD       PRO  56   4.572  -6.496   3.049
  409    H    HIS  57           H        HIS  57  10.030  -6.857   3.637
  410    HA   HIS  57           HA       HIS  57  11.020  -5.724   1.176
  411   1HB   HIS  57          1HB       HIS  57  13.238  -5.833   2.245
  412   2HB   HIS  57          2HB       HIS  57  12.066  -5.032   3.276
  413    HD1  HIS  57           HD1      HIS  57  10.971  -6.790   5.168
  414    HD2  HIS  57           HD2      HIS  57  14.682  -7.706   3.518
  415    HE1  HIS  57           HE1      HIS  57  12.017  -8.464   6.733
  416    H    GLU  58           H        GLU  58  10.442  -8.821   2.441
  417    HA   GLU  58           HA       GLU  58  12.356 -10.098   0.669
  418   1HB   GLU  58          1HB       GLU  58  11.683 -12.192   1.719
  419   2HB   GLU  58          2HB       GLU  58  12.143 -11.005   2.926
  420   1HG   GLU  58          1HG       GLU  58   9.799 -10.578   3.421
  421   2HG   GLU  58          2HG       GLU  58   9.314 -11.718   2.168
  422    H    ALA  59           H        ALA  59  11.824 -11.476  -0.977
  423    HA   ALA  59           HA       ALA  59   9.074 -11.928  -1.742
  424   1HB   ALA  59          1HB       ALA  59   8.913 -10.146  -3.076
  425   2HB   ALA  59          2HB       ALA  59  10.093 -10.944  -4.121
  426   3HB   ALA  59          3HB       ALA  59  10.632  -9.775  -2.913
  Start of MODEL   14
    1   1H    ARG   1          1H        ARG   1  12.133   4.260   2.439
    2   2H    ARG   1          2H        ARG   1  11.724   5.823   3.040
    3   3H    ARG   1          3H        ARG   1  10.481   4.712   2.606
    4    HA   ARG   1           HA       ARG   1  12.214   4.765   4.922
    5   1HB   ARG   1          1HB       ARG   1   9.339   4.138   4.441
    6   2HB   ARG   1          2HB       ARG   1  10.091   4.181   6.018
    7   1HG   ARG   1          1HG       ARG   1  10.059   6.574   4.198
    8   2HG   ARG   1          2HG       ARG   1   8.733   6.214   5.300
    9   1HD   ARG   1          1HD       ARG   1  11.551   6.345   6.297
   10   2HD   ARG   1          2HD       ARG   1  10.609   7.816   6.065
   11    HE   ARG   1           HE       ARG   1   9.144   5.915   7.606
   12   1HH1  ARG   1          1HH1      ARG   1  11.783   8.223   7.792
   13   2HH1  ARG   1          2HH1      ARG   1  11.611   8.480   9.502
   14   1HH2  ARG   1          1HH2      ARG   1   8.896   6.297   9.855
   15   2HH2  ARG   1          2HH2      ARG   1   9.965   7.399  10.668
   16    H    ILE   2           H        ILE   2  10.380   2.479   5.829
   17    HA   ILE   2           HA       ILE   2  11.872   0.355   4.481
   18    HB   ILE   2           HB       ILE   2  12.734   0.754   6.814
   19   1HG1  ILE   2          1HG1      ILE   2  12.854  -1.667   7.354
   20   2HG1  ILE   2          2HG1      ILE   2  11.626  -1.973   6.130
   21   1HG2  ILE   2          1HG2      ILE   2  10.571   1.115   7.976
   22   2HG2  ILE   2          2HG2      ILE   2  11.492  -0.207   8.694
   23   3HG2  ILE   2          3HG2      ILE   2  10.128  -0.557   7.635
   24   1HD1  ILE   2          1HD1      ILE   2  13.998  -0.468   5.238
   25   2HD1  ILE   2          2HD1      ILE   2  13.076  -1.733   4.427
   26   3HD1  ILE   2          3HD1      ILE   2  14.244  -2.164   5.671
   27    HA   PRO   3           HA       PRO   3   7.494  -1.456   5.580
   28   1HB   PRO   3          1HB       PRO   3   5.748   0.882   5.331
   29   2HB   PRO   3          2HB       PRO   3   5.776  -0.366   6.581
   30   1HG   PRO   3          1HG       PRO   3   6.575   2.156   7.069
   31   2HG   PRO   3          2HG       PRO   3   7.342   0.758   7.851
   32   1HD   PRO   3          1HD       PRO   3   8.295   2.374   5.496
   33   2HD   PRO   3          2HD       PRO   3   9.222   1.761   6.882
   34    H    VAL   4           H        VAL   4   8.539   0.783   3.285
   35    HA   VAL   4           HA       VAL   4   6.913  -0.533   1.224
   36    HB   VAL   4           HB       VAL   4   7.522   2.456   1.160
   37   1HG1  VAL   4          1HG1      VAL   4   5.500   0.987  -0.497
   38   2HG1  VAL   4          2HG1      VAL   4   7.198   1.041  -0.975
   39   3HG1  VAL   4          3HG1      VAL   4   6.281   2.539  -0.808
   40   1HG2  VAL   4          1HG2      VAL   4   5.878   2.554   2.717
   41   2HG2  VAL   4          2HG2      VAL   4   5.218   0.975   2.288
   42   3HG2  VAL   4          3HG2      VAL   4   4.852   2.387   1.296
   43    H    LYS   5           H        LYS   5   8.070  -1.077  -0.585
   44    HA   LYS   5           HA       LYS   5  10.694   0.150  -0.970
   45   1HB   LYS   5          1HB       LYS   5  10.680  -2.119   0.447
   46   2HB   LYS   5          2HB       LYS   5  10.625  -2.829  -1.161
   47   1HG   LYS   5          1HG       LYS   5  12.722  -0.961  -0.079
   48   2HG   LYS   5          2HG       LYS   5  12.919  -2.685  -0.418
   49   1HD   LYS   5          1HD       LYS   5  12.750  -2.356  -2.753
   50   2HD   LYS   5          2HD       LYS   5  12.144  -0.711  -2.557
   51   1HE   LYS   5          1HE       LYS   5  14.451  -0.242  -1.461
   52   2HE   LYS   5          2HE       LYS   5  14.939  -1.760  -2.208
   53   1HZ   LYS   5          1HZ       LYS   5  14.265  -0.835  -4.372
   54   2HZ   LYS   5          2HZ       LYS   5  15.489   0.086  -3.630
   55   3HZ   LYS   5          3HZ       LYS   5  13.889   0.639  -3.615
   56    H    TYR   6           H        TYR   6   8.948  -2.688  -2.227
   57    HA   TYR   6           HA       TYR   6   9.688  -2.031  -4.907
   58   1HB   TYR   6          1HB       TYR   6   7.722  -4.128  -3.944
   59   2HB   TYR   6          2HB       TYR   6   8.469  -4.042  -5.541
   60    HD1  TYR   6           HD1      TYR   6   9.176  -4.628  -1.946
   61    HD2  TYR   6           HD2      TYR   6  10.695  -4.853  -5.919
   62    HE1  TYR   6           HE1      TYR   6  11.127  -5.852  -1.125
   63    HE2  TYR   6           HE2      TYR   6  12.643  -6.096  -5.102
   64    HH   TYR   6           HH       TYR   6  12.802  -7.549  -2.151
   65    H    GLY   7           H        GLY   7   8.174  -1.773  -6.669
   66   1HA   GLY   7          1HA       GLY   7   6.020  -1.082  -7.502
   67   2HA   GLY   7          2HA       GLY   7   5.666  -0.394  -5.923
   68    H    ASN   8           H        ASN   8   5.267   1.692  -6.788
   69    HA   ASN   8           HA       ASN   8   7.679   2.920  -7.915
   70   1HB   ASN   8          1HB       ASN   8   6.308   4.631  -8.970
   71   2HB   ASN   8          2HB       ASN   8   5.786   3.025  -9.458
   72   1HD2  ASN   8          1HD2      ASN   8   4.357   5.551  -9.528
   73   2HD2  ASN   8          2HD2      ASN   8   2.920   5.310  -8.604
   74    H    ALA   9           H        ALA   9   6.428   2.628  -5.037
   75    HA   ALA   9           HA       ALA   9   6.684   5.405  -4.165
   76   1HB   ALA   9          1HB       ALA   9   6.110   3.134  -2.329
   77   2HB   ALA   9          2HB       ALA   9   4.827   3.740  -3.394
   78   3HB   ALA   9          3HB       ALA   9   5.591   4.824  -2.222
   79    H    ASP  10           H        ASP  10   9.018   4.058  -5.123
   80    HA   ASP  10           HA       ASP  10  10.531   2.881  -3.070
   81   1HB   ASP  10          1HB       ASP  10  11.179   2.599  -5.385
   82   2HB   ASP  10          2HB       ASP  10  11.432   4.332  -5.564
   83    H    GLY  11           H        GLY  11  11.162   3.773  -1.237
   84   1HA   GLY  11          1HA       GLY  11  12.503   5.313  -0.017
   85   2HA   GLY  11          2HA       GLY  11  12.255   6.493  -1.300
   86    H    GLU  12           H        GLU  12   9.307   5.283  -0.930
   87    HA   GLU  12           HA       GLU  12   8.490   7.497   0.751
   88   1HB   GLU  12          1HB       GLU  12   6.935   5.527  -0.925
   89   2HB   GLU  12          2HB       GLU  12   6.175   6.757   0.076
   90   1HG   GLU  12          1HG       GLU  12   8.153   7.387  -2.094
   91   2HG   GLU  12          2HG       GLU  12   6.414   7.322  -2.353
   92    H    TYR  13           H        TYR  13   6.319   6.819   1.999
   93    HA   TYR  13           HA       TYR  13   6.927   4.553   3.725
   94   1HB   TYR  13          1HB       TYR  13   7.133   5.905   5.501
   95   2HB   TYR  13          2HB       TYR  13   7.327   7.173   4.312
   96    HD1  TYR  13           HD1      TYR  13   4.987   8.153   3.444
   97    HD2  TYR  13           HD2      TYR  13   5.713   6.284   7.186
   98    HE1  TYR  13           HE1      TYR  13   3.106   9.397   4.415
   99    HE2  TYR  13           HE2      TYR  13   3.830   7.509   8.179
  100    HH   TYR  13           HH       TYR  13   1.665   8.605   7.300
  101    H    CYS  14           H        CYS  14   4.961   3.768   4.954
  102    HA   CYS  14           HA       CYS  14   2.721   3.648   3.185
  103   1HB   CYS  14          1HB       CYS  14   3.416   2.416   5.812
  104   2HB   CYS  14          2HB       CYS  14   1.738   2.402   5.290
  105    H    LYS  15           H        LYS  15   0.959   4.880   3.174
  106    HA   LYS  15           HA       LYS  15   0.672   6.876   5.287
  107   1HB   LYS  15          1HB       LYS  15   0.458   7.180   2.630
  108   2HB   LYS  15          2HB       LYS  15  -1.214   6.763   2.976
  109   1HG   LYS  15          1HG       LYS  15   0.342   9.076   4.132
  110   2HG   LYS  15          2HG       LYS  15  -0.949   9.169   2.935
  111   1HD   LYS  15          1HD       LYS  15  -2.545   8.320   4.578
  112   2HD   LYS  15          2HD       LYS  15  -1.250   8.181   5.775
  113   1HE   LYS  15          1HE       LYS  15  -0.880  10.651   5.547
  114   2HE   LYS  15          2HE       LYS  15  -2.306  10.710   4.513
  115   1HZ   LYS  15          1HZ       LYS  15  -3.522   9.652   6.457
  116   2HZ   LYS  15          2HZ       LYS  15  -3.071  11.277   6.636
  117   3HZ   LYS  15          3HZ       LYS  15  -2.170  10.064   7.404
  118    H    PHE  16           H        PHE  16  -0.280   5.982   7.024
  119    HA   PHE  16           HA       PHE  16  -2.687   4.337   6.611
  120   1HB   PHE  16          1HB       PHE  16  -0.832   4.542   8.994
  121   2HB   PHE  16          2HB       PHE  16  -2.308   3.593   8.971
  122    HD1  PHE  16           HD1      PHE  16   0.275   2.407   9.625
  123    HD2  PHE  16           HD2      PHE  16  -1.596   2.963   5.845
  124    HE1  PHE  16           HE1      PHE  16   1.542   0.509   8.731
  125    HE2  PHE  16           HE2      PHE  16  -0.341   1.063   4.937
  126    HZ   PHE  16           HZ       PHE  16   1.245  -0.197   6.373
  127    HA   PRO  17           HA       PRO  17  -4.368   3.907   6.938
  128   1HB   PRO  17          1HB       PRO  17  -7.044   4.524   6.780
  129   2HB   PRO  17          2HB       PRO  17  -6.286   3.730   8.163
  130   1HG   PRO  17          1HG       PRO  17  -7.426   6.375   8.027
  131   2HG   PRO  17          2HG       PRO  17  -6.729   5.554   9.431
  132   1HD   PRO  17          1HD       PRO  17  -5.525   7.572   7.654
  133   2HD   PRO  17          2HD       PRO  17  -5.054   7.092   9.295
  134    H    PHE  18           H        PHE  18  -4.771   3.462   4.771
  135    HA   PHE  18           HA       PHE  18  -5.073   5.833   3.077
  136   1HB   PHE  18          1HB       PHE  18  -4.193   4.538   1.224
  137   2HB   PHE  18          2HB       PHE  18  -3.092   4.465   2.586
  138    HD1  PHE  18           HD1      PHE  18  -2.950   2.367   3.929
  139    HD2  PHE  18           HD2      PHE  18  -5.138   2.600   0.288
  140    HE1  PHE  18           HE1      PHE  18  -2.904  -0.084   3.743
  141    HE2  PHE  18           HE2      PHE  18  -5.101   0.155   0.093
  142    HZ   PHE  18           HZ       PHE  18  -3.972  -1.214   1.828
  143    H    LEU  19           H        LEU  19  -6.474   5.687   1.181
  144    HA   LEU  19           HA       LEU  19  -8.889   4.183   1.873
  145   1HB   LEU  19          1HB       LEU  19  -8.957   6.665   1.604
  146   2HB   LEU  19          2HB       LEU  19  -8.575   6.443  -0.091
  147    HG   LEU  19           HG       LEU  19 -10.683   5.025  -0.249
  148   1HD1  LEU  19          1HD1      LEU  19 -10.887   4.696   2.208
  149   2HD1  LEU  19          2HD1      LEU  19 -12.359   5.283   1.431
  150   3HD1  LEU  19          3HD1      LEU  19 -11.342   6.394   2.350
  151   1HD2  LEU  19          1HD2      LEU  19 -10.574   7.971   0.182
  152   2HD2  LEU  19          2HD2      LEU  19 -12.141   7.192  -0.034
  153   3HD2  LEU  19          3HD2      LEU  19 -10.912   7.051  -1.288
  154    H    PHE  20           H        PHE  20  -9.364   2.407   0.796
  155    HA   PHE  20           HA       PHE  20  -8.521   2.172  -2.021
  156   1HB   PHE  20          1HB       PHE  20  -7.283   0.657  -0.328
  157   2HB   PHE  20          2HB       PHE  20  -8.837  -0.146  -0.147
  158    HD1  PHE  20           HD1      PHE  20  -7.010   1.085  -3.173
  159    HD2  PHE  20           HD2      PHE  20  -8.847  -2.133  -1.091
  160    HE1  PHE  20           HE1      PHE  20  -6.565  -0.418  -5.079
  161    HE2  PHE  20           HE2      PHE  20  -8.411  -3.641  -2.985
  162    HZ   PHE  20           HZ       PHE  20  -7.272  -2.772  -4.998
  163    H    ASN  21           H        ASN  21 -10.391   2.549  -3.060
  164    HA   ASN  21           HA       ASN  21 -12.548   2.392  -3.741
  165   1HB   ASN  21          1HB       ASN  21 -12.096  -0.400  -2.701
  166   2HB   ASN  21          2HB       ASN  21 -13.578   0.077  -3.517
  167   1HD2  ASN  21          1HD2      ASN  21 -11.410   1.961  -4.964
  168   2HD2  ASN  21          2HD2      ASN  21 -10.908   0.930  -6.259
  169    H    GLY  22           H        GLY  22 -12.220   3.585  -1.198
  170   1HA   GLY  22          1HA       GLY  22 -13.828   4.506   0.227
  171   2HA   GLY  22          2HA       GLY  22 -14.921   3.204  -0.191
  172    H    LYS  23           H        LYS  23 -12.051   1.768   0.602
  173    HA   LYS  23           HA       LYS  23 -12.915   1.466   3.402
  174   1HB   LYS  23          1HB       LYS  23 -13.089  -0.591   1.962
  175   2HB   LYS  23          2HB       LYS  23 -11.349  -0.532   1.750
  176   1HG   LYS  23          1HG       LYS  23 -11.053  -0.802   4.168
  177   2HG   LYS  23          2HG       LYS  23 -12.804  -0.889   4.363
  178   1HD   LYS  23          1HD       LYS  23 -12.862  -2.882   2.934
  179   2HD   LYS  23          2HD       LYS  23 -11.112  -2.798   2.742
  180   1HE   LYS  23          1HE       LYS  23 -10.849  -3.097   5.175
  181   2HE   LYS  23          2HE       LYS  23 -12.598  -3.213   5.342
  182   1HZ   LYS  23          1HZ       LYS  23 -10.821  -5.274   4.853
  183   2HZ   LYS  23          2HZ       LYS  23 -11.675  -5.057   3.395
  184   3HZ   LYS  23          3HZ       LYS  23 -12.522  -5.351   4.836
  185    H    GLU  24           H        GLU  24 -11.551   2.178   4.915
  186    HA   GLU  24           HA       GLU  24  -8.895   3.036   4.084
  187   1HB   GLU  24          1HB       GLU  24 -10.370   3.416   6.695
  188   2HB   GLU  24          2HB       GLU  24  -8.798   4.097   6.321
  189   1HG   GLU  24          1HG       GLU  24  -9.816   5.372   4.483
  190   2HG   GLU  24          2HG       GLU  24 -11.388   4.711   4.934
  191    H    TYR  25           H        TYR  25  -7.029   2.112   4.682
  192    HA   TYR  25           HA       TYR  25  -7.170  -0.179   6.538
  193   1HB   TYR  25          1HB       TYR  25  -5.339   0.212   4.192
  194   2HB   TYR  25          2HB       TYR  25  -5.248  -1.135   5.302
  195    HD1  TYR  25           HD1      TYR  25  -7.351   0.464   2.719
  196    HD2  TYR  25           HD2      TYR  25  -6.615  -3.042   5.009
  197    HE1  TYR  25           HE1      TYR  25  -8.906  -0.794   1.274
  198    HE2  TYR  25           HE2      TYR  25  -8.170  -4.309   3.572
  199    HH   TYR  25           HH       TYR  25  -9.068  -4.170   1.275
  200    H    ASN  26           H        ASN  26  -6.033   0.023   8.315
  201    HA   ASN  26           HA       ASN  26  -4.018   2.136   8.524
  202   1HB   ASN  26          1HB       ASN  26  -5.710   0.660  10.467
  203   2HB   ASN  26          2HB       ASN  26  -4.100   1.119  11.018
  204   1HD2  ASN  26          1HD2      ASN  26  -7.259   2.131  10.458
  205   2HD2  ASN  26          2HD2      ASN  26  -7.037   3.819  10.766
  206    H    SER  27           H        SER  27  -3.905  -0.639   7.246
  207    HA   SER  27           HA       SER  27  -1.198  -1.203   8.050
  208   1HB   SER  27          1HB       SER  27  -1.687  -3.651   8.371
  209   2HB   SER  27          2HB       SER  27  -2.354  -2.619   9.639
  210    HG   SER  27           HG       SER  27  -4.248  -3.386   9.138
  211    H    CYS  28           H        CYS  28  -0.451  -3.206   6.636
  212    HA   CYS  28           HA       CYS  28  -1.067  -2.499   3.910
  213   1HB   CYS  28          1HB       CYS  28   0.708  -4.703   4.995
  214   2HB   CYS  28          2HB       CYS  28   0.680  -4.116   3.330
  215    H    THR  29           H        THR  29  -2.195  -3.753   2.417
  216    HA   THR  29           HA       THR  29  -3.502  -6.145   3.487
  217    HB   THR  29           HB       THR  29  -5.035  -4.198   3.475
  218    HG1  THR  29           HG1      THR  29  -6.057  -6.122   3.203
  219   1HG2  THR  29          1HG2      THR  29  -3.928  -3.334   1.212
  220   2HG2  THR  29          2HG2      THR  29  -5.580  -2.937   1.689
  221   3HG2  THR  29          3HG2      THR  29  -5.280  -4.234   0.533
  222    H    ASP  30           H        ASP  30  -4.367  -7.617   1.780
  223    HA   ASP  30           HA       ASP  30  -2.537  -7.642  -0.496
  224   1HB   ASP  30          1HB       ASP  30  -4.111 -10.019  -0.214
  225   2HB   ASP  30          2HB       ASP  30  -2.388  -9.869  -0.345
  226    H    THR  31           H        THR  31  -5.415  -6.521   0.184
  227    HA   THR  31           HA       THR  31  -7.235  -7.618  -1.628
  228    HB   THR  31           HB       THR  31  -7.075  -4.727  -0.796
  229    HG1  THR  31           HG1      THR  31  -7.004  -5.799   1.105
  230   1HG2  THR  31          1HG2      THR  31  -9.697  -5.551  -0.637
  231   2HG2  THR  31          2HG2      THR  31  -9.107  -6.294  -2.124
  232   3HG2  THR  31          3HG2      THR  31  -8.985  -4.548  -1.902
  233    H    GLY  32           H        GLY  32  -7.670  -7.241  -3.763
  234   1HA   GLY  32          1HA       GLY  32  -7.481  -6.206  -5.844
  235   2HA   GLY  32          2HA       GLY  32  -6.253  -5.142  -5.173
  236    H    ARG  33           H        ARG  33  -4.684  -7.237  -4.013
  237    HA   ARG  33           HA       ARG  33  -3.138  -8.030  -6.321
  238   1HB   ARG  33          1HB       ARG  33  -2.730  -8.537  -3.361
  239   2HB   ARG  33          2HB       ARG  33  -1.579  -8.949  -4.611
  240   1HG   ARG  33          1HG       ARG  33  -2.494  -6.177  -3.912
  241   2HG   ARG  33          2HG       ARG  33  -0.955  -6.906  -3.454
  242   1HD   ARG  33          1HD       ARG  33  -1.908  -6.288  -6.250
  243   2HD   ARG  33          2HD       ARG  33  -0.651  -5.439  -5.351
  244    HE   ARG  33           HE       ARG  33  -0.058  -8.218  -5.646
  245   1HH1  ARG  33          1HH1      ARG  33   0.043  -5.119  -7.260
  246   2HH1  ARG  33          2HH1      ARG  33   1.248  -5.611  -8.408
  247   1HH2  ARG  33          1HH2      ARG  33   1.526  -8.877  -7.120
  248   2HH2  ARG  33          2HH2      ARG  33   2.145  -7.753  -8.294
  249    H    SER  34           H        SER  34  -2.501 -10.225  -6.723
  250    HA   SER  34           HA       SER  34  -4.556 -12.166  -5.892
  251   1HB   SER  34          1HB       SER  34  -2.790 -12.310  -8.349
  252   2HB   SER  34          2HB       SER  34  -4.195 -13.309  -7.980
  253    HG   SER  34           HG       SER  34  -5.078 -11.815  -9.250
  254    H    ASP  35           H        ASP  35  -1.295 -11.320  -5.735
  255    HA   ASP  35           HA       ASP  35  -0.265 -13.936  -5.279
  256   1HB   ASP  35          1HB       ASP  35   1.451 -11.765  -4.508
  257   2HB   ASP  35          2HB       ASP  35   1.743 -13.017  -5.682
  258    H    GLY  36           H        GLY  36  -2.025 -11.969  -3.442
  259   1HA   GLY  36          1HA       GLY  36  -2.430 -11.794  -1.179
  260   2HA   GLY  36          2HA       GLY  36  -1.467 -13.257  -0.992
  261    H    PHE  37           H        PHE  37  -0.395 -10.283  -2.445
  262    HA   PHE  37           HA       PHE  37   1.767 -10.095  -0.496
  263   1HB   PHE  37          1HB       PHE  37   1.805  -9.921  -3.193
  264   2HB   PHE  37          2HB       PHE  37   1.584  -8.224  -2.801
  265    HD1  PHE  37           HD1      PHE  37   3.871  -8.823  -4.279
  266    HD2  PHE  37           HD2      PHE  37   3.313  -9.218  -0.080
  267    HE1  PHE  37           HE1      PHE  37   6.291  -8.581  -3.948
  268    HE2  PHE  37           HE2      PHE  37   5.739  -8.969   0.262
  269    HZ   PHE  37           HZ       PHE  37   7.229  -8.650  -1.664
  270    H    LEU  38           H        LEU  38   1.790  -8.559   1.061
  271    HA   LEU  38           HA       LEU  38  -0.452  -6.786   1.312
  272   1HB   LEU  38          1HB       LEU  38   2.005  -7.149   2.974
  273   2HB   LEU  38          2HB       LEU  38   0.777  -5.972   3.357
  274    HG   LEU  38           HG       LEU  38  -0.820  -8.059   3.335
  275   1HD1  LEU  38          1HD1      LEU  38   1.850  -9.336   3.895
  276   2HD1  LEU  38          2HD1      LEU  38   0.811  -9.655   2.506
  277   3HD1  LEU  38          3HD1      LEU  38   0.271 -10.086   4.127
  278   1HD2  LEU  38          1HD2      LEU  38   1.026  -7.034   5.424
  279   2HD2  LEU  38          2HD2      LEU  38   0.080  -8.478   5.782
  280   3HD2  LEU  38          3HD2      LEU  38  -0.736  -6.980   5.336
  281    H    TRP  39           H        TRP  39  -0.606  -4.733   0.730
  282    HA   TRP  39           HA       TRP  39   1.838  -3.205   0.215
  283   1HB   TRP  39          1HB       TRP  39   0.926  -2.328  -1.881
  284   2HB   TRP  39          2HB       TRP  39   1.052  -4.080  -1.955
  285    HD1  TRP  39           HD1      TRP  39  -1.315  -5.471  -1.815
  286    HE1  TRP  39           HE1      TRP  39  -3.691  -4.776  -2.481
  287    HE3  TRP  39           HE3      TRP  39  -0.672  -0.407  -2.033
  288    HZ2  TRP  39           HZ2      TRP  39  -5.106  -2.404  -3.040
  289    HZ3  TRP  39           HZ3      TRP  39  -2.590   0.999  -2.653
  290    HH2  TRP  39           HH2      TRP  39  -4.761   0.015  -3.140
  291    H    CYS  40           H        CYS  40   1.266  -0.858  -0.199
  292    HA   CYS  40           HA       CYS  40  -1.158   0.092   1.083
  293   1HB   CYS  40          1HB       CYS  40  -0.092   1.348   2.798
  294   2HB   CYS  40          2HB       CYS  40   0.617  -0.258   2.890
  295    H    SER  41           H        SER  41  -1.414   2.462   0.638
  296    HA   SER  41           HA       SER  41   0.064   3.136  -1.794
  297   1HB   SER  41          1HB       SER  41  -1.703   4.887  -2.106
  298   2HB   SER  41          2HB       SER  41  -2.320   3.236  -2.088
  299    HG   SER  41           HG       SER  41  -2.661   5.297  -0.242
  300    H    THR  42           H        THR  42   0.855   5.332  -2.096
  301    HA   THR  42           HA       THR  42   2.197   6.285   0.274
  302    HB   THR  42           HB       THR  42   2.176   7.624  -2.431
  303    HG1  THR  42           HG1      THR  42   3.683   5.352  -1.635
  304   1HG2  THR  42          1HG2      THR  42   3.734   8.880  -1.500
  305   2HG2  THR  42          2HG2      THR  42   4.760   7.443  -1.433
  306   3HG2  THR  42          3HG2      THR  42   3.756   7.878  -0.048
  307    H    THR  43           H        THR  43  -0.406   7.277  -1.819
  308    HA   THR  43           HA       THR  43  -0.800   9.734  -0.299
  309    HB   THR  43           HB       THR  43  -2.392  10.274  -2.128
  310    HG1  THR  43           HG1      THR  43  -2.812   8.848  -3.688
  311   1HG2  THR  43          1HG2      THR  43  -0.504   9.796  -4.034
  312   2HG2  THR  43          2HG2      THR  43   0.454   9.771  -2.553
  313   3HG2  THR  43          3HG2      THR  43  -0.524  11.186  -2.944
  314    H    TYR  44           H        TYR  44  -3.453  10.137  -0.441
  315    HA   TYR  44           HA       TYR  44  -4.443   8.307   1.530
  316   1HB   TYR  44          1HB       TYR  44  -4.910  10.842   1.384
  317   2HB   TYR  44          2HB       TYR  44  -6.093  10.417   0.148
  318    HD1  TYR  44           HD1      TYR  44  -7.477  11.726   2.016
  319    HD2  TYR  44           HD2      TYR  44  -5.951   7.777   2.478
  320    HE1  TYR  44           HE1      TYR  44  -9.115  11.302   3.793
  321    HE2  TYR  44           HE2      TYR  44  -7.595   7.347   4.255
  322    HH   TYR  44           HH       TYR  44  -9.437   8.131   5.312
  323    H    ASN  45           H        ASN  45  -5.828   9.370  -1.593
  324    HA   ASN  45           HA       ASN  45  -7.257   6.832  -1.712
  325   1HB   ASN  45          1HB       ASN  45  -8.398   9.068  -2.174
  326   2HB   ASN  45          2HB       ASN  45  -7.481   9.128  -3.659
  327   1HD2  ASN  45          1HD2      ASN  45  -7.963   6.018  -3.683
  328   2HD2  ASN  45          2HD2      ASN  45  -9.522   6.002  -4.349
  329    H    PHE  46           H        PHE  46  -6.183   5.195  -2.630
  330    HA   PHE  46           HA       PHE  46  -3.898   5.443  -4.253
  331   1HB   PHE  46          1HB       PHE  46  -4.258   3.455  -2.965
  332   2HB   PHE  46          2HB       PHE  46  -5.800   3.134  -3.791
  333    HD1  PHE  46           HD1      PHE  46  -2.163   3.667  -4.643
  334    HD2  PHE  46           HD2      PHE  46  -5.758   1.519  -5.431
  335    HE1  PHE  46           HE1      PHE  46  -0.983   2.295  -6.305
  336    HE2  PHE  46           HE2      PHE  46  -4.582   0.150  -7.087
  337    HZ   PHE  46           HZ       PHE  46  -2.193   0.533  -7.528
  338    H    GLU  47           H        GLU  47  -7.287   5.040  -5.082
  339    HA   GLU  47           HA       GLU  47  -7.123   4.283  -7.724
  340   1HB   GLU  47          1HB       GLU  47  -9.162   4.620  -6.177
  341   2HB   GLU  47          2HB       GLU  47  -9.168   6.267  -6.785
  342   1HG   GLU  47          1HG       GLU  47  -9.326   5.351  -9.087
  343   2HG   GLU  47          2HG       GLU  47  -9.496   3.743  -8.385
  344    H    LYS  48           H        LYS  48  -7.111   7.624  -6.479
  345    HA   LYS  48           HA       LYS  48  -6.973   8.724  -9.114
  346   1HB   LYS  48          1HB       LYS  48  -6.642  10.903  -7.906
  347   2HB   LYS  48          2HB       LYS  48  -8.123  10.034  -7.529
  348   1HG   LYS  48          1HG       LYS  48  -7.180   9.248  -5.443
  349   2HG   LYS  48          2HG       LYS  48  -5.634  10.000  -5.832
  350   1HD   LYS  48          1HD       LYS  48  -8.233  11.492  -5.506
  351   2HD   LYS  48          2HD       LYS  48  -7.014  11.311  -4.241
  352   1HE   LYS  48          1HE       LYS  48  -5.381  12.458  -5.649
  353   2HE   LYS  48          2HE       LYS  48  -6.584  12.628  -6.927
  354   1HZ   LYS  48          1HZ       LYS  48  -6.713  14.659  -5.874
  355   2HZ   LYS  48          2HZ       LYS  48  -6.414  14.010  -4.336
  356   3HZ   LYS  48          3HZ       LYS  48  -7.934  13.803  -5.059
  357    H    ASP  49           H        ASP  49  -4.574   8.287  -6.525
  358    HA   ASP  49           HA       ASP  49  -2.572   9.656  -8.110
  359   1HB   ASP  49          1HB       ASP  49  -2.528   8.381  -5.389
  360   2HB   ASP  49          2HB       ASP  49  -1.071   9.006  -6.153
  361    H    GLY  50           H        GLY  50  -2.978   6.329  -6.894
  362   1HA   GLY  50          1HA       GLY  50  -2.415   4.383  -8.041
  363   2HA   GLY  50          2HA       GLY  50  -1.597   5.360  -9.241
  364    H    LYS  51           H        LYS  51  -0.569   6.327  -6.218
  365    HA   LYS  51           HA       LYS  51   1.960   4.991  -6.596
  366   1HB   LYS  51          1HB       LYS  51   0.997   7.100  -4.715
  367   2HB   LYS  51          2HB       LYS  51   2.589   6.363  -4.561
  368   1HG   LYS  51          1HG       LYS  51   3.307   7.219  -6.591
  369   2HG   LYS  51          2HG       LYS  51   1.659   7.539  -7.144
  370   1HD   LYS  51          1HD       LYS  51   1.418   9.290  -5.537
  371   2HD   LYS  51          2HD       LYS  51   3.005   8.921  -4.855
  372   1HE   LYS  51          1HE       LYS  51   4.110   9.622  -6.850
  373   2HE   LYS  51          2HE       LYS  51   2.581   9.753  -7.719
  374   1HZ   LYS  51          1HZ       LYS  51   3.734  11.861  -6.764
  375   2HZ   LYS  51          2HZ       LYS  51   3.003  11.385  -5.308
  376   3HZ   LYS  51          3HZ       LYS  51   2.043  11.698  -6.682
  377    H    TYR  52           H        TYR  52   2.564   3.173  -5.650
  378    HA   TYR  52           HA       TYR  52   1.490   2.439  -3.039
  379   1HB   TYR  52          1HB       TYR  52   0.728   0.259  -3.778
  380   2HB   TYR  52          2HB       TYR  52  -0.078   1.496  -4.742
  381    HD1  TYR  52           HD1      TYR  52   1.092   2.093  -7.019
  382    HD2  TYR  52           HD2      TYR  52   1.769  -1.511  -4.860
  383    HE1  TYR  52           HE1      TYR  52   1.951   1.047  -9.061
  384    HE2  TYR  52           HE2      TYR  52   2.624  -2.575  -6.903
  385    HH   TYR  52           HH       TYR  52   2.595  -0.874 -10.018
  386    H    GLY  53           H        GLY  53   2.484   0.340  -2.304
  387   1HA   GLY  53          1HA       GLY  53   4.915  -0.568  -3.493
  388   2HA   GLY  53          2HA       GLY  53   5.195   0.430  -2.068
  389    H    PHE  54           H        PHE  54   5.882  -2.314  -2.283
  390    HA   PHE  54           HA       PHE  54   3.839  -3.632  -0.699
  391   1HB   PHE  54          1HB       PHE  54   6.344  -4.794  -1.885
  392   2HB   PHE  54          2HB       PHE  54   5.062  -5.703  -1.096
  393    HD1  PHE  54           HD1      PHE  54   5.958  -3.754  -4.088
  394    HD2  PHE  54           HD2      PHE  54   2.998  -6.164  -2.206
  395    HE1  PHE  54           HE1      PHE  54   4.753  -3.917  -6.221
  396    HE2  PHE  54           HE2      PHE  54   1.783  -6.336  -4.343
  397    HZ   PHE  54           HZ       PHE  54   2.661  -5.217  -6.353
  398    H    CYS  55           H        CYS  55   4.174  -4.506   1.317
  399    HA   CYS  55           HA       CYS  55   6.239  -3.123   2.837
  400   1HB   CYS  55          1HB       CYS  55   4.040  -4.740   4.084
  401   2HB   CYS  55          2HB       CYS  55   4.877  -3.324   4.711
  402    HA   PRO  56           HA       PRO  56   7.049  -7.536   4.508
  403   1HB   PRO  56          1HB       PRO  56   5.738  -9.477   2.857
  404   2HB   PRO  56          2HB       PRO  56   5.595  -9.224   4.589
  405   1HG   PRO  56          1HG       PRO  56   3.580  -8.696   2.834
  406   2HG   PRO  56          2HG       PRO  56   3.785  -7.850   4.378
  407   1HD   PRO  56          1HD       PRO  56   4.499  -6.962   1.614
  408   2HD   PRO  56          2HD       PRO  56   3.819  -6.025   2.961
  409    H    HIS  57           H        HIS  57   9.098  -7.396   3.836
  410    HA   HIS  57           HA       HIS  57   9.735  -8.525   1.192
  411   1HB   HIS  57          1HB       HIS  57  11.895  -7.317   1.340
  412   2HB   HIS  57          2HB       HIS  57  10.512  -6.233   1.360
  413    HD1  HIS  57           HD1      HIS  57  12.631  -4.701   2.333
  414    HD2  HIS  57           HD2      HIS  57  10.947  -7.528   4.874
  415    HE1  HIS  57           HE1      HIS  57  13.336  -4.029   4.650
  416    H    GLU  58           H        GLU  58   9.536  -9.394   4.276
  417    HA   GLU  58           HA       GLU  58  11.941 -11.076   4.265
  418   1HB   GLU  58          1HB       GLU  58  11.497 -11.403   6.667
  419   2HB   GLU  58          2HB       GLU  58  11.724  -9.715   6.261
  420   1HG   GLU  58          1HG       GLU  58   9.283  -9.393   6.326
  421   2HG   GLU  58          2HG       GLU  58   9.089 -11.090   6.765
  422    H    ALA  59           H        ALA  59   9.402 -11.527   2.768
  423    HA   ALA  59           HA       ALA  59   8.759 -14.174   3.875
  424   1HB   ALA  59          1HB       ALA  59   6.993 -11.998   3.258
  425   2HB   ALA  59          2HB       ALA  59   6.628 -13.556   3.995
  426   3HB   ALA  59          3HB       ALA  59   6.616 -13.394   2.240
  Start of MODEL   15
    1   1H    ARG   1          1H        ARG   1   4.697   3.249  11.964
    2   2H    ARG   1          2H        ARG   1   5.571   1.866  11.434
    3   3H    ARG   1          3H        ARG   1   3.870   1.777  11.649
    4    HA   ARG   1           HA       ARG   1   3.493   2.448   9.643
    5   1HB   ARG   1          1HB       ARG   1   3.762   4.735  10.539
    6   2HB   ARG   1          2HB       ARG   1   5.491   4.656  10.235
    7   1HG   ARG   1          1HG       ARG   1   5.128   4.611   7.857
    8   2HG   ARG   1          2HG       ARG   1   3.378   4.515   8.092
    9   1HD   ARG   1          1HD       ARG   1   3.505   6.707   9.295
   10   2HD   ARG   1          2HD       ARG   1   5.197   6.805   8.820
   11    HE   ARG   1           HE       ARG   1   3.486   6.426   6.551
   12   1HH1  ARG   1          1HH1      ARG   1   4.660   8.792   8.835
   13   2HH1  ARG   1          2HH1      ARG   1   4.399  10.144   7.778
   14   1HH2  ARG   1          1HH2      ARG   1   3.144   8.221   5.131
   15   2HH2  ARG   1          2HH2      ARG   1   3.537   9.820   5.685
   16    H    ILE   2           H        ILE   2   4.447   0.479   8.918
   17    HA   ILE   2           HA       ILE   2   7.129   0.078   8.370
   18    HB   ILE   2           HB       ILE   2   5.265  -1.173   6.425
   19   1HG1  ILE   2          1HG1      ILE   2   4.855  -1.575   9.396
   20   2HG1  ILE   2          2HG1      ILE   2   3.690  -0.932   8.244
   21   1HG2  ILE   2          1HG2      ILE   2   6.678  -2.862   8.381
   22   2HG2  ILE   2          2HG2      ILE   2   7.694  -1.905   7.305
   23   3HG2  ILE   2          3HG2      ILE   2   6.519  -3.035   6.634
   24   1HD1  ILE   2          1HD1      ILE   2   3.207  -3.243   8.852
   25   2HD1  ILE   2          2HD1      ILE   2   4.784  -3.728   8.226
   26   3HD1  ILE   2          3HD1      ILE   2   3.564  -3.073   7.132
   27    HA   PRO   3           HA       PRO   3   7.998   2.551   4.833
   28   1HB   PRO   3          1HB       PRO   3  10.080   0.675   4.045
   29   2HB   PRO   3          2HB       PRO   3  10.243   2.294   4.732
   30   1HG   PRO   3          1HG       PRO   3  10.902   0.027   6.101
   31   2HG   PRO   3          2HG       PRO   3  10.329   1.505   6.897
   32   1HD   PRO   3          1HD       PRO   3   8.827  -1.000   6.235
   33   2HD   PRO   3          2HD       PRO   3   8.758   0.002   7.700
   34    H    VAL   4           H        VAL   4   8.933   2.008   2.445
   35    HA   VAL   4           HA       VAL   4   7.129   0.029   1.208
   36    HB   VAL   4           HB       VAL   4   7.738   2.841   0.188
   37   1HG1  VAL   4          1HG1      VAL   4   6.045   0.657  -1.010
   38   2HG1  VAL   4          2HG1      VAL   4   7.552   1.313  -1.656
   39   3HG1  VAL   4          3HG1      VAL   4   6.108   2.324  -1.576
   40   1HG2  VAL   4          1HG2      VAL   4   6.086   3.373   1.612
   41   2HG2  VAL   4          2HG2      VAL   4   5.498   1.713   1.725
   42   3HG2  VAL   4          3HG2      VAL   4   5.046   2.721   0.347
   43    H    LYS   5           H        LYS   5   7.974  -0.924  -0.761
   44    HA   LYS   5           HA       LYS   5  10.797  -0.275  -1.266
   45   1HB   LYS   5          1HB       LYS   5   9.863  -2.680  -0.110
   46   2HB   LYS   5          2HB       LYS   5  10.386  -3.067  -1.746
   47   1HG   LYS   5          1HG       LYS   5  12.036  -1.656   0.345
   48   2HG   LYS   5          2HG       LYS   5  12.205  -3.348  -0.166
   49   1HD   LYS   5          1HD       LYS   5  12.974  -2.734  -2.306
   50   2HD   LYS   5          2HD       LYS   5  12.424  -1.067  -2.119
   51   1HE   LYS   5          1HE       LYS   5  14.667  -2.367  -0.569
   52   2HE   LYS   5          2HE       LYS   5  14.868  -1.252  -1.922
   53   1HZ   LYS   5          1HZ       LYS   5  13.970  -0.705   0.824
   54   2HZ   LYS   5          2HZ       LYS   5  13.395   0.284  -0.432
   55   3HZ   LYS   5          3HZ       LYS   5  15.064   0.161  -0.146
   56    H    TYR   6           H        TYR   6   9.037  -2.909  -2.764
   57    HA   TYR   6           HA       TYR   6   9.681  -1.884  -5.358
   58   1HB   TYR   6          1HB       TYR   6   7.983  -4.292  -4.675
   59   2HB   TYR   6          2HB       TYR   6   8.787  -3.958  -6.211
   60    HD1  TYR   6           HD1      TYR   6  11.461  -3.308  -5.707
   61    HD2  TYR   6           HD2      TYR   6   9.026  -6.019  -3.498
   62    HE1  TYR   6           HE1      TYR   6  13.472  -4.465  -4.920
   63    HE2  TYR   6           HE2      TYR   6  11.032  -7.179  -2.707
   64    HH   TYR   6           HH       TYR   6  14.180  -6.519  -4.017
   65    H    GLY   7           H        GLY   7   8.317  -1.263  -6.989
   66   1HA   GLY   7          1HA       GLY   7   5.869  -1.127  -7.641
   67   2HA   GLY   7          2HA       GLY   7   5.684  -0.252  -6.135
   68    H    ASN   8           H        ASN   8   4.990   1.619  -7.308
   69    HA   ASN   8           HA       ASN   8   7.088   2.841  -8.954
   70   1HB   ASN   8          1HB       ASN   8   5.441   4.291  -9.922
   71   2HB   ASN   8          2HB       ASN   8   4.841   2.642  -9.989
   72   1HD2  ASN   8          1HD2      ASN   8   3.400   5.124 -10.173
   73   2HD2  ASN   8          2HD2      ASN   8   2.234   5.103  -8.900
   74    H    ALA   9           H        ALA   9   6.382   2.847  -5.837
   75    HA   ALA   9           HA       ALA   9   6.593   5.689  -5.294
   76   1HB   ALA   9          1HB       ALA   9   6.677   3.464  -3.278
   77   2HB   ALA   9          2HB       ALA   9   5.160   4.072  -3.943
   78   3HB   ALA   9          3HB       ALA   9   6.215   5.151  -3.030
   79    H    ASP  10           H        ASP  10   8.283   6.073  -3.357
   80    HA   ASP  10           HA       ASP  10  10.838   5.098  -4.421
   81   1HB   ASP  10          1HB       ASP  10  10.091   7.540  -2.822
   82   2HB   ASP  10          2HB       ASP  10  11.764   7.003  -2.950
   83    H    GLY  11           H        GLY  11  10.975   6.434  -1.317
   84   1HA   GLY  11          1HA       GLY  11  11.073   3.773  -0.092
   85   2HA   GLY  11          2HA       GLY  11  12.344   4.952   0.190
   86    H    GLU  12           H        GLU  12   8.953   5.813  -0.029
   87    HA   GLU  12           HA       GLU  12   9.019   7.069   2.551
   88   1HB   GLU  12          1HB       GLU  12   6.797   6.598   0.555
   89   2HB   GLU  12          2HB       GLU  12   6.536   7.417   2.086
   90   1HG   GLU  12          1HG       GLU  12   6.759   9.050   0.372
   91   2HG   GLU  12          2HG       GLU  12   8.190   9.128   1.393
   92    H    TYR  13           H        TYR  13   6.736   6.596   3.829
   93    HA   TYR  13           HA       TYR  13   6.706   3.697   4.278
   94   1HB   TYR  13          1HB       TYR  13   5.986   5.649   6.439
   95   2HB   TYR  13          2HB       TYR  13   6.397   3.936   6.579
   96    HD1  TYR  13           HD1      TYR  13   8.007   7.152   5.499
   97    HD2  TYR  13           HD2      TYR  13   8.404   3.369   7.394
   98    HE1  TYR  13           HE1      TYR  13  10.317   7.704   6.106
   99    HE2  TYR  13           HE2      TYR  13  10.712   3.900   8.003
  100    HH   TYR  13           HH       TYR  13  11.991   6.470   8.340
  101    H    CYS  14           H        CYS  14   4.735   2.741   4.760
  102    HA   CYS  14           HA       CYS  14   2.601   3.372   3.198
  103   1HB   CYS  14          1HB       CYS  14   2.545   2.000   5.887
  104   2HB   CYS  14          2HB       CYS  14   1.262   1.918   4.686
  105    H    LYS  15           H        LYS  15   0.878   4.714   3.236
  106    HA   LYS  15           HA       LYS  15   0.753   6.653   5.400
  107   1HB   LYS  15          1HB       LYS  15   0.503   7.413   3.032
  108   2HB   LYS  15          2HB       LYS  15  -0.997   6.488   2.929
  109   1HG   LYS  15          1HG       LYS  15  -1.769   7.848   4.936
  110   2HG   LYS  15          2HG       LYS  15  -0.398   8.904   4.607
  111   1HD   LYS  15          1HD       LYS  15  -1.248   9.427   2.427
  112   2HD   LYS  15          2HD       LYS  15  -2.539   8.230   2.594
  113   1HE   LYS  15          1HE       LYS  15  -2.184  10.808   4.111
  114   2HE   LYS  15          2HE       LYS  15  -3.502  10.364   3.024
  115   1HZ   LYS  15          1HZ       LYS  15  -4.061   8.562   4.659
  116   2HZ   LYS  15          2HZ       LYS  15  -4.293  10.135   5.248
  117   3HZ   LYS  15          3HZ       LYS  15  -2.928   9.248   5.724
  118    H    PHE  16           H        PHE  16  -0.363   6.159   7.147
  119    HA   PHE  16           HA       PHE  16  -2.747   4.457   6.828
  120   1HB   PHE  16          1HB       PHE  16  -0.788   4.697   9.124
  121   2HB   PHE  16          2HB       PHE  16  -2.328   3.840   9.247
  122    HD1  PHE  16           HD1      PHE  16   0.373   2.596   9.689
  123    HD2  PHE  16           HD2      PHE  16  -2.033   2.945   6.198
  124    HE1  PHE  16           HE1      PHE  16   1.410   0.571   8.772
  125    HE2  PHE  16           HE2      PHE  16  -1.009   0.928   5.277
  126    HZ   PHE  16           HZ       PHE  16   0.738  -0.286   6.550
  127    HA   PRO  17           HA       PRO  17  -4.427   4.234   6.904
  128   1HB   PRO  17          1HB       PRO  17  -7.040   5.032   6.606
  129   2HB   PRO  17          2HB       PRO  17  -6.408   4.185   8.019
  130   1HG   PRO  17          1HG       PRO  17  -7.363   6.900   7.856
  131   2HG   PRO  17          2HG       PRO  17  -6.788   6.029   9.284
  132   1HD   PRO  17          1HD       PRO  17  -5.369   7.962   7.567
  133   2HD   PRO  17          2HD       PRO  17  -5.027   7.468   9.236
  134    H    PHE  18           H        PHE  18  -5.157   3.796   4.760
  135    HA   PHE  18           HA       PHE  18  -5.214   6.143   2.996
  136   1HB   PHE  18          1HB       PHE  18  -4.152   4.864   1.219
  137   2HB   PHE  18          2HB       PHE  18  -3.127   4.866   2.644
  138    HD1  PHE  18           HD1      PHE  18  -3.098   2.783   4.094
  139    HD2  PHE  18           HD2      PHE  18  -4.834   2.893   0.215
  140    HE1  PHE  18           HE1      PHE  18  -2.933   0.333   3.949
  141    HE2  PHE  18           HE2      PHE  18  -4.681   0.448   0.060
  142    HZ   PHE  18           HZ       PHE  18  -3.731  -0.855   1.938
  143    H    LEU  19           H        LEU  19  -6.580   5.966   1.119
  144    HA   LEU  19           HA       LEU  19  -8.930   4.322   1.687
  145   1HB   LEU  19          1HB       LEU  19  -9.153   6.776   1.388
  146   2HB   LEU  19          2HB       LEU  19  -8.597   6.591  -0.267
  147    HG   LEU  19           HG       LEU  19 -10.555   5.109  -0.693
  148   1HD1  LEU  19          1HD1      LEU  19 -12.464   5.393   0.936
  149   2HD1  LEU  19          2HD1      LEU  19 -11.263   5.954   2.103
  150   3HD1  LEU  19          3HD1      LEU  19 -11.156   4.323   1.438
  151   1HD2  LEU  19          1HD2      LEU  19 -12.245   7.062  -0.480
  152   2HD2  LEU  19          2HD2      LEU  19 -10.837   7.243  -1.528
  153   3HD2  LEU  19          3HD2      LEU  19 -10.844   7.981   0.074
  154    H    PHE  20           H        PHE  20  -9.312   2.538   0.631
  155    HA   PHE  20           HA       PHE  20  -8.287   2.221  -2.118
  156   1HB   PHE  20          1HB       PHE  20  -7.071   0.799  -0.339
  157   2HB   PHE  20          2HB       PHE  20  -8.612  -0.023  -0.159
  158    HD1  PHE  20           HD1      PHE  20  -6.855   1.107  -3.256
  159    HD2  PHE  20           HD2      PHE  20  -8.454  -2.090  -0.952
  160    HE1  PHE  20           HE1      PHE  20  -6.354  -0.479  -5.081
  161    HE2  PHE  20           HE2      PHE  20  -7.954  -3.679  -2.757
  162    HZ   PHE  20           HZ       PHE  20  -6.898  -2.863  -4.840
  163    H    ASN  21           H        ASN  21 -10.109   2.484  -3.267
  164    HA   ASN  21           HA       ASN  21 -12.206   2.196  -4.087
  165   1HB   ASN  21          1HB       ASN  21 -11.803  -0.579  -2.970
  166   2HB   ASN  21          2HB       ASN  21 -13.050  -0.123  -4.126
  167   1HD2  ASN  21          1HD2      ASN  21 -10.347  -1.745  -3.986
  168   2HD2  ASN  21          2HD2      ASN  21  -9.645  -1.380  -5.525
  169    H    GLY  22           H        GLY  22 -12.167   3.323  -1.446
  170   1HA   GLY  22          1HA       GLY  22 -14.097   4.092  -0.301
  171   2HA   GLY  22          2HA       GLY  22 -14.902   2.591  -0.700
  172    H    LYS  23           H        LYS  23 -11.909   1.719   0.408
  173    HA   LYS  23           HA       LYS  23 -12.869   1.610   3.195
  174   1HB   LYS  23          1HB       LYS  23 -13.008  -0.610   2.092
  175   2HB   LYS  23          2HB       LYS  23 -11.280  -0.532   1.764
  176   1HG   LYS  23          1HG       LYS  23 -10.878  -0.401   4.206
  177   2HG   LYS  23          2HG       LYS  23 -12.605  -0.633   4.466
  178   1HD   LYS  23          1HD       LYS  23 -12.477  -2.790   3.293
  179   2HD   LYS  23          2HD       LYS  23 -10.735  -2.558   3.082
  180   1HE   LYS  23          1HE       LYS  23 -12.275  -2.950   5.649
  181   2HE   LYS  23          2HE       LYS  23 -11.007  -3.976   4.973
  182   1HZ   LYS  23          1HZ       LYS  23  -9.589  -1.815   5.235
  183   2HZ   LYS  23          2HZ       LYS  23  -9.865  -2.813   6.577
  184   3HZ   LYS  23          3HZ       LYS  23 -10.775  -1.398   6.374
  185    H    GLU  24           H        GLU  24 -11.494   2.252   4.742
  186    HA   GLU  24           HA       GLU  24  -8.843   3.162   3.901
  187   1HB   GLU  24          1HB       GLU  24 -10.435   3.661   6.425
  188   2HB   GLU  24          2HB       GLU  24  -8.823   4.291   6.141
  189   1HG   GLU  24          1HG       GLU  24  -9.631   5.568   4.254
  190   2HG   GLU  24          2HG       GLU  24 -11.244   4.885   4.469
  191    H    TYR  25           H        TYR  25  -7.001   2.206   4.550
  192    HA   TYR  25           HA       TYR  25  -7.256  -0.079   6.385
  193   1HB   TYR  25          1HB       TYR  25  -5.299   0.392   4.152
  194   2HB   TYR  25          2HB       TYR  25  -5.171  -0.944   5.284
  195    HD1  TYR  25           HD1      TYR  25  -7.105   0.502   2.534
  196    HD2  TYR  25           HD2      TYR  25  -6.624  -2.852   5.099
  197    HE1  TYR  25           HE1      TYR  25  -8.604  -0.807   1.076
  198    HE2  TYR  25           HE2      TYR  25  -8.116  -4.180   3.642
  199    HH   TYR  25           HH       TYR  25  -8.877  -4.175   1.285
  200    H    ASN  26           H        ASN  26  -5.954  -0.268   8.110
  201    HA   ASN  26           HA       ASN  26  -4.252   2.047   8.727
  202   1HB   ASN  26          1HB       ASN  26  -5.458  -0.076  10.528
  203   2HB   ASN  26          2HB       ASN  26  -4.343   1.166  11.084
  204   1HD2  ASN  26          1HD2      ASN  26  -6.268   2.412   8.672
  205   2HD2  ASN  26          2HD2      ASN  26  -7.473   3.161   9.656
  206    H    SER  27           H        SER  27  -3.978  -0.886   7.375
  207    HA   SER  27           HA       SER  27  -1.173  -1.101   8.074
  208   1HB   SER  27          1HB       SER  27  -1.487  -3.621   8.472
  209   2HB   SER  27          2HB       SER  27  -1.992  -2.536   9.772
  210    HG   SER  27           HG       SER  27  -3.511  -4.174   8.115
  211    H    CYS  28           H        CYS  28  -0.445  -3.364   6.829
  212    HA   CYS  28           HA       CYS  28  -0.924  -2.740   4.055
  213   1HB   CYS  28          1HB       CYS  28   0.671  -4.995   5.294
  214   2HB   CYS  28          2HB       CYS  28   0.694  -4.522   3.597
  215    H    THR  29           H        THR  29  -2.307  -3.761   2.699
  216    HA   THR  29           HA       THR  29  -3.675  -6.131   3.738
  217    HB   THR  29           HB       THR  29  -5.150  -4.181   3.583
  218    HG1  THR  29           HG1      THR  29  -6.070  -6.210   3.135
  219   1HG2  THR  29          1HG2      THR  29  -3.833  -3.662   1.125
  220   2HG2  THR  29          2HG2      THR  29  -5.073  -2.708   1.939
  221   3HG2  THR  29          3HG2      THR  29  -5.538  -3.954   0.784
  222    H    ASP  30           H        ASP  30  -4.579  -7.578   2.019
  223    HA   ASP  30           HA       ASP  30  -2.632  -7.843  -0.141
  224   1HB   ASP  30          1HB       ASP  30  -4.346 -10.118   0.164
  225   2HB   ASP  30          2HB       ASP  30  -2.608 -10.069   0.166
  226    H    THR  31           H        THR  31  -5.508  -6.579   0.390
  227    HA   THR  31           HA       THR  31  -7.282  -7.657  -1.490
  228    HB   THR  31           HB       THR  31  -7.102  -4.770  -0.651
  229    HG1  THR  31           HG1      THR  31  -7.167  -5.889   1.240
  230   1HG2  THR  31          1HG2      THR  31  -8.764  -4.963  -2.301
  231   2HG2  THR  31          2HG2      THR  31  -9.604  -4.945  -0.751
  232   3HG2  THR  31          3HG2      THR  31  -9.369  -6.466  -1.613
  233    H    GLY  32           H        GLY  32  -7.549  -7.364  -3.648
  234   1HA   GLY  32          1HA       GLY  32  -7.268  -6.365  -5.729
  235   2HA   GLY  32          2HA       GLY  32  -6.111  -5.254  -5.014
  236    H    ARG  33           H        ARG  33  -4.779  -7.632  -3.721
  237    HA   ARG  33           HA       ARG  33  -3.115  -8.384  -6.017
  238   1HB   ARG  33          1HB       ARG  33  -2.592  -8.583  -3.042
  239   2HB   ARG  33          2HB       ARG  33  -1.453  -9.034  -4.294
  240   1HG   ARG  33          1HG       ARG  33  -2.531  -6.272  -3.788
  241   2HG   ARG  33          2HG       ARG  33  -0.928  -6.855  -3.345
  242   1HD   ARG  33          1HD       ARG  33  -2.035  -6.522  -6.136
  243   2HD   ARG  33          2HD       ARG  33  -0.799  -5.530  -5.366
  244    HE   ARG  33           HE       ARG  33  -0.031  -8.276  -5.469
  245   1HH1  ARG  33          1HH1      ARG  33  -0.274  -5.360  -7.374
  246   2HH1  ARG  33          2HH1      ARG  33   0.980  -5.828  -8.483
  247   1HH2  ARG  33          1HH2      ARG  33   1.578  -8.923  -6.908
  248   2HH2  ARG  33          2HH2      ARG  33   2.044  -7.880  -8.220
  249    H    SER  34           H        SER  34  -3.506 -10.315  -6.877
  250    HA   SER  34           HA       SER  34  -5.077 -12.273  -5.472
  251   1HB   SER  34          1HB       SER  34  -3.618 -12.644  -8.089
  252   2HB   SER  34          2HB       SER  34  -5.034 -13.522  -7.507
  253    HG   SER  34           HG       SER  34  -5.782 -11.047  -7.452
  254    H    ASP  35           H        ASP  35  -1.839 -11.481  -5.452
  255    HA   ASP  35           HA       ASP  35  -0.883 -14.172  -5.074
  256   1HB   ASP  35          1HB       ASP  35   1.017 -12.061  -4.590
  257   2HB   ASP  35          2HB       ASP  35   1.140 -13.419  -5.671
  258    H    GLY  36           H        GLY  36  -2.386 -12.061  -3.189
  259   1HA   GLY  36          1HA       GLY  36  -2.598 -11.839  -0.905
  260   2HA   GLY  36          2HA       GLY  36  -1.621 -13.295  -0.770
  261    H    PHE  37           H        PHE  37  -0.472 -10.431  -2.416
  262    HA   PHE  37           HA       PHE  37   1.720 -10.285  -0.526
  263   1HB   PHE  37          1HB       PHE  37   1.220  -9.230  -3.253
  264   2HB   PHE  37          2HB       PHE  37   2.254  -8.250  -2.216
  265    HD1  PHE  37           HD1      PHE  37   1.817 -11.837  -3.159
  266    HD2  PHE  37           HD2      PHE  37   4.499  -8.642  -2.322
  267    HE1  PHE  37           HE1      PHE  37   3.717 -13.311  -3.663
  268    HE2  PHE  37           HE2      PHE  37   6.412 -10.110  -2.826
  269    HZ   PHE  37           HZ       PHE  37   6.024 -12.447  -3.499
  270    H    LEU  38           H        LEU  38   2.121  -8.712   0.890
  271    HA   LEU  38           HA       LEU  38  -0.056  -6.990   1.640
  272   1HB   LEU  38          1HB       LEU  38   2.723  -7.212   2.750
  273   2HB   LEU  38          2HB       LEU  38   1.442  -6.268   3.463
  274    HG   LEU  38           HG       LEU  38   1.539  -8.210   4.763
  275   1HD1  LEU  38          1HD1      LEU  38  -0.536  -9.472   4.216
  276   2HD1  LEU  38          2HD1      LEU  38  -0.621  -8.558   2.710
  277   3HD1  LEU  38          3HD1      LEU  38  -0.721  -7.713   4.252
  278   1HD2  LEU  38          1HD2      LEU  38   1.526 -10.493   3.803
  279   2HD2  LEU  38          2HD2      LEU  38   2.982  -9.571   3.418
  280   3HD2  LEU  38          3HD2      LEU  38   1.719  -9.786   2.204
  281    H    TRP  39           H        TRP  39  -0.362  -4.967   0.922
  282    HA   TRP  39           HA       TRP  39   1.997  -3.405   0.159
  283   1HB   TRP  39          1HB       TRP  39   1.006  -2.635  -1.904
  284   2HB   TRP  39          2HB       TRP  39   1.040  -4.390  -1.915
  285    HD1  TRP  39           HD1      TRP  39  -1.387  -5.647  -1.525
  286    HE1  TRP  39           HE1      TRP  39  -3.743  -4.869  -2.146
  287    HE3  TRP  39           HE3      TRP  39  -0.500  -0.623  -2.092
  288    HZ2  TRP  39           HZ2      TRP  39  -5.064  -2.461  -2.778
  289    HZ3  TRP  39           HZ3      TRP  39  -2.400   0.837  -2.696
  290    HH2  TRP  39           HH2      TRP  39  -4.624  -0.081  -3.021
  291    H    CYS  40           H        CYS  40   1.303  -1.080  -0.341
  292    HA   CYS  40           HA       CYS  40  -1.021  -0.063   1.027
  293   1HB   CYS  40          1HB       CYS  40   0.256   1.273   2.656
  294   2HB   CYS  40          2HB       CYS  40   0.517  -0.450   2.931
  295    H    SER  41           H        SER  41  -0.996   2.408   0.817
  296    HA   SER  41           HA       SER  41   0.602   3.143  -1.539
  297   1HB   SER  41          1HB       SER  41  -1.207   4.811  -2.035
  298   2HB   SER  41          2HB       SER  41  -1.740   3.134  -2.129
  299    HG   SER  41           HG       SER  41  -2.499   5.142  -0.397
  300    H    THR  42           H        THR  42   1.278   5.410  -1.672
  301    HA   THR  42           HA       THR  42   2.109   6.353   0.953
  302    HB   THR  42           HB       THR  42   2.777   7.641  -1.696
  303    HG1  THR  42           HG1      THR  42   4.577   6.224  -1.756
  304   1HG2  THR  42          1HG2      THR  42   4.156   8.886  -0.508
  305   2HG2  THR  42          2HG2      THR  42   4.982   7.435   0.059
  306   3HG2  THR  42          3HG2      THR  42   3.622   8.085   0.973
  307    H    THR  43           H        THR  43  -0.150   7.086  -1.544
  308    HA   THR  43           HA       THR  43  -0.771   9.689  -0.371
  309    HB   THR  43           HB       THR  43  -2.248   9.913  -2.388
  310    HG1  THR  43           HG1      THR  43  -2.547   8.253  -3.617
  311   1HG2  THR  43          1HG2      THR  43   0.319   9.200  -3.615
  312   2HG2  THR  43          2HG2      THR  43   0.416  10.345  -2.278
  313   3HG2  THR  43          3HG2      THR  43  -0.596  10.706  -3.678
  314    H    TYR  44           H        TYR  44  -3.258  10.155  -0.416
  315    HA   TYR  44           HA       TYR  44  -4.445   8.293   1.402
  316   1HB   TYR  44          1HB       TYR  44  -4.734  10.892   1.245
  317   2HB   TYR  44          2HB       TYR  44  -5.997  10.495   0.081
  318    HD1  TYR  44           HD1      TYR  44  -7.484   8.330   1.121
  319    HD2  TYR  44           HD2      TYR  44  -5.567  11.425   3.323
  320    HE1  TYR  44           HE1      TYR  44  -9.049   7.966   2.986
  321    HE2  TYR  44           HE2      TYR  44  -7.125  11.069   5.187
  322    HH   TYR  44           HH       TYR  44  -9.547   8.475   5.115
  323    H    ASN  45           H        ASN  45  -5.711   9.578  -1.677
  324    HA   ASN  45           HA       ASN  45  -7.360   7.210  -1.956
  325   1HB   ASN  45          1HB       ASN  45  -8.114   9.602  -2.451
  326   2HB   ASN  45          2HB       ASN  45  -7.130   9.514  -3.889
  327   1HD2  ASN  45          1HD2      ASN  45  -8.007   6.550  -4.054
  328   2HD2  ASN  45          2HD2      ASN  45  -9.551   6.746  -4.734
  329    H    PHE  46           H        PHE  46  -6.331   5.448  -2.733
  330    HA   PHE  46           HA       PHE  46  -4.009   5.543  -4.351
  331   1HB   PHE  46          1HB       PHE  46  -4.399   3.661  -2.891
  332   2HB   PHE  46          2HB       PHE  46  -5.920   3.269  -3.727
  333    HD1  PHE  46           HD1      PHE  46  -5.867   2.159  -5.896
  334    HD2  PHE  46           HD2      PHE  46  -2.237   3.123  -3.885
  335    HE1  PHE  46           HE1      PHE  46  -4.627   0.699  -7.427
  336    HE2  PHE  46           HE2      PHE  46  -1.002   1.665  -5.418
  337    HZ   PHE  46           HZ       PHE  46  -2.199   0.446  -7.196
  338    H    GLU  47           H        GLU  47  -7.418   5.230  -5.129
  339    HA   GLU  47           HA       GLU  47  -7.300   4.278  -7.715
  340   1HB   GLU  47          1HB       GLU  47  -9.356   4.739  -6.313
  341   2HB   GLU  47          2HB       GLU  47  -9.210   6.423  -6.797
  342   1HG   GLU  47          1HG       GLU  47  -9.225   5.462  -9.208
  343   2HG   GLU  47          2HG       GLU  47  -9.919   4.035  -8.442
  344    H    LYS  48           H        LYS  48  -7.298   7.710  -6.724
  345    HA   LYS  48           HA       LYS  48  -6.916   8.580  -9.425
  346   1HB   LYS  48          1HB       LYS  48  -6.897  10.837  -8.534
  347   2HB   LYS  48          2HB       LYS  48  -8.240   9.919  -7.869
  348   1HG   LYS  48          1HG       LYS  48  -7.166   9.695  -5.772
  349   2HG   LYS  48          2HG       LYS  48  -5.634  10.288  -6.420
  350   1HD   LYS  48          1HD       LYS  48  -6.742  12.480  -6.859
  351   2HD   LYS  48          2HD       LYS  48  -8.182  11.872  -6.039
  352   1HE   LYS  48          1HE       LYS  48  -6.971  11.626  -3.976
  353   2HE   LYS  48          2HE       LYS  48  -5.447  12.027  -4.774
  354   1HZ   LYS  48          1HZ       LYS  48  -7.027  13.771  -3.465
  355   2HZ   LYS  48          2HZ       LYS  48  -7.501  14.029  -5.081
  356   3HZ   LYS  48          3HZ       LYS  48  -5.868  14.196  -4.633
  357    H    ASP  49           H        ASP  49  -4.753   8.149  -6.663
  358    HA   ASP  49           HA       ASP  49  -2.634   9.538  -8.073
  359   1HB   ASP  49          1HB       ASP  49  -2.831   8.283  -5.349
  360   2HB   ASP  49          2HB       ASP  49  -1.291   8.856  -5.999
  361    H    GLY  50           H        GLY  50  -2.865   6.288  -6.625
  362   1HA   GLY  50          1HA       GLY  50  -2.284   4.279  -7.657
  363   2HA   GLY  50          2HA       GLY  50  -1.587   5.197  -8.982
  364    H    LYS  51           H        LYS  51  -0.390   6.542  -6.177
  365    HA   LYS  51           HA       LYS  51   2.168   5.279  -6.576
  366   1HB   LYS  51          1HB       LYS  51   1.195   7.485  -4.786
  367   2HB   LYS  51          2HB       LYS  51   2.753   6.739  -4.485
  368   1HG   LYS  51          1HG       LYS  51   3.314   8.533  -5.775
  369   2HG   LYS  51          2HG       LYS  51   3.185   7.258  -6.980
  370   1HD   LYS  51          1HD       LYS  51   2.044   9.015  -7.974
  371   2HD   LYS  51          2HD       LYS  51   0.745   8.078  -7.238
  372   1HE   LYS  51          1HE       LYS  51   0.628   9.598  -5.372
  373   2HE   LYS  51          2HE       LYS  51   2.059  10.463  -5.935
  374   1HZ   LYS  51          1HZ       LYS  51   0.283  10.522  -8.049
  375   2HZ   LYS  51          2HZ       LYS  51   0.674  11.808  -7.010
  376   3HZ   LYS  51          3HZ       LYS  51  -0.671  10.831  -6.671
  377    H    TYR  52           H        TYR  52   2.534   3.322  -5.798
  378    HA   TYR  52           HA       TYR  52   1.796   2.724  -3.034
  379   1HB   TYR  52          1HB       TYR  52   0.783   0.639  -3.599
  380   2HB   TYR  52          2HB       TYR  52   0.031   1.839  -4.645
  381    HD1  TYR  52           HD1      TYR  52   1.348   2.136  -6.992
  382    HD2  TYR  52           HD2      TYR  52   1.427  -1.345  -4.546
  383    HE1  TYR  52           HE1      TYR  52   2.040   0.797  -8.932
  384    HE2  TYR  52           HE2      TYR  52   2.109  -2.694  -6.479
  385    HH   TYR  52           HH       TYR  52   2.059  -1.461  -9.701
  386    H    GLY  53           H        GLY  53   2.634   0.420  -2.557
  387   1HA   GLY  53          1HA       GLY  53   4.864  -0.566  -3.957
  388   2HA   GLY  53          2HA       GLY  53   5.391   0.390  -2.588
  389    H    PHE  54           H        PHE  54   5.994  -2.274  -2.670
  390    HA   PHE  54           HA       PHE  54   3.991  -3.616  -1.059
  391   1HB   PHE  54          1HB       PHE  54   6.587  -4.631  -2.185
  392   2HB   PHE  54          2HB       PHE  54   5.447  -5.605  -1.271
  393    HD1  PHE  54           HD1      PHE  54   2.889  -5.095  -2.257
  394    HD2  PHE  54           HD2      PHE  54   6.548  -5.119  -4.429
  395    HE1  PHE  54           HE1      PHE  54   1.655  -5.584  -4.325
  396    HE2  PHE  54           HE2      PHE  54   5.321  -5.605  -6.500
  397    HZ   PHE  54           HZ       PHE  54   2.865  -5.840  -6.449
  398    H    CYS  55           H        CYS  55   4.176  -4.139   1.020
  399    HA   CYS  55           HA       CYS  55   5.984  -2.641   2.635
  400   1HB   CYS  55          1HB       CYS  55   4.212  -4.939   3.505
  401   2HB   CYS  55          2HB       CYS  55   4.831  -3.630   4.504
  402    HA   PRO  56           HA       PRO  56   9.286  -5.652   2.533
  403   1HB   PRO  56          1HB       PRO  56  10.884  -4.532   4.387
  404   2HB   PRO  56          2HB       PRO  56  10.703  -3.866   2.763
  405   1HG   PRO  56          1HG       PRO  56   9.431  -2.988   5.323
  406   2HG   PRO  56          2HG       PRO  56  10.098  -2.002   4.009
  407   1HD   PRO  56          1HD       PRO  56   7.428  -2.474   4.331
  408   2HD   PRO  56          2HD       PRO  56   8.186  -2.154   2.758
  409    H    HIS  57           H        HIS  57   6.926  -5.639   4.649
  410    HA   HIS  57           HA       HIS  57   8.243  -7.540   6.465
  411   1HB   HIS  57          1HB       HIS  57   7.450  -5.356   7.514
  412   2HB   HIS  57          2HB       HIS  57   5.806  -5.879   7.160
  413    HD1  HIS  57           HD1      HIS  57   5.308  -8.431   8.256
  414    HD2  HIS  57           HD2      HIS  57   8.239  -6.039   9.981
  415    HE1  HIS  57           HE1      HIS  57   5.653  -9.352  10.576
  416    H    GLU  58           H        GLU  58   7.572  -8.762   4.340
  417    HA   GLU  58           HA       GLU  58   4.838  -9.399   4.003
  418   1HB   GLU  58          1HB       GLU  58   5.645 -11.255   2.577
  419   2HB   GLU  58          2HB       GLU  58   6.366  -9.710   2.159
  420   1HG   GLU  58          1HG       GLU  58   7.802 -11.611   3.965
  421   2HG   GLU  58          2HG       GLU  58   7.823 -11.842   2.222
  422    H    ALA  59           H        ALA  59   3.605 -10.482   5.339
  423    HA   ALA  59           HA       ALA  59   4.604 -12.890   6.633
  424   1HB   ALA  59          1HB       ALA  59   3.028 -11.399   8.527
  425   2HB   ALA  59          2HB       ALA  59   4.454 -10.482   8.037
  426   3HB   ALA  59          3HB       ALA  59   4.634 -12.102   8.715
  Start of MODEL   16
    1   1H    ARG   1          1H        ARG   1   2.705   4.692  11.226
    2   2H    ARG   1          2H        ARG   1   4.195   4.038  11.767
    3   3H    ARG   1          3H        ARG   1   2.904   2.992  11.333
    4    HA   ARG   1           HA       ARG   1   3.031   3.738   9.083
    5   1HB   ARG   1          1HB       ARG   1   4.056   5.981   9.988
    6   2HB   ARG   1          2HB       ARG   1   5.590   5.139   9.815
    7   1HG   ARG   1          1HG       ARG   1   5.230   4.859   7.449
    8   2HG   ARG   1          2HG       ARG   1   3.610   5.555   7.577
    9   1HD   ARG   1          1HD       ARG   1   4.722   7.645   8.463
   10   2HD   ARG   1          2HD       ARG   1   6.262   6.928   7.996
   11    HE   ARG   1           HE       ARG   1   4.348   7.029   5.847
   12   1HH1  ARG   1          1HH1      ARG   1   6.805   8.802   7.591
   13   2HH1  ARG   1          2HH1      ARG   1   7.097   9.926   6.299
   14   1HH2  ARG   1          1HH2      ARG   1   4.709   8.513   4.147
   15   2HH2  ARG   1          2HH2      ARG   1   5.908   9.756   4.342
   16    H    ILE   2           H        ILE   2   4.298   2.433   7.672
   17    HA   ILE   2           HA       ILE   2   6.505   0.971   8.918
   18    HB   ILE   2           HB       ILE   2   4.264  -0.316   9.037
   19   1HG1  ILE   2          1HG1      ILE   2   5.371  -2.486   8.380
   20   2HG1  ILE   2          2HG1      ILE   2   6.746  -1.526   7.836
   21   1HG2  ILE   2          1HG2      ILE   2   4.580  -0.064   6.152
   22   2HG2  ILE   2          2HG2      ILE   2   3.149  -0.440   7.114
   23   3HG2  ILE   2          3HG2      ILE   2   4.293  -1.717   6.701
   24   1HD1  ILE   2          1HD1      ILE   2   5.921  -0.797  10.512
   25   2HD1  ILE   2          2HD1      ILE   2   7.502  -1.302   9.913
   26   3HD1  ILE   2          3HD1      ILE   2   6.311  -2.512  10.379
   27    HA   PRO   3           HA       PRO   3   8.824   1.895   5.291
   28   1HB   PRO   3          1HB       PRO   3  10.104  -0.588   5.033
   29   2HB   PRO   3          2HB       PRO   3  10.686   0.819   5.926
   30   1HG   PRO   3          1HG       PRO   3   9.248  -1.596   6.901
   31   2HG   PRO   3          2HG       PRO   3  10.518  -0.642   7.689
   32   1HD   PRO   3          1HD       PRO   3   7.959  -0.429   8.457
   33   2HD   PRO   3          2HD       PRO   3   9.014   1.000   8.387
   34    H    VAL   4           H        VAL   4   9.181   1.366   3.096
   35    HA   VAL   4           HA       VAL   4   7.221  -0.521   1.923
   36    HB   VAL   4           HB       VAL   4   8.130   2.184   0.830
   37   1HG1  VAL   4          1HG1      VAL   4   6.866   1.791  -1.096
   38   2HG1  VAL   4          2HG1      VAL   4   6.054   0.390  -0.388
   39   3HG1  VAL   4          3HG1      VAL   4   7.758   0.293  -0.842
   40   1HG2  VAL   4          1HG2      VAL   4   5.303   1.884   1.001
   41   2HG2  VAL   4          2HG2      VAL   4   6.344   3.045   1.821
   42   3HG2  VAL   4          3HG2      VAL   4   6.002   1.484   2.568
   43    H    LYS   5           H        LYS   5   7.963  -1.797   0.209
   44    HA   LYS   5           HA       LYS   5  10.871  -1.666  -0.213
   45   1HB   LYS   5          1HB       LYS   5   9.048  -3.867   0.327
   46   2HB   LYS   5          2HB       LYS   5  10.009  -4.162  -1.116
   47   1HG   LYS   5          1HG       LYS   5  11.109  -3.488   1.618
   48   2HG   LYS   5          2HG       LYS   5  11.062  -5.093   0.882
   49   1HD   LYS   5          1HD       LYS   5  12.539  -4.354  -0.897
   50   2HD   LYS   5          2HD       LYS   5  12.535  -2.713  -0.258
   51   1HE   LYS   5          1HE       LYS   5  13.634  -5.156   1.135
   52   2HE   LYS   5          2HE       LYS   5  14.580  -3.890   0.354
   53   1HZ   LYS   5          1HZ       LYS   5  14.593  -2.868   2.298
   54   2HZ   LYS   5          2HZ       LYS   5  13.492  -3.977   2.967
   55   3HZ   LYS   5          3HZ       LYS   5  12.922  -2.596   2.150
   56    H    TYR   6           H        TYR   6   8.866  -3.657  -2.229
   57    HA   TYR   6           HA       TYR   6   9.862  -2.309  -4.572
   58   1HB   TYR   6          1HB       TYR   6   7.837  -4.548  -4.584
   59   2HB   TYR   6          2HB       TYR   6   9.017  -4.126  -5.825
   60    HD1  TYR   6           HD1      TYR   6   8.628  -5.663  -2.475
   61    HD2  TYR   6           HD2      TYR   6  11.271  -4.989  -5.749
   62    HE1  TYR   6           HE1      TYR   6  10.205  -7.274  -1.528
   63    HE2  TYR   6           HE2      TYR   6  12.846  -6.604  -4.809
   64    HH   TYR   6           HH       TYR   6  12.057  -8.767  -2.356
   65    H    GLY   7           H        GLY   7   8.369  -1.903  -6.423
   66   1HA   GLY   7          1HA       GLY   7   6.011  -1.446  -7.007
   67   2HA   GLY   7          2HA       GLY   7   5.895  -0.548  -5.510
   68    H    ASN   8           H        ASN   8   5.296   1.323  -6.628
   69    HA   ASN   8           HA       ASN   8   7.487   2.608  -8.140
   70   1HB   ASN   8          1HB       ASN   8   5.918   3.584  -9.633
   71   2HB   ASN   8          2HB       ASN   8   5.456   1.890  -9.493
   72   1HD2  ASN   8          1HD2      ASN   8   3.939   4.402 -10.154
   73   2HD2  ASN   8          2HD2      ASN   8   2.631   4.412  -9.016
   74    H    ALA   9           H        ALA   9   6.300   2.707  -5.254
   75    HA   ALA   9           HA       ALA   9   5.191   5.213  -4.718
   76   1HB   ALA   9          1HB       ALA   9   7.005   4.094  -2.716
   77   2HB   ALA   9          2HB       ALA   9   5.705   3.045  -3.285
   78   3HB   ALA   9          3HB       ALA   9   5.329   4.621  -2.584
   79    H    ASP  10           H        ASP  10   6.086   7.085  -3.729
   80    HA   ASP  10           HA       ASP  10   8.281   8.182  -5.111
   81   1HB   ASP  10          1HB       ASP  10   6.805   9.127  -2.651
   82   2HB   ASP  10          2HB       ASP  10   8.057  10.071  -3.455
   83    H    GLY  11           H        GLY  11   8.092   6.525  -2.062
   84   1HA   GLY  11          1HA       GLY  11  10.393   5.562  -1.505
   85   2HA   GLY  11          2HA       GLY  11  10.891   7.249  -1.492
   86    H    GLU  12           H        GLU  12   7.898   7.470  -0.416
   87    HA   GLU  12           HA       GLU  12   8.683   7.731   2.335
   88   1HB   GLU  12          1HB       GLU  12   5.983   7.966   0.979
   89   2HB   GLU  12          2HB       GLU  12   6.302   8.374   2.660
   90   1HG   GLU  12          1HG       GLU  12   7.787   9.679   0.406
   91   2HG   GLU  12          2HG       GLU  12   6.222  10.274   0.963
   92    H    TYR  13           H        TYR  13   7.007   6.780   4.003
   93    HA   TYR  13           HA       TYR  13   7.013   3.915   3.558
   94   1HB   TYR  13          1HB       TYR  13   6.172   5.402   6.041
   95   2HB   TYR  13          2HB       TYR  13   6.469   3.668   5.894
   96    HD1  TYR  13           HD1      TYR  13   8.963   3.447   4.524
   97    HD2  TYR  13           HD2      TYR  13   7.785   6.323   7.427
   98    HE1  TYR  13           HE1      TYR  13  11.309   3.738   5.182
   99    HE2  TYR  13           HE2      TYR  13  10.127   6.629   8.087
  100    HH   TYR  13           HH       TYR  13  12.475   6.234   6.740
  101    H    CYS  14           H        CYS  14   4.975   2.901   4.832
  102    HA   CYS  14           HA       CYS  14   2.831   3.268   3.037
  103   1HB   CYS  14          1HB       CYS  14   2.931   1.848   5.700
  104   2HB   CYS  14          2HB       CYS  14   1.593   1.740   4.560
  105    H    LYS  15           H        LYS  15   1.114   4.561   3.077
  106    HA   LYS  15           HA       LYS  15   0.923   6.492   5.235
  107   1HB   LYS  15          1HB       LYS  15   0.499   6.711   2.531
  108   2HB   LYS  15          2HB       LYS  15  -1.146   6.577   3.145
  109   1HG   LYS  15          1HG       LYS  15  -0.630   8.428   4.733
  110   2HG   LYS  15          2HG       LYS  15   0.922   8.625   3.912
  111   1HD   LYS  15          1HD       LYS  15  -0.542   8.805   1.766
  112   2HD   LYS  15          2HD       LYS  15  -1.846   9.161   2.902
  113   1HE   LYS  15          1HE       LYS  15  -0.851  11.234   2.146
  114   2HE   LYS  15          2HE       LYS  15  -0.481  10.984   3.854
  115   1HZ   LYS  15          1HZ       LYS  15   1.311  11.405   1.752
  116   2HZ   LYS  15          2HZ       LYS  15   1.550   9.820   2.309
  117   3HZ   LYS  15          3HZ       LYS  15   1.669  11.114   3.389
  118    H    PHE  16           H        PHE  16  -0.193   5.999   6.971
  119    HA   PHE  16           HA       PHE  16  -2.582   4.306   6.665
  120   1HB   PHE  16          1HB       PHE  16  -0.632   4.531   8.968
  121   2HB   PHE  16          2HB       PHE  16  -2.163   3.662   9.068
  122    HD1  PHE  16           HD1      PHE  16   0.471   2.414   9.594
  123    HD2  PHE  16           HD2      PHE  16  -1.737   2.804   5.981
  124    HE1  PHE  16           HE1      PHE  16   1.587   0.418   8.703
  125    HE2  PHE  16           HE2      PHE  16  -0.633   0.813   5.082
  126    HZ   PHE  16           HZ       PHE  16   1.054  -0.403   6.432
  127    HA   PRO  17           HA       PRO  17  -4.270   4.044   6.848
  128   1HB   PRO  17          1HB       PRO  17  -6.849   4.664   6.559
  129   2HB   PRO  17          2HB       PRO  17  -6.190   4.188   8.130
  130   1HG   PRO  17          1HG       PRO  17  -6.976   6.890   7.161
  131   2HG   PRO  17          2HG       PRO  17  -7.014   6.234   8.806
  132   1HD   PRO  17          1HD       PRO  17  -5.017   7.900   7.662
  133   2HD   PRO  17          2HD       PRO  17  -4.971   7.100   9.245
  134    H    PHE  18           H        PHE  18  -4.878   3.577   4.689
  135    HA   PHE  18           HA       PHE  18  -4.887   5.917   2.911
  136   1HB   PHE  18          1HB       PHE  18  -3.720   4.692   1.226
  137   2HB   PHE  18          2HB       PHE  18  -2.837   4.471   2.729
  138    HD1  PHE  18           HD1      PHE  18  -5.089   2.827   0.306
  139    HD2  PHE  18           HD2      PHE  18  -2.504   2.320   3.649
  140    HE1  PHE  18           HE1      PHE  18  -5.143   0.398  -0.038
  141    HE2  PHE  18           HE2      PHE  18  -2.555  -0.118   3.320
  142    HZ   PHE  18           HZ       PHE  18  -3.867  -1.101   1.474
  143    H    LEU  19           H        LEU  19  -6.287   5.867   1.107
  144    HA   LEU  19           HA       LEU  19  -8.694   4.324   1.616
  145   1HB   LEU  19          1HB       LEU  19  -8.678   6.809   1.234
  146   2HB   LEU  19          2HB       LEU  19  -8.243   6.483  -0.432
  147    HG   LEU  19           HG       LEU  19 -10.389   5.109  -0.564
  148   1HD1  LEU  19          1HD1      LEU  19 -10.580   5.097   1.990
  149   2HD1  LEU  19          2HD1      LEU  19 -12.048   5.386   1.057
  150   3HD1  LEU  19          3HD1      LEU  19 -11.208   6.736   1.816
  151   1HD2  LEU  19          1HD2      LEU  19 -11.701   7.027  -1.089
  152   2HD2  LEU  19          2HD2      LEU  19 -10.029   7.392  -1.516
  153   3HD2  LEU  19          3HD2      LEU  19 -10.729   8.052  -0.037
  154    H    PHE  20           H        PHE  20  -9.226   2.575   0.572
  155    HA   PHE  20           HA       PHE  20  -8.246   2.129  -2.175
  156   1HB   PHE  20          1HB       PHE  20  -7.149   0.677  -0.314
  157   2HB   PHE  20          2HB       PHE  20  -8.738  -0.078  -0.206
  158    HD1  PHE  20           HD1      PHE  20  -7.647  -2.168  -0.688
  159    HD2  PHE  20           HD2      PHE  20  -7.726   1.001  -3.527
  160    HE1  PHE  20           HE1      PHE  20  -7.103  -3.776  -2.462
  161    HE2  PHE  20           HE2      PHE  20  -7.181  -0.611  -5.314
  162    HZ   PHE  20           HZ       PHE  20  -6.872  -2.991  -4.786
  163    H    ASN  21           H        ASN  21 -10.087   2.409  -3.343
  164    HA   ASN  21           HA       ASN  21 -12.215   2.180  -4.110
  165   1HB   ASN  21          1HB       ASN  21 -11.860  -0.422  -2.653
  166   2HB   ASN  21          2HB       ASN  21 -13.377  -0.029  -3.454
  167   1HD2  ASN  21          1HD2      ASN  21 -13.544  -0.840  -5.386
  168   2HD2  ASN  21          2HD2      ASN  21 -12.253  -1.139  -6.494
  169    H    GLY  22           H        GLY  22 -11.715   3.368  -1.347
  170   1HA   GLY  22          1HA       GLY  22 -13.400   4.688  -0.281
  171   2HA   GLY  22          2HA       GLY  22 -14.556   3.406  -0.584
  172    H    LYS  23           H        LYS  23 -11.813   1.905   0.436
  173    HA   LYS  23           HA       LYS  23 -12.720   1.961   3.244
  174   1HB   LYS  23          1HB       LYS  23 -13.004  -0.226   2.056
  175   2HB   LYS  23          2HB       LYS  23 -11.265  -0.281   1.815
  176   1HG   LYS  23          1HG       LYS  23 -10.942  -0.298   4.251
  177   2HG   LYS  23          2HG       LYS  23 -12.691  -0.288   4.471
  178   1HD   LYS  23          1HD       LYS  23 -12.875  -2.419   3.331
  179   2HD   LYS  23          2HD       LYS  23 -11.139  -2.420   3.011
  180   1HE   LYS  23          1HE       LYS  23 -10.751  -2.402   5.468
  181   2HE   LYS  23          2HE       LYS  23 -12.491  -2.553   5.710
  182   1HZ   LYS  23          1HZ       LYS  23 -10.666  -4.596   5.369
  183   2HZ   LYS  23          2HZ       LYS  23 -11.535  -4.547   3.912
  184   3HZ   LYS  23          3HZ       LYS  23 -12.362  -4.734   5.392
  185    H    GLU  24           H        GLU  24 -11.274   2.527   4.789
  186    HA   GLU  24           HA       GLU  24  -8.574   3.227   3.898
  187   1HB   GLU  24          1HB       GLU  24  -9.971   3.899   6.494
  188   2HB   GLU  24          2HB       GLU  24  -8.425   4.539   5.951
  189   1HG   GLU  24          1HG       GLU  24  -9.591   5.512   3.995
  190   2HG   GLU  24          2HG       GLU  24 -11.113   4.981   4.701
  191    H    TYR  25           H        TYR  25  -6.853   2.081   4.420
  192    HA   TYR  25           HA       TYR  25  -7.156  -0.109   6.358
  193   1HB   TYR  25          1HB       TYR  25  -5.242   0.272   4.074
  194   2HB   TYR  25          2HB       TYR  25  -5.140  -1.063   5.208
  195    HD1  TYR  25           HD1      TYR  25  -7.212  -2.583   5.411
  196    HD2  TYR  25           HD2      TYR  25  -6.561   0.105   2.186
  197    HE1  TYR  25           HE1      TYR  25  -8.820  -3.852   4.030
  198    HE2  TYR  25           HE2      TYR  25  -8.163  -1.152   0.794
  199    HH   TYR  25           HH       TYR  25  -9.153  -4.174   1.403
  200    H    ASN  26           H        ASN  26  -5.869  -0.301   8.097
  201    HA   ASN  26           HA       ASN  26  -4.000   1.898   8.625
  202   1HB   ASN  26          1HB       ASN  26  -5.311  -0.122  10.447
  203   2HB   ASN  26          2HB       ASN  26  -4.017   0.938  10.986
  204   1HD2  ASN  26          1HD2      ASN  26  -6.125   2.270   8.657
  205   2HD2  ASN  26          2HD2      ASN  26  -7.057   3.250   9.736
  206    H    SER  27           H        SER  27  -3.766  -0.893   7.141
  207    HA   SER  27           HA       SER  27  -0.994  -1.267   7.806
  208   1HB   SER  27          1HB       SER  27  -1.468  -3.812   8.182
  209   2HB   SER  27          2HB       SER  27  -1.696  -2.697   9.532
  210    HG   SER  27           HG       SER  27  -3.576  -4.126   8.037
  211    H    CYS  28           H        CYS  28  -0.118  -3.211   6.435
  212    HA   CYS  28           HA       CYS  28  -0.874  -2.730   3.730
  213   1HB   CYS  28          1HB       CYS  28   0.931  -4.835   4.948
  214   2HB   CYS  28          2HB       CYS  28   0.665  -4.665   3.219
  215    H    THR  29           H        THR  29  -2.281  -3.771   2.447
  216    HA   THR  29           HA       THR  29  -3.552  -6.171   3.536
  217    HB   THR  29           HB       THR  29  -5.070  -4.224   3.506
  218    HG1  THR  29           HG1      THR  29  -6.131  -6.116   3.216
  219   1HG2  THR  29          1HG2      THR  29  -3.956  -3.236   1.367
  220   2HG2  THR  29          2HG2      THR  29  -5.678  -3.007   1.664
  221   3HG2  THR  29          3HG2      THR  29  -5.143  -4.239   0.524
  222    H    ASP  30           H        ASP  30  -4.427  -7.654   1.861
  223    HA   ASP  30           HA       ASP  30  -2.616  -7.722  -0.432
  224   1HB   ASP  30          1HB       ASP  30  -4.106 -10.139   0.006
  225   2HB   ASP  30          2HB       ASP  30  -2.392  -9.938  -0.200
  226    H    THR  31           H        THR  31  -5.432  -6.565   0.238
  227    HA   THR  31           HA       THR  31  -7.298  -7.730  -1.521
  228    HB   THR  31           HB       THR  31  -7.152  -4.849  -0.627
  229    HG1  THR  31           HG1      THR  31  -7.098  -5.986   1.241
  230   1HG2  THR  31          1HG2      THR  31  -9.001  -5.978  -2.279
  231   2HG2  THR  31          2HG2      THR  31  -9.251  -4.551  -1.274
  232   3HG2  THR  31          3HG2      THR  31  -9.755  -6.137  -0.691
  233    H    GLY  32           H        GLY  32  -7.849  -7.233  -3.644
  234   1HA   GLY  32          1HA       GLY  32  -7.693  -6.155  -5.707
  235   2HA   GLY  32          2HA       GLY  32  -6.396  -5.158  -5.062
  236    H    ARG  33           H        ARG  33  -5.218  -7.760  -4.010
  237    HA   ARG  33           HA       ARG  33  -3.736  -8.410  -6.453
  238   1HB   ARG  33          1HB       ARG  33  -3.095  -9.287  -3.634
  239   2HB   ARG  33          2HB       ARG  33  -2.017  -9.241  -5.020
  240   1HG   ARG  33          1HG       ARG  33  -3.185  -6.815  -3.668
  241   2HG   ARG  33          2HG       ARG  33  -1.575  -7.467  -3.363
  242   1HD   ARG  33          1HD       ARG  33  -2.569  -6.518  -6.050
  243   2HD   ARG  33          2HD       ARG  33  -1.601  -5.541  -4.944
  244    HE   ARG  33           HE       ARG  33  -0.415  -8.087  -5.631
  245   1HH1  ARG  33          1HH1      ARG  33  -0.735  -4.708  -6.469
  246   2HH1  ARG  33          2HH1      ARG  33   0.661  -4.699  -7.510
  247   1HH2  ARG  33          1HH2      ARG  33   1.428  -8.090  -6.987
  248   2HH2  ARG  33          2HH2      ARG  33   1.920  -6.614  -7.767
  249    H    SER  34           H        SER  34  -2.869 -10.906  -6.102
  250    HA   SER  34           HA       SER  34  -5.211 -12.561  -5.474
  251   1HB   SER  34          1HB       SER  34  -3.563 -12.862  -7.994
  252   2HB   SER  34          2HB       SER  34  -4.942 -13.856  -7.521
  253    HG   SER  34           HG       SER  34  -5.916 -11.503  -7.418
  254    H    ASP  35           H        ASP  35  -1.777 -12.152  -5.632
  255    HA   ASP  35           HA       ASP  35  -1.286 -14.865  -4.796
  256   1HB   ASP  35          1HB       ASP  35   0.481 -12.616  -5.554
  257   2HB   ASP  35          2HB       ASP  35   1.123 -14.069  -4.832
  258    H    GLY  36           H        GLY  36  -2.439 -12.452  -3.218
  259   1HA   GLY  36          1HA       GLY  36  -2.536 -11.874  -1.002
  260   2HA   GLY  36          2HA       GLY  36  -1.617 -13.333  -0.673
  261    H    PHE  37           H        PHE  37  -0.635 -10.505  -2.592
  262    HA   PHE  37           HA       PHE  37   1.717 -10.315  -0.879
  263   1HB   PHE  37          1HB       PHE  37   1.035  -9.074  -3.545
  264   2HB   PHE  37          2HB       PHE  37   2.449  -8.586  -2.613
  265    HD1  PHE  37           HD1      PHE  37   3.177  -9.394  -5.127
  266    HD2  PHE  37           HD2      PHE  37   2.109 -11.917  -1.867
  267    HE1  PHE  37           HE1      PHE  37   4.463 -11.240  -6.133
  268    HE2  PHE  37           HE2      PHE  37   3.393 -13.763  -2.861
  269    HZ   PHE  37           HZ       PHE  37   4.572 -13.428  -5.006
  270    H    LEU  38           H        LEU  38   1.916  -8.865   0.650
  271    HA   LEU  38           HA       LEU  38  -0.229  -7.048   1.190
  272   1HB   LEU  38          1HB       LEU  38   2.407  -7.363   2.574
  273   2HB   LEU  38          2HB       LEU  38   1.054  -6.443   3.179
  274    HG   LEU  38           HG       LEU  38  -0.221  -8.718   3.067
  275   1HD1  LEU  38          1HD1      LEU  38   2.394  -9.522   2.259
  276   2HD1  LEU  38          2HD1      LEU  38   0.945 -10.506   2.465
  277   3HD1  LEU  38          3HD1      LEU  38   2.031 -10.238   3.828
  278   1HD2  LEU  38          1HD2      LEU  38   1.271  -7.368   5.045
  279   2HD2  LEU  38          2HD2      LEU  38   1.553  -9.096   5.254
  280   3HD2  LEU  38          3HD2      LEU  38  -0.094  -8.470   5.260
  281    H    TRP  39           H        TRP  39  -0.407  -5.011   0.601
  282    HA   TRP  39           HA       TRP  39   2.028  -3.505  -0.043
  283   1HB   TRP  39          1HB       TRP  39   0.999  -2.575  -2.059
  284   2HB   TRP  39          2HB       TRP  39   1.072  -4.328  -2.171
  285    HD1  TRP  39           HD1      TRP  39  -1.322  -5.659  -1.911
  286    HE1  TRP  39           HE1      TRP  39  -3.719  -4.873  -2.396
  287    HE3  TRP  39           HE3      TRP  39  -0.522  -0.610  -2.048
  288    HZ2  TRP  39           HZ2      TRP  39  -5.084  -2.436  -2.786
  289    HZ3  TRP  39           HZ3      TRP  39  -2.435   0.870  -2.488
  290    HH2  TRP  39           HH2      TRP  39  -4.665  -0.031  -2.847
  291    H    CYS  40           H        CYS  40   1.416  -1.129  -0.406
  292    HA   CYS  40           HA       CYS  40  -0.863  -0.202   1.129
  293   1HB   CYS  40          1HB       CYS  40   0.535   1.165   2.634
  294   2HB   CYS  40          2HB       CYS  40   0.817  -0.558   2.872
  295    H    SER  41           H        SER  41  -1.081   2.187   0.930
  296    HA   SER  41           HA       SER  41  -0.008   3.052  -1.642
  297   1HB   SER  41          1HB       SER  41  -2.446   3.192  -1.274
  298   2HB   SER  41          2HB       SER  41  -2.168   4.308   0.061
  299    HG   SER  41           HG       SER  41  -2.159   5.819  -1.377
  300    H    THR  42           H        THR  42   0.677   5.298  -1.858
  301    HA   THR  42           HA       THR  42   2.313   6.118   0.439
  302    HB   THR  42           HB       THR  42   2.514   7.127  -2.411
  303    HG1  THR  42           HG1      THR  42   2.808   4.796  -2.197
  304   1HG2  THR  42          1HG2      THR  42   3.781   8.033  -0.159
  305   2HG2  THR  42          2HG2      THR  42   4.352   8.232  -1.816
  306   3HG2  THR  42          3HG2      THR  42   4.948   6.894  -0.833
  307    H    THR  43           H        THR  43  -0.195   7.096  -1.755
  308    HA   THR  43           HA       THR  43  -0.425   9.712  -0.455
  309    HB   THR  43           HB       THR  43  -1.897  10.283  -2.347
  310    HG1  THR  43           HG1      THR  43  -2.571   8.830  -3.737
  311   1HG2  THR  43          1HG2      THR  43   0.087  10.924  -3.163
  312   2HG2  THR  43          2HG2      THR  43  -0.126   9.545  -4.240
  313   3HG2  THR  43          3HG2      THR  43   0.862   9.384  -2.788
  314    H    TYR  44           H        TYR  44  -3.070  10.268  -0.584
  315    HA   TYR  44           HA       TYR  44  -4.149   8.450   1.372
  316   1HB   TYR  44          1HB       TYR  44  -4.465  11.038   1.233
  317   2HB   TYR  44          2HB       TYR  44  -5.755  10.651   0.096
  318    HD1  TYR  44           HD1      TYR  44  -6.712  12.094   2.255
  319    HD2  TYR  44           HD2      TYR  44  -5.758   7.942   2.231
  320    HE1  TYR  44           HE1      TYR  44  -8.240  11.729   4.150
  321    HE2  TYR  44           HE2      TYR  44  -7.278   7.576   4.124
  322    HH   TYR  44           HH       TYR  44  -9.155   8.573   5.204
  323    H    ASN  45           H        ASN  45  -5.391   9.611  -1.792
  324    HA   ASN  45           HA       ASN  45  -7.042   7.213  -1.926
  325   1HB   ASN  45          1HB       ASN  45  -7.928   9.524  -2.505
  326   2HB   ASN  45          2HB       ASN  45  -6.923   9.466  -3.937
  327   1HD2  ASN  45          1HD2      ASN  45  -7.570   6.464  -4.061
  328   2HD2  ASN  45          2HD2      ASN  45  -9.127   6.513  -4.739
  329    H    PHE  46           H        PHE  46  -5.930   5.470  -2.583
  330    HA   PHE  46           HA       PHE  46  -3.605   5.481  -4.137
  331   1HB   PHE  46          1HB       PHE  46  -4.115   3.594  -2.740
  332   2HB   PHE  46          2HB       PHE  46  -5.617   3.275  -3.639
  333    HD1  PHE  46           HD1      PHE  46  -1.982   3.800  -4.489
  334    HD2  PHE  46           HD2      PHE  46  -5.485   1.430  -5.014
  335    HE1  PHE  46           HE1      PHE  46  -0.759   2.310  -6.003
  336    HE2  PHE  46           HE2      PHE  46  -4.253  -0.058  -6.525
  337    HZ   PHE  46           HZ       PHE  46  -1.886   0.380  -7.025
  338    H    GLU  47           H        GLU  47  -6.956   4.865  -5.106
  339    HA   GLU  47           HA       GLU  47  -6.497   4.180  -7.772
  340   1HB   GLU  47          1HB       GLU  47  -8.657   4.099  -6.358
  341   2HB   GLU  47          2HB       GLU  47  -8.889   5.760  -6.870
  342   1HG   GLU  47          1HG       GLU  47  -8.857   5.051  -9.206
  343   2HG   GLU  47          2HG       GLU  47  -8.654   3.375  -8.687
  344    H    LYS  48           H        LYS  48  -6.868   7.320  -6.246
  345    HA   LYS  48           HA       LYS  48  -7.047   8.841  -8.612
  346   1HB   LYS  48          1HB       LYS  48  -7.831   9.925  -6.688
  347   2HB   LYS  48          2HB       LYS  48  -6.438   9.453  -5.734
  348   1HG   LYS  48          1HG       LYS  48  -5.068  11.078  -7.079
  349   2HG   LYS  48          2HG       LYS  48  -6.578  11.643  -7.805
  350   1HD   LYS  48          1HD       LYS  48  -7.420  12.190  -5.563
  351   2HD   LYS  48          2HD       LYS  48  -5.884  11.665  -4.869
  352   1HE   LYS  48          1HE       LYS  48  -6.367  13.980  -6.743
  353   2HE   LYS  48          2HE       LYS  48  -5.848  14.053  -5.060
  354   1HZ   LYS  48          1HZ       LYS  48  -3.950  12.500  -6.279
  355   2HZ   LYS  48          2HZ       LYS  48  -3.791  14.140  -5.874
  356   3HZ   LYS  48          3HZ       LYS  48  -4.287  13.697  -7.436
  357    H    ASP  49           H        ASP  49  -4.268   8.464  -6.364
  358    HA   ASP  49           HA       ASP  49  -2.526   9.691  -8.320
  359   1HB   ASP  49          1HB       ASP  49  -2.020   8.692  -5.515
  360   2HB   ASP  49          2HB       ASP  49  -0.797   9.460  -6.521
  361    H    GLY  50           H        GLY  50  -2.344   6.611  -6.505
  362   1HA   GLY  50          1HA       GLY  50  -2.044   4.541  -7.649
  363   2HA   GLY  50          2HA       GLY  50  -1.290   5.423  -8.957
  364    H    LYS  51           H        LYS  51  -0.045   6.505  -6.019
  365    HA   LYS  51           HA       LYS  51   2.413   5.057  -6.515
  366   1HB   LYS  51          1HB       LYS  51   1.673   7.320  -4.673
  367   2HB   LYS  51          2HB       LYS  51   3.193   6.464  -4.479
  368   1HG   LYS  51          1HG       LYS  51   3.675   8.375  -5.739
  369   2HG   LYS  51          2HG       LYS  51   3.671   7.037  -6.885
  370   1HD   LYS  51          1HD       LYS  51   1.339   7.666  -7.501
  371   2HD   LYS  51          2HD       LYS  51   1.490   9.074  -6.451
  372   1HE   LYS  51          1HE       LYS  51   3.396   9.851  -7.785
  373   2HE   LYS  51          2HE       LYS  51   3.216   8.455  -8.849
  374   1HZ   LYS  51          1HZ       LYS  51   1.096   9.250  -9.562
  375   2HZ   LYS  51          2HZ       LYS  51   2.195  10.533  -9.696
  376   3HZ   LYS  51          3HZ       LYS  51   1.097  10.493  -8.399
  377    H    TYR  52           H        TYR  52   2.772   3.126  -5.637
  378    HA   TYR  52           HA       TYR  52   1.853   2.617  -2.905
  379   1HB   TYR  52          1HB       TYR  52   0.785   0.573  -3.472
  380   2HB   TYR  52          2HB       TYR  52   0.182   1.754  -4.634
  381    HD1  TYR  52           HD1      TYR  52   2.300  -1.201  -4.169
  382    HD2  TYR  52           HD2      TYR  52   0.809   1.618  -6.984
  383    HE1  TYR  52           HE1      TYR  52   3.080  -2.635  -5.999
  384    HE2  TYR  52           HE2      TYR  52   1.575   0.184  -8.826
  385    HH   TYR  52           HH       TYR  52   2.094  -2.724  -8.811
  386    H    GLY  53           H        GLY  53   2.672   0.399  -2.220
  387   1HA   GLY  53          1HA       GLY  53   4.985  -0.655  -3.485
  388   2HA   GLY  53          2HA       GLY  53   5.404   0.305  -2.083
  389    H    PHE  54           H        PHE  54   5.997  -2.377  -2.099
  390    HA   PHE  54           HA       PHE  54   3.855  -3.741  -0.677
  391   1HB   PHE  54          1HB       PHE  54   6.554  -4.692  -1.600
  392   2HB   PHE  54          2HB       PHE  54   5.367  -5.704  -0.794
  393    HD1  PHE  54           HD1      PHE  54   6.393  -6.542  -3.345
  394    HD2  PHE  54           HD2      PHE  54   3.207  -3.857  -2.484
  395    HE1  PHE  54           HE1      PHE  54   5.374  -7.057  -5.518
  396    HE2  PHE  54           HE2      PHE  54   2.181  -4.367  -4.657
  397    HZ   PHE  54           HZ       PHE  54   3.267  -5.971  -6.182
  398    H    CYS  55           H        CYS  55   4.192  -4.782   1.327
  399    HA   CYS  55           HA       CYS  55   5.525  -3.154   3.256
  400   1HB   CYS  55          1HB       CYS  55   3.611  -5.320   3.260
  401   2HB   CYS  55          2HB       CYS  55   4.888  -5.653   4.424
  402    HA   PRO  56           HA       PRO  56   9.583  -4.835   3.555
  403   1HB   PRO  56          1HB       PRO  56   9.679  -5.625   6.210
  404   2HB   PRO  56          2HB       PRO  56  10.079  -4.027   5.597
  405   1HG   PRO  56          1HG       PRO  56   7.555  -4.993   6.863
  406   2HG   PRO  56          2HG       PRO  56   8.346  -3.413   6.991
  407   1HD   PRO  56          1HD       PRO  56   6.179  -3.758   5.466
  408   2HD   PRO  56          2HD       PRO  56   7.493  -2.681   4.949
  409    H    HIS  57           H        HIS  57   7.426  -6.841   5.558
  410    HA   HIS  57           HA       HIS  57   7.114  -9.076   5.728
  411   1HB   HIS  57          1HB       HIS  57   6.678  -8.640   3.202
  412   2HB   HIS  57          2HB       HIS  57   8.225  -9.437   2.959
  413    HD1  HIS  57           HD1      HIS  57   6.344 -11.023   1.620
  414    HD2  HIS  57           HD2      HIS  57   6.580 -11.274   5.771
  415    HE1  HIS  57           HE1      HIS  57   5.229 -13.195   2.238
  416    H    GLU  58           H        GLU  58   9.517 -10.105   3.501
  417    HA   GLU  58           HA       GLU  58  11.188 -10.947   5.748
  418   1HB   GLU  58          1HB       GLU  58  12.197 -12.245   3.542
  419   2HB   GLU  58          2HB       GLU  58  11.051 -12.917   4.690
  420   1HG   GLU  58          1HG       GLU  58  10.080 -13.364   2.642
  421   2HG   GLU  58          2HG       GLU  58   9.247 -11.904   3.165
  422    H    ALA  59           H        ALA  59  11.131  -8.357   3.879
  423    HA   ALA  59           HA       ALA  59  14.064  -8.188   3.778
  424   1HB   ALA  59          1HB       ALA  59  13.921  -6.867   1.744
  425   2HB   ALA  59          2HB       ALA  59  12.166  -7.034   1.744
  426   3HB   ALA  59          3HB       ALA  59  13.186  -8.453   1.510
  Start of MODEL   17
    1   1H    ARG   1          1H        ARG   1   4.717   1.842  11.678
    2   2H    ARG   1          2H        ARG   1   4.286   3.433  12.170
    3   3H    ARG   1          3H        ARG   1   5.881   2.847  12.437
    4    HA   ARG   1           HA       ARG   1   4.583   3.447   9.868
    5   1HB   ARG   1          1HB       ARG   1   5.328   5.456  10.813
    6   2HB   ARG   1          2HB       ARG   1   6.715   4.692  11.577
    7   1HG   ARG   1          1HG       ARG   1   7.731   4.383   9.341
    8   2HG   ARG   1          2HG       ARG   1   6.370   5.273   8.646
    9   1HD   ARG   1          1HD       ARG   1   7.039   7.280   9.579
   10   2HD   ARG   1          2HD       ARG   1   7.955   6.492  10.868
   11    HE   ARG   1           HE       ARG   1   9.219   5.811   8.499
   12   1HH1  ARG   1          1HH1      ARG   1   8.465   8.759  10.235
   13   2HH1  ARG   1          2HH1      ARG   1   9.894   9.593   9.692
   14   1HH2  ARG   1          1HH2      ARG   1  11.093   6.886   7.797
   15   2HH2  ARG   1          2HH2      ARG   1  11.408   8.507   8.328
   16    H    ILE   2           H        ILE   2   5.259   2.202   8.198
   17    HA   ILE   2           HA       ILE   2   7.903   0.987   8.421
   18    HB   ILE   2           HB       ILE   2   6.812  -0.741   6.688
   19   1HG1  ILE   2          1HG1      ILE   2   4.574   0.537   7.018
   20   2HG1  ILE   2          2HG1      ILE   2   4.558  -1.222   6.926
   21   1HG2  ILE   2          1HG2      ILE   2   6.322  -1.245   9.602
   22   2HG2  ILE   2          2HG2      ILE   2   7.922  -1.288   8.881
   23   3HG2  ILE   2          3HG2      ILE   2   6.679  -2.411   8.338
   24   1HD1  ILE   2          1HD1      ILE   2   3.345  -1.131   8.783
   25   2HD1  ILE   2          2HD1      ILE   2   3.781   0.549   9.087
   26   3HD1  ILE   2          3HD1      ILE   2   4.854  -0.749   9.615
   27    HA   PRO   3           HA       PRO   3   9.189   2.731   4.669
   28   1HB   PRO   3          1HB       PRO   3  10.851   0.739   3.862
   29   2HB   PRO   3          2HB       PRO   3  11.248   1.833   5.195
   30   1HG   PRO   3          1HG       PRO   3  10.019  -0.913   5.320
   31   2HG   PRO   3          2HG       PRO   3  11.393  -0.274   6.244
   32   1HD   PRO   3          1HD       PRO   3   8.987  -0.381   7.330
   33   2HD   PRO   3          2HD       PRO   3  10.020   1.045   7.591
   34    H    VAL   4           H        VAL   4   9.505   2.138   2.341
   35    HA   VAL   4           HA       VAL   4   7.435   0.223   1.449
   36    HB   VAL   4           HB       VAL   4   8.321   2.783   0.033
   37   1HG1  VAL   4          1HG1      VAL   4   7.780   1.259  -1.665
   38   2HG1  VAL   4          2HG1      VAL   4   6.312   2.207  -1.429
   39   3HG1  VAL   4          3HG1      VAL   4   6.428   0.580  -0.755
   40   1HG2  VAL   4          1HG2      VAL   4   5.767   3.248   0.375
   41   2HG2  VAL   4          2HG2      VAL   4   6.903   3.564   1.687
   42   3HG2  VAL   4          3HG2      VAL   4   5.928   2.096   1.700
   43    H    LYS   5           H        LYS   5   7.983  -1.160  -0.244
   44    HA   LYS   5           HA       LYS   5  10.869  -1.232  -0.767
   45   1HB   LYS   5          1HB       LYS   5   8.840  -3.304  -0.272
   46   2HB   LYS   5          2HB       LYS   5  10.028  -3.684  -1.510
   47   1HG   LYS   5          1HG       LYS   5  10.528  -3.051   1.388
   48   2HG   LYS   5          2HG       LYS   5  10.824  -4.575   0.530
   49   1HD   LYS   5          1HD       LYS   5  12.949  -3.776   0.512
   50   2HD   LYS   5          2HD       LYS   5  12.360  -2.984  -0.950
   51   1HE   LYS   5          1HE       LYS   5  11.744  -1.022   0.548
   52   2HE   LYS   5          2HE       LYS   5  12.701  -1.806   1.799
   53   1HZ   LYS   5          1HZ       LYS   5  14.121  -1.600  -0.687
   54   2HZ   LYS   5          2HZ       LYS   5  14.583  -1.117   0.874
   55   3HZ   LYS   5          3HZ       LYS   5  13.641  -0.081  -0.089
   56    H    TYR   6           H        TYR   6   8.670  -3.170  -2.599
   57    HA   TYR   6           HA       TYR   6   9.683  -1.961  -5.039
   58   1HB   TYR   6          1HB       TYR   6   7.910  -4.394  -4.767
   59   2HB   TYR   6          2HB       TYR   6   8.931  -3.956  -6.135
   60    HD1  TYR   6           HD1      TYR   6   8.966  -6.619  -4.642
   61    HD2  TYR   6           HD2      TYR   6  11.301  -3.084  -4.161
   62    HE1  TYR   6           HE1      TYR   6  10.787  -7.948  -3.687
   63    HE2  TYR   6           HE2      TYR   6  13.124  -4.418  -3.198
   64    HH   TYR   6           HH       TYR   6  12.721  -7.575  -2.138
   65    H    GLY   7           H        GLY   7   8.093  -1.820  -6.921
   66   1HA   GLY   7          1HA       GLY   7   5.676  -1.557  -7.436
   67   2HA   GLY   7          2HA       GLY   7   5.568  -0.584  -5.978
   68    H    ASN   8           H        ASN   8   4.862   1.257  -7.138
   69    HA   ASN   8           HA       ASN   8   6.881   2.327  -8.986
   70   1HB   ASN   8          1HB       ASN   8   5.209   3.645 -10.046
   71   2HB   ASN   8          2HB       ASN   8   4.575   2.011  -9.901
   72   1HD2  ASN   8          1HD2      ASN   8   3.197   4.545 -10.260
   73   2HD2  ASN   8          2HD2      ASN   8   2.099   4.689  -8.937
   74    H    ALA   9           H        ALA   9   6.313   2.553  -5.880
   75    HA   ALA   9           HA       ALA   9   6.482   5.437  -5.547
   76   1HB   ALA   9          1HB       ALA   9   6.771   3.549  -3.267
   77   2HB   ALA   9          2HB       ALA   9   5.186   3.697  -4.034
   78   3HB   ALA   9          3HB       ALA   9   5.963   5.118  -3.334
   79    H    ASP  10           H        ASP  10   8.080   5.334  -3.192
   80    HA   ASP  10           HA       ASP  10  10.693   4.400  -4.148
   81   1HB   ASP  10          1HB       ASP  10  10.117   6.992  -4.429
   82   2HB   ASP  10          2HB       ASP  10  10.544   7.028  -2.724
   83    H    GLY  11           H        GLY  11  11.894   5.753  -1.750
   84   1HA   GLY  11          1HA       GLY  11  11.177   3.672   0.141
   85   2HA   GLY  11          2HA       GLY  11  12.519   4.791   0.292
   86    H    GLU  12           H        GLU  12   8.958   5.079   0.036
   87    HA   GLU  12           HA       GLU  12   9.045   7.199   2.033
   88   1HB   GLU  12          1HB       GLU  12   6.937   6.214   0.143
   89   2HB   GLU  12          2HB       GLU  12   6.492   7.219   1.515
   90   1HG   GLU  12          1HG       GLU  12   6.759   8.727  -0.242
   91   2HG   GLU  12          2HG       GLU  12   8.249   8.858   0.682
   92    H    TYR  13           H        TYR  13   6.563   6.959   3.208
   93    HA   TYR  13           HA       TYR  13   6.841   4.522   4.798
   94   1HB   TYR  13          1HB       TYR  13   7.180   5.880   6.538
   95   2HB   TYR  13          2HB       TYR  13   7.093   7.253   5.452
   96    HD1  TYR  13           HD1      TYR  13   4.908   5.009   7.459
   97    HD2  TYR  13           HD2      TYR  13   5.504   8.836   5.726
   98    HE1  TYR  13           HE1      TYR  13   2.935   5.850   8.655
   99    HE2  TYR  13           HE2      TYR  13   3.531   9.693   6.900
  100    HH   TYR  13           HH       TYR  13   1.235   8.286   7.953
  101    H    CYS  14           H        CYS  14   5.023   3.299   5.072
  102    HA   CYS  14           HA       CYS  14   2.836   3.559   3.377
  103   1HB   CYS  14          1HB       CYS  14   3.222   2.024   5.932
  104   2HB   CYS  14          2HB       CYS  14   1.726   1.928   5.012
  105    H    LYS  15           H        LYS  15   1.264   4.985   3.351
  106    HA   LYS  15           HA       LYS  15   0.704   6.636   5.629
  107   1HB   LYS  15          1HB       LYS  15   0.683   7.518   3.301
  108   2HB   LYS  15          2HB       LYS  15  -0.742   6.532   2.973
  109   1HG   LYS  15          1HG       LYS  15  -1.879   7.754   4.861
  110   2HG   LYS  15          2HG       LYS  15  -0.496   8.850   4.878
  111   1HD   LYS  15          1HD       LYS  15  -0.922   9.369   2.505
  112   2HD   LYS  15          2HD       LYS  15  -2.346   8.329   2.556
  113   1HE   LYS  15          1HE       LYS  15  -3.055  10.609   2.831
  114   2HE   LYS  15          2HE       LYS  15  -3.272   9.759   4.360
  115   1HZ   LYS  15          1HZ       LYS  15  -0.744  11.176   3.940
  116   2HZ   LYS  15          2HZ       LYS  15  -1.640  10.952   5.368
  117   3HZ   LYS  15          3HZ       LYS  15  -2.133  12.112   4.225
  118    H    PHE  16           H        PHE  16  -0.610   6.104   7.197
  119    HA   PHE  16           HA       PHE  16  -2.922   4.380   6.610
  120   1HB   PHE  16          1HB       PHE  16  -1.280   4.470   9.152
  121   2HB   PHE  16          2HB       PHE  16  -2.732   3.508   8.917
  122    HD1  PHE  16           HD1      PHE  16   0.022   2.516   9.718
  123    HD2  PHE  16           HD2      PHE  16  -1.907   2.837   5.944
  124    HE1  PHE  16           HE1      PHE  16   1.388   0.664   8.868
  125    HE2  PHE  16           HE2      PHE  16  -0.549   0.991   5.080
  126    HZ   PHE  16           HZ       PHE  16   1.122  -0.121   6.538
  127    HA   PRO  17           HA       PRO  17  -4.681   3.991   6.954
  128   1HB   PRO  17          1HB       PRO  17  -7.266   4.611   6.629
  129   2HB   PRO  17          2HB       PRO  17  -6.625   4.129   8.207
  130   1HG   PRO  17          1HG       PRO  17  -7.412   6.830   7.239
  131   2HG   PRO  17          2HG       PRO  17  -7.432   6.177   8.886
  132   1HD   PRO  17          1HD       PRO  17  -5.462   7.853   7.714
  133   2HD   PRO  17          2HD       PRO  17  -5.393   7.068   9.304
  134    H    PHE  18           H        PHE  18  -5.146   3.470   4.801
  135    HA   PHE  18           HA       PHE  18  -5.191   5.785   2.985
  136   1HB   PHE  18          1HB       PHE  18  -3.953   4.552   1.352
  137   2HB   PHE  18          2HB       PHE  18  -3.102   4.407   2.879
  138    HD1  PHE  18           HD1      PHE  18  -5.286   2.597   0.495
  139    HD2  PHE  18           HD2      PHE  18  -2.651   2.302   3.824
  140    HE1  PHE  18           HE1      PHE  18  -5.198   0.160   0.205
  141    HE2  PHE  18           HE2      PHE  18  -2.560  -0.138   3.539
  142    HZ   PHE  18           HZ       PHE  18  -3.831  -1.230   1.731
  143    H    LEU  19           H        LEU  19  -6.615   5.797   1.280
  144    HA   LEU  19           HA       LEU  19  -8.975   4.193   1.725
  145   1HB   LEU  19          1HB       LEU  19  -9.029   6.648   1.288
  146   2HB   LEU  19          2HB       LEU  19  -8.502   6.325  -0.354
  147    HG   LEU  19           HG       LEU  19 -10.597   4.894  -0.592
  148   1HD1  LEU  19          1HD1      LEU  19 -12.392   5.971   1.065
  149   2HD1  LEU  19          2HD1      LEU  19 -10.980   5.990   2.125
  150   3HD1  LEU  19          3HD1      LEU  19 -11.533   4.472   1.419
  151   1HD2  LEU  19          1HD2      LEU  19 -12.052   7.053  -0.712
  152   2HD2  LEU  19          2HD2      LEU  19 -10.663   6.864  -1.780
  153   3HD2  LEU  19          3HD2      LEU  19 -10.530   7.867  -0.338
  154    H    PHE  20           H        PHE  20  -9.492   2.401   0.715
  155    HA   PHE  20           HA       PHE  20  -8.583   1.940  -2.048
  156   1HB   PHE  20          1HB       PHE  20  -7.266   0.578  -0.271
  157   2HB   PHE  20          2HB       PHE  20  -8.796  -0.251  -0.022
  158    HD1  PHE  20           HD1      PHE  20  -6.942   0.792  -3.103
  159    HD2  PHE  20           HD2      PHE  20  -8.847  -2.264  -0.848
  160    HE1  PHE  20           HE1      PHE  20  -6.491  -0.837  -4.900
  161    HE2  PHE  20           HE2      PHE  20  -8.408  -3.889  -2.630
  162    HZ   PHE  20           HZ       PHE  20  -7.235  -3.170  -4.672
  163    H    ASN  21           H        ASN  21 -10.494   2.126  -3.082
  164    HA   ASN  21           HA       ASN  21 -12.650   1.799  -3.699
  165   1HB   ASN  21          1HB       ASN  21 -12.101  -0.837  -2.353
  166   2HB   ASN  21          2HB       ASN  21 -13.584  -0.506  -3.240
  167   1HD2  ASN  21          1HD2      ASN  21 -10.742  -1.966  -3.486
  168   2HD2  ASN  21          2HD2      ASN  21 -10.442  -1.819  -5.182
  169    H    GLY  22           H        GLY  22 -12.263   3.198  -1.226
  170   1HA   GLY  22          1HA       GLY  22 -13.925   4.240   0.060
  171   2HA   GLY  22          2HA       GLY  22 -14.949   2.834  -0.150
  172    H    LYS  23           H        LYS  23 -12.078   1.554   0.727
  173    HA   LYS  23           HA       LYS  23 -12.817   1.675   3.578
  174   1HB   LYS  23          1HB       LYS  23 -13.002  -0.572   2.539
  175   2HB   LYS  23          2HB       LYS  23 -11.286  -0.510   2.153
  176   1HG   LYS  23          1HG       LYS  23 -10.779  -0.343   4.565
  177   2HG   LYS  23          2HG       LYS  23 -12.503  -0.513   4.913
  178   1HD   LYS  23          1HD       LYS  23 -12.511  -2.709   3.852
  179   2HD   LYS  23          2HD       LYS  23 -10.805  -2.534   3.446
  180   1HE   LYS  23          1HE       LYS  23 -10.338  -2.315   5.902
  181   2HE   LYS  23          2HE       LYS  23 -12.023  -2.747   6.193
  182   1HZ   LYS  23          1HZ       LYS  23 -11.498  -4.881   5.999
  183   2HZ   LYS  23          2HZ       LYS  23  -9.862  -4.472   5.784
  184   3HZ   LYS  23          3HZ       LYS  23 -10.882  -4.638   4.435
  185    H    GLU  24           H        GLU  24 -11.375   2.344   5.046
  186    HA   GLU  24           HA       GLU  24  -8.771   3.237   4.037
  187   1HB   GLU  24          1HB       GLU  24 -10.140   3.913   6.649
  188   2HB   GLU  24          2HB       GLU  24  -8.685   4.665   6.012
  189   1HG   GLU  24          1HG       GLU  24  -9.989   5.502   4.112
  190   2HG   GLU  24          2HG       GLU  24 -11.441   4.803   4.821
  191    H    TYR  25           H        TYR  25  -7.102   1.952   4.355
  192    HA   TYR  25           HA       TYR  25  -7.191  -0.072   6.457
  193   1HB   TYR  25          1HB       TYR  25  -5.316   0.347   4.156
  194   2HB   TYR  25          2HB       TYR  25  -5.143  -0.951   5.319
  195    HD1  TYR  25           HD1      TYR  25  -7.030  -2.658   5.496
  196    HD2  TYR  25           HD2      TYR  25  -6.711   0.152   2.322
  197    HE1  TYR  25           HE1      TYR  25  -8.556  -4.034   4.120
  198    HE2  TYR  25           HE2      TYR  25  -8.231  -1.213   0.940
  199    HH   TYR  25           HH       TYR  25  -9.627  -4.230   2.185
  200    H    ASN  26           H        ASN  26  -6.021  -0.029   8.242
  201    HA   ASN  26           HA       ASN  26  -4.040   2.122   8.577
  202   1HB   ASN  26          1HB       ASN  26  -5.665   0.522  10.556
  203   2HB   ASN  26          2HB       ASN  26  -4.224   1.406  11.055
  204   1HD2  ASN  26          1HD2      ASN  26  -7.505   1.591  10.709
  205   2HD2  ASN  26          2HD2      ASN  26  -7.684   3.311  10.706
  206    H    SER  27           H        SER  27  -3.998  -0.695   7.350
  207    HA   SER  27           HA       SER  27  -1.315  -1.327   8.175
  208   1HB   SER  27          1HB       SER  27  -1.930  -3.767   8.564
  209   2HB   SER  27          2HB       SER  27  -2.447  -2.649   9.835
  210    HG   SER  27           HG       SER  27  -4.531  -2.632   8.813
  211    H    CYS  28           H        CYS  28  -0.404  -3.038   6.730
  212    HA   CYS  28           HA       CYS  28  -1.235  -2.524   4.040
  213   1HB   CYS  28          1HB       CYS  28   0.802  -4.485   5.112
  214   2HB   CYS  28          2HB       CYS  28   0.607  -4.043   3.418
  215    H    THR  29           H        THR  29  -2.400  -3.789   2.668
  216    HA   THR  29           HA       THR  29  -3.382  -6.340   3.716
  217    HB   THR  29           HB       THR  29  -5.135  -4.634   3.820
  218    HG1  THR  29           HG1      THR  29  -6.141  -6.445   3.389
  219   1HG2  THR  29          1HG2      THR  29  -6.006  -4.060   1.340
  220   2HG2  THR  29          2HG2      THR  29  -4.261  -4.029   1.074
  221   3HG2  THR  29          3HG2      THR  29  -4.991  -2.989   2.298
  222    H    ASP  30           H        ASP  30  -4.215  -7.811   1.955
  223    HA   ASP  30           HA       ASP  30  -2.409  -7.651  -0.338
  224   1HB   ASP  30          1HB       ASP  30  -3.889 -10.115  -0.095
  225   2HB   ASP  30          2HB       ASP  30  -2.186  -9.875  -0.337
  226    H    THR  31           H        THR  31  -5.321  -6.673   0.403
  227    HA   THR  31           HA       THR  31  -7.092  -7.771  -1.476
  228    HB   THR  31           HB       THR  31  -7.108  -4.955  -0.392
  229    HG1  THR  31           HG1      THR  31  -7.081  -6.177   1.405
  230   1HG2  THR  31          1HG2      THR  31  -9.267  -6.706  -1.491
  231   2HG2  THR  31          2HG2      THR  31  -8.807  -5.075  -1.982
  232   3HG2  THR  31          3HG2      THR  31  -9.605  -5.338  -0.429
  233    H    GLY  32           H        GLY  32  -7.503  -7.335  -3.593
  234   1HA   GLY  32          1HA       GLY  32  -7.447  -6.065  -5.574
  235   2HA   GLY  32          2HA       GLY  32  -6.229  -5.037  -4.844
  236    H    ARG  33           H        ARG  33  -4.692  -7.326  -3.899
  237    HA   ARG  33           HA       ARG  33  -3.176  -7.822  -6.320
  238   1HB   ARG  33          1HB       ARG  33  -2.662  -8.702  -3.470
  239   2HB   ARG  33          2HB       ARG  33  -1.516  -8.792  -4.800
  240   1HG   ARG  33          1HG       ARG  33  -2.665  -6.253  -3.654
  241   2HG   ARG  33          2HG       ARG  33  -1.072  -6.904  -3.284
  242   1HD   ARG  33          1HD       ARG  33  -2.060  -5.960  -5.977
  243   2HD   ARG  33          2HD       ARG  33  -0.910  -5.127  -4.930
  244    HE   ARG  33           HE       ARG  33   0.044  -7.723  -5.539
  245   1HH1  ARG  33          1HH1      ARG  33  -0.352  -4.522  -6.903
  246   2HH1  ARG  33          2HH1      ARG  33   0.830  -4.773  -8.153
  247   1HH2  ARG  33          1HH2      ARG  33   1.646  -8.022  -7.128
  248   2HH2  ARG  33          2HH2      ARG  33   1.995  -6.745  -8.253
  249    H    SER  34           H        SER  34  -2.604  -9.965  -7.003
  250    HA   SER  34           HA       SER  34  -4.714 -11.911  -6.403
  251   1HB   SER  34          1HB       SER  34  -2.755 -11.788  -8.705
  252   2HB   SER  34          2HB       SER  34  -3.995 -13.023  -8.497
  253    HG   SER  34           HG       SER  34  -5.547 -11.586  -8.957
  254    H    ASP  35           H        ASP  35  -1.340 -11.323  -6.012
  255    HA   ASP  35           HA       ASP  35  -0.809 -14.094  -5.405
  256   1HB   ASP  35          1HB       ASP  35   0.958 -11.742  -5.749
  257   2HB   ASP  35          2HB       ASP  35   1.554 -13.288  -5.210
  258    H    GLY  36           H        GLY  36  -2.194 -11.852  -3.732
  259   1HA   GLY  36          1HA       GLY  36  -2.446 -11.390  -1.499
  260   2HA   GLY  36          2HA       GLY  36  -1.691 -12.949  -1.230
  261    H    PHE  37           H        PHE  37  -0.593  -9.721  -2.342
  262    HA   PHE  37           HA       PHE  37   1.656 -10.023  -0.471
  263   1HB   PHE  37          1HB       PHE  37   1.438  -8.773  -3.163
  264   2HB   PHE  37          2HB       PHE  37   2.524  -8.016  -2.002
  265    HD1  PHE  37           HD1      PHE  37   1.693 -11.487  -3.106
  266    HD2  PHE  37           HD2      PHE  37   4.722  -8.634  -2.197
  267    HE1  PHE  37           HE1      PHE  37   3.418 -13.150  -3.645
  268    HE2  PHE  37           HE2      PHE  37   6.453 -10.300  -2.738
  269    HZ   PHE  37           HZ       PHE  37   5.806 -12.559  -3.457
  270    H    LEU  38           H        LEU  38   2.146  -8.399   0.946
  271    HA   LEU  38           HA       LEU  38  -0.029  -6.679   1.687
  272   1HB   LEU  38          1HB       LEU  38   2.751  -6.946   2.787
  273   2HB   LEU  38          2HB       LEU  38   1.499  -5.965   3.508
  274    HG   LEU  38           HG       LEU  38   1.303  -8.961   3.171
  275   1HD1  LEU  38          1HD1      LEU  38   1.507  -8.559   5.824
  276   2HD1  LEU  38          2HD1      LEU  38   2.566  -7.279   5.234
  277   3HD1  LEU  38          3HD1      LEU  38   2.877  -8.957   4.788
  278   1HD2  LEU  38          1HD2      LEU  38  -0.865  -8.328   3.441
  279   2HD2  LEU  38          2HD2      LEU  38  -0.440  -6.828   4.262
  280   3HD2  LEU  38          3HD2      LEU  38  -0.378  -8.352   5.142
  281    H    TRP  39           H        TRP  39  -0.358  -4.688   0.881
  282    HA   TRP  39           HA       TRP  39   2.009  -3.113   0.159
  283   1HB   TRP  39          1HB       TRP  39   0.947  -2.276  -1.861
  284   2HB   TRP  39          2HB       TRP  39   1.042  -4.029  -1.918
  285    HD1  TRP  39           HD1      TRP  39  -1.295  -5.389  -1.569
  286    HE1  TRP  39           HE1      TRP  39  -3.717  -4.695  -2.062
  287    HE3  TRP  39           HE3      TRP  39  -0.656  -0.331  -1.876
  288    HZ2  TRP  39           HZ2      TRP  39  -5.163  -2.321  -2.512
  289    HZ3  TRP  39           HZ3      TRP  39  -2.615   1.080  -2.340
  290    HH2  TRP  39           HH2      TRP  39  -4.822   0.096  -2.648
  291    H    CYS  40           H        CYS  40   1.409  -0.787  -0.223
  292    HA   CYS  40           HA       CYS  40  -0.891   0.196   1.258
  293   1HB   CYS  40          1HB       CYS  40   0.432   1.552   2.790
  294   2HB   CYS  40          2HB       CYS  40   0.872  -0.140   2.998
  295    H    SER  41           H        SER  41  -1.155   2.562   0.835
  296    HA   SER  41           HA       SER  41   0.187   3.238  -1.677
  297   1HB   SER  41          1HB       SER  41  -1.587   4.979  -1.907
  298   2HB   SER  41          2HB       SER  41  -2.232   3.342  -1.790
  299    HG   SER  41           HG       SER  41  -2.427   5.468  -0.014
  300    H    THR  42           H        THR  42   1.052   5.378  -1.994
  301    HA   THR  42           HA       THR  42   2.329   6.399   0.407
  302    HB   THR  42           HB       THR  42   2.640   7.404  -2.427
  303    HG1  THR  42           HG1      THR  42   4.565   5.833  -2.169
  304   1HG2  THR  42          1HG2      THR  42   5.077   7.555  -1.506
  305   2HG2  THR  42          2HG2      THR  42   4.256   7.604   0.054
  306   3HG2  THR  42          3HG2      THR  42   3.898   8.824  -1.168
  307    H    THR  43           H        THR  43  -0.381   6.981  -1.484
  308    HA   THR  43           HA       THR  43  -0.679   9.730  -0.477
  309    HB   THR  43           HB       THR  43  -2.401   9.798  -2.420
  310    HG1  THR  43           HG1      THR  43  -2.481   8.079  -3.605
  311   1HG2  THR  43          1HG2      THR  43  -0.235  11.003  -2.448
  312   2HG2  THR  43          2HG2      THR  43  -0.779  10.462  -4.037
  313   3HG2  THR  43          3HG2      THR  43   0.494   9.581  -3.191
  314    H    TYR  44           H        TYR  44  -3.140  10.298  -0.334
  315    HA   TYR  44           HA       TYR  44  -4.305   8.409   1.506
  316   1HB   TYR  44          1HB       TYR  44  -4.412  11.038   1.534
  317   2HB   TYR  44          2HB       TYR  44  -5.762  10.812   0.426
  318    HD1  TYR  44           HD1      TYR  44  -6.474  12.221   2.730
  319    HD2  TYR  44           HD2      TYR  44  -5.985   8.008   2.375
  320    HE1  TYR  44           HE1      TYR  44  -7.979  11.887   4.648
  321    HE2  TYR  44           HE2      TYR  44  -7.484   7.668   4.288
  322    HH   TYR  44           HH       TYR  44  -9.151   8.739   5.551
  323    H    ASN  45           H        ASN  45  -4.784   9.471  -1.786
  324    HA   ASN  45           HA       ASN  45  -7.003   7.568  -2.080
  325   1HB   ASN  45          1HB       ASN  45  -7.216  10.051  -2.760
  326   2HB   ASN  45          2HB       ASN  45  -6.153   9.660  -4.087
  327   1HD2  ASN  45          1HD2      ASN  45  -7.575   6.934  -4.224
  328   2HD2  ASN  45          2HD2      ASN  45  -9.007   7.375  -5.024
  329    H    PHE  46           H        PHE  46  -6.649   5.739  -3.324
  330    HA   PHE  46           HA       PHE  46  -3.986   5.520  -4.563
  331   1HB   PHE  46          1HB       PHE  46  -4.325   3.847  -2.894
  332   2HB   PHE  46          2HB       PHE  46  -5.927   3.434  -3.543
  333    HD1  PHE  46           HD1      PHE  46  -6.123   1.837  -5.289
  334    HD2  PHE  46           HD2      PHE  46  -2.259   3.269  -4.204
  335    HE1  PHE  46           HE1      PHE  46  -5.099   0.102  -6.686
  336    HE2  PHE  46           HE2      PHE  46  -1.235   1.532  -5.605
  337    HZ   PHE  46           HZ       PHE  46  -2.641  -0.049  -6.844
  338    H    GLU  47           H        GLU  47  -7.353   5.503  -5.272
  339    HA   GLU  47           HA       GLU  47  -7.357   4.095  -7.681
  340   1HB   GLU  47          1HB       GLU  47  -9.319   4.909  -6.244
  341   2HB   GLU  47          2HB       GLU  47  -9.161   6.427  -7.113
  342   1HG   GLU  47          1HG       GLU  47  -9.559   5.287  -9.216
  343   2HG   GLU  47          2HG       GLU  47  -9.674   3.745  -8.369
  344    H    LYS  48           H        LYS  48  -7.241   7.669  -7.261
  345    HA   LYS  48           HA       LYS  48  -6.586   7.896 -10.065
  346   1HB   LYS  48          1HB       LYS  48  -6.685  10.339  -9.697
  347   2HB   LYS  48          2HB       LYS  48  -8.156   9.495  -9.249
  348   1HG   LYS  48          1HG       LYS  48  -7.618   9.685  -6.914
  349   2HG   LYS  48          2HG       LYS  48  -6.042  10.387  -7.297
  350   1HD   LYS  48          1HD       LYS  48  -7.118  12.327  -8.281
  351   2HD   LYS  48          2HD       LYS  48  -8.708  11.610  -8.017
  352   1HE   LYS  48          1HE       LYS  48  -8.363  11.683  -5.608
  353   2HE   LYS  48          2HE       LYS  48  -6.742  12.343  -5.846
  354   1HZ   LYS  48          1HZ       LYS  48  -8.469  14.011  -5.273
  355   2HZ   LYS  48          2HZ       LYS  48  -9.230  13.698  -6.758
  356   3HZ   LYS  48          3HZ       LYS  48  -7.655  14.344  -6.726
  357    H    ASP  49           H        ASP  49  -4.888   8.229  -7.003
  358    HA   ASP  49           HA       ASP  49  -2.606   9.501  -8.179
  359   1HB   ASP  49          1HB       ASP  49  -2.884   8.090  -5.513
  360   2HB   ASP  49          2HB       ASP  49  -1.506   9.071  -6.006
  361    H    GLY  50           H        GLY  50  -3.221   6.209  -6.948
  362   1HA   GLY  50          1HA       GLY  50  -2.463   4.191  -7.769
  363   2HA   GLY  50          2HA       GLY  50  -1.689   5.067  -9.071
  364    H    LYS  51           H        LYS  51  -0.714   6.366  -6.143
  365    HA   LYS  51           HA       LYS  51   1.910   5.237  -6.432
  366   1HB   LYS  51          1HB       LYS  51   0.699   7.224  -4.555
  367   2HB   LYS  51          2HB       LYS  51   2.364   6.675  -4.397
  368   1HG   LYS  51          1HG       LYS  51   2.965   7.601  -6.471
  369   2HG   LYS  51          2HG       LYS  51   1.276   7.815  -6.947
  370   1HD   LYS  51          1HD       LYS  51   0.969   9.501  -5.300
  371   2HD   LYS  51          2HD       LYS  51   2.579   9.210  -4.635
  372   1HE   LYS  51          1HE       LYS  51   1.983  10.233  -7.413
  373   2HE   LYS  51          2HE       LYS  51   2.491  11.228  -6.048
  374   1HZ   LYS  51          1HZ       LYS  51   4.060   9.457  -7.731
  375   2HZ   LYS  51          2HZ       LYS  51   4.415   9.373  -6.074
  376   3HZ   LYS  51          3HZ       LYS  51   4.520  10.863  -6.890
  377    H    TYR  52           H        TYR  52   2.351   3.247  -5.659
  378    HA   TYR  52           HA       TYR  52   1.525   2.602  -2.936
  379   1HB   TYR  52          1HB       TYR  52   0.588   0.486  -3.543
  380   2HB   TYR  52          2HB       TYR  52  -0.159   1.688  -4.590
  381    HD1  TYR  52           HD1      TYR  52   2.168  -1.146  -4.449
  382    HD2  TYR  52           HD2      TYR  52   0.325   1.730  -6.985
  383    HE1  TYR  52           HE1      TYR  52   2.897  -2.428  -6.413
  384    HE2  TYR  52           HE2      TYR  52   1.047   0.452  -8.955
  385    HH   TYR  52           HH       TYR  52   3.152  -1.325  -9.345
  386    H    GLY  53           H        GLY  53   2.535   0.478  -2.276
  387   1HA   GLY  53          1HA       GLY  53   4.868  -0.427  -3.643
  388   2HA   GLY  53          2HA       GLY  53   5.256   0.549  -2.240
  389    H    PHE  54           H        PHE  54   5.986  -2.120  -2.388
  390    HA   PHE  54           HA       PHE  54   3.992  -3.587  -0.899
  391   1HB   PHE  54          1HB       PHE  54   6.705  -4.399  -1.918
  392   2HB   PHE  54          2HB       PHE  54   5.619  -5.477  -1.053
  393    HD1  PHE  54           HD1      PHE  54   6.456  -6.432  -3.555
  394    HD2  PHE  54           HD2      PHE  54   3.392  -3.594  -2.743
  395    HE1  PHE  54           HE1      PHE  54   5.358  -7.007  -5.685
  396    HE2  PHE  54           HE2      PHE  54   2.286  -4.162  -4.859
  397    HZ   PHE  54           HZ       PHE  54   3.269  -5.873  -6.342
  398    H    CYS  55           H        CYS  55   4.179  -4.299   1.189
  399    HA   CYS  55           HA       CYS  55   6.006  -2.735   2.846
  400   1HB   CYS  55          1HB       CYS  55   3.780  -4.531   3.782
  401   2HB   CYS  55          2HB       CYS  55   4.538  -3.205   4.655
  402    HA   PRO  56           HA       PRO  56   8.387  -6.385   3.747
  403   1HB   PRO  56          1HB       PRO  56  10.074  -5.274   5.514
  404   2HB   PRO  56          2HB       PRO  56  10.190  -4.956   3.784
  405   1HG   PRO  56          1HG       PRO  56   9.180  -3.220   5.960
  406   2HG   PRO  56          2HG       PRO  56   9.934  -2.778   4.422
  407   1HD   PRO  56          1HD       PRO  56   7.178  -2.747   5.026
  408   2HD   PRO  56          2HD       PRO  56   7.913  -2.558   3.421
  409    H    HIS  57           H        HIS  57   9.317  -7.272   6.060
  410    HA   HIS  57           HA       HIS  57   6.926  -7.802   7.550
  411   1HB   HIS  57          1HB       HIS  57   8.712  -9.513   7.173
  412   2HB   HIS  57          2HB       HIS  57   9.757  -8.600   8.260
  413    HD1  HIS  57           HD1      HIS  57   6.164  -9.878   8.535
  414    HD2  HIS  57           HD2      HIS  57   9.733  -9.787  10.676
  415    HE1  HIS  57           HE1      HIS  57   5.682 -11.056  10.712
  416    H    GLU  58           H        GLU  58  10.062  -6.380   8.498
  417    HA   GLU  58           HA       GLU  58   8.618  -4.890  10.583
  418   1HB   GLU  58          1HB       GLU  58  10.691  -4.984  11.913
  419   2HB   GLU  58          2HB       GLU  58  10.024  -6.575  11.606
  420   1HG   GLU  58          1HG       GLU  58  11.689  -6.903   9.832
  421   2HG   GLU  58          2HG       GLU  58  12.360  -5.309  10.182
  422    H    ALA  59           H        ALA  59  10.510  -3.171  11.409
  423    HA   ALA  59           HA       ALA  59  11.077  -1.566   9.011
  424   1HB   ALA  59          1HB       ALA  59  10.996   0.386  10.624
  425   2HB   ALA  59          2HB       ALA  59  10.306  -0.734  11.796
  426   3HB   ALA  59          3HB       ALA  59   9.456  -0.410  10.286
  Start of MODEL   18
    1   1H    ARG   1          1H        ARG   1  15.368   4.698   4.834
    2   2H    ARG   1          2H        ARG   1  14.755   6.273   5.154
    3   3H    ARG   1          3H        ARG   1  14.646   5.609   3.570
    4    HA   ARG   1           HA       ARG   1  13.068   5.115   5.921
    5   1HB   ARG   1          1HB       ARG   1  12.657   5.288   2.984
    6   2HB   ARG   1          2HB       ARG   1  11.368   4.803   4.059
    7   1HG   ARG   1          1HG       ARG   1  11.566   6.950   5.245
    8   2HG   ARG   1          2HG       ARG   1  12.847   7.429   4.133
    9   1HD   ARG   1          1HD       ARG   1  11.399   7.687   2.353
   10   2HD   ARG   1          2HD       ARG   1  10.208   6.575   3.029
   11    HE   ARG   1           HE       ARG   1   9.218   8.345   4.089
   12   1HH1  ARG   1          1HH1      ARG   1  12.380   9.358   2.969
   13   2HH1  ARG   1          2HH1      ARG   1  12.213  10.972   3.572
   14   1HH2  ARG   1          1HH2      ARG   1   8.948  10.451   4.775
   15   2HH2  ARG   1          2HH2      ARG   1  10.222  11.616   4.576
   16    H    ILE   2           H        ILE   2  11.381   3.134   5.124
   17    HA   ILE   2           HA       ILE   2  12.772   0.856   4.145
   18    HB   ILE   2           HB       ILE   2  13.903   0.837   6.217
   19   1HG1  ILE   2          1HG1      ILE   2  11.696  -1.231   6.188
   20   2HG1  ILE   2          2HG1      ILE   2  13.290  -1.365   5.458
   21   1HG2  ILE   2          1HG2      ILE   2  12.126   2.234   7.405
   22   2HG2  ILE   2          2HG2      ILE   2  12.976   1.012   8.352
   23   3HG2  ILE   2          3HG2      ILE   2  11.339   0.697   7.775
   24   1HD1  ILE   2          1HD1      ILE   2  12.950  -2.615   7.596
   25   2HD1  ILE   2          2HD1      ILE   2  12.860  -1.054   8.404
   26   3HD1  ILE   2          3HD1      ILE   2  14.338  -1.522   7.564
   27    HA   PRO   3           HA       PRO   3   8.184  -0.318   5.824
   28   1HB   PRO   3          1HB       PRO   3   7.079   2.308   4.958
   29   2HB   PRO   3          2HB       PRO   3   6.517   1.218   6.230
   30   1HG   PRO   3          1HG       PRO   3   7.874   3.375   6.889
   31   2HG   PRO   3          2HG       PRO   3   8.242   1.832   7.689
   32   1HD   PRO   3          1HD       PRO   3   9.746   3.252   5.511
   33   2HD   PRO   3          2HD       PRO   3  10.371   2.356   6.912
   34    H    VAL   4           H        VAL   4   9.040   1.582   2.964
   35    HA   VAL   4           HA       VAL   4   7.310  -0.259   1.421
   36    HB   VAL   4           HB       VAL   4   7.995   2.618   0.659
   37   1HG1  VAL   4          1HG1      VAL   4   6.256   2.182  -1.115
   38   2HG1  VAL   4          2HG1      VAL   4   6.387   0.469  -0.714
   39   3HG1  VAL   4          3HG1      VAL   4   7.792   1.345  -1.328
   40   1HG2  VAL   4          1HG2      VAL   4   6.124   3.290   1.677
   41   2HG2  VAL   4          2HG2      VAL   4   6.022   1.697   2.425
   42   3HG2  VAL   4          3HG2      VAL   4   5.177   2.016   0.910
   43    H    LYS   5           H        LYS   5   8.200  -1.221  -0.406
   44    HA   LYS   5           HA       LYS   5  11.062  -0.659  -0.839
   45   1HB   LYS   5          1HB       LYS   5   9.786  -3.107   0.014
   46   2HB   LYS   5          2HB       LYS   5  10.680  -3.353  -1.479
   47   1HG   LYS   5          1HG       LYS   5  11.802  -2.226   1.086
   48   2HG   LYS   5          2HG       LYS   5  12.028  -3.874   0.472
   49   1HD   LYS   5          1HD       LYS   5  13.226  -3.043  -1.451
   50   2HD   LYS   5          2HD       LYS   5  12.911  -1.372  -0.972
   51   1HE   LYS   5          1HE       LYS   5  14.646  -3.403   0.431
   52   2HE   LYS   5          2HE       LYS   5  15.150  -1.890  -0.318
   53   1HZ   LYS   5          1HZ       LYS   5  13.620  -0.798   1.403
   54   2HZ   LYS   5          2HZ       LYS   5  15.106  -1.419   1.947
   55   3HZ   LYS   5          3HZ       LYS   5  13.676  -2.292   2.214
   56    H    TYR   6           H        TYR   6   8.906  -2.993  -2.395
   57    HA   TYR   6           HA       TYR   6   9.804  -2.028  -4.990
   58   1HB   TYR   6          1HB       TYR   6   8.094  -4.443  -4.335
   59   2HB   TYR   6          2HB       TYR   6   8.912  -4.107  -5.859
   60    HD1  TYR   6           HD1      TYR   6   9.261  -6.652  -4.216
   61    HD2  TYR   6           HD2      TYR   6  11.459  -3.003  -4.261
   62    HE1  TYR   6           HE1      TYR   6  11.253  -7.842  -3.421
   63    HE2  TYR   6           HE2      TYR   6  13.449  -4.185  -3.467
   64    HH   TYR   6           HH       TYR   6  14.298  -6.681  -3.605
   65    H    GLY   7           H        GLY   7   8.394  -1.545  -6.709
   66   1HA   GLY   7          1HA       GLY   7   6.016  -1.365  -7.427
   67   2HA   GLY   7          2HA       GLY   7   5.714  -0.594  -5.881
   68    H    ASN   8           H        ASN   8   4.959   1.290  -6.998
   69    HA   ASN   8           HA       ASN   8   7.132   2.766  -8.313
   70   1HB   ASN   8          1HB       ASN   8   5.528   4.016  -9.589
   71   2HB   ASN   8          2HB       ASN   8   5.191   2.302  -9.777
   72   1HD2  ASN   8          1HD2      ASN   8   3.445   4.531 -10.253
   73   2HD2  ASN   8          2HD2      ASN   8   2.079   4.308  -9.217
   74    H    ALA   9           H        ALA   9   5.820   2.602  -5.404
   75    HA   ALA   9           HA       ALA   9   5.572   5.448  -4.876
   76   1HB   ALA   9          1HB       ALA   9   5.550   3.293  -2.797
   77   2HB   ALA   9          2HB       ALA   9   4.128   3.628  -3.792
   78   3HB   ALA   9          3HB       ALA   9   4.787   4.886  -2.748
   79    H    ASP  10           H        ASP  10   7.934   3.137  -5.108
   80    HA   ASP  10           HA       ASP  10  10.149   3.057  -4.700
   81   1HB   ASP  10          1HB       ASP  10  10.043   5.520  -5.286
   82   2HB   ASP  10          2HB       ASP  10   9.955   5.846  -3.558
   83    H    GLY  11           H        GLY  11   9.356   5.176  -1.971
   84   1HA   GLY  11          1HA       GLY  11   9.007   3.117  -0.093
   85   2HA   GLY  11          2HA       GLY  11  10.692   3.591  -0.094
   86    H    GLU  12           H        GLU  12   8.064   5.876  -0.666
   87    HA   GLU  12           HA       GLU  12   9.011   7.505   1.506
   88   1HB   GLU  12          1HB       GLU  12   6.612   7.867  -0.293
   89   2HB   GLU  12          2HB       GLU  12   7.222   9.065   0.833
   90   1HG   GLU  12          1HG       GLU  12   8.660   8.003  -1.594
   91   2HG   GLU  12          2HG       GLU  12   7.900   9.589  -1.424
   92    H    TYR  13           H        TYR  13   8.175   5.136   2.640
   93    HA   TYR  13           HA       TYR  13   6.977   4.288   4.366
   94   1HB   TYR  13          1HB       TYR  13   6.677   7.205   4.686
   95   2HB   TYR  13          2HB       TYR  13   5.530   6.205   5.579
   96    HD1  TYR  13           HD1      TYR  13   9.207   6.233   4.857
   97    HD2  TYR  13           HD2      TYR  13   6.120   5.680   7.727
   98    HE1  TYR  13           HE1      TYR  13  10.903   5.841   6.592
   99    HE2  TYR  13           HE2      TYR  13   7.801   5.289   9.475
  100    HH   TYR  13           HH       TYR  13  10.116   5.709   9.947
  101    H    CYS  14           H        CYS  14   4.797   3.876   5.270
  102    HA   CYS  14           HA       CYS  14   2.855   3.727   3.117
  103   1HB   CYS  14          1HB       CYS  14   2.959   2.462   5.858
  104   2HB   CYS  14          2HB       CYS  14   1.593   2.283   4.764
  105    H    LYS  15           H        LYS  15   0.831   4.703   3.197
  106    HA   LYS  15           HA       LYS  15   0.611   6.826   5.198
  107   1HB   LYS  15          1HB       LYS  15   0.324   7.215   2.670
  108   2HB   LYS  15          2HB       LYS  15  -1.238   6.423   2.846
  109   1HG   LYS  15          1HG       LYS  15  -1.375   8.889   2.923
  110   2HG   LYS  15          2HG       LYS  15  -1.978   8.115   4.390
  111   1HD   LYS  15          1HD       LYS  15   0.253   8.515   5.440
  112   2HD   LYS  15          2HD       LYS  15   0.710   9.433   4.006
  113   1HE   LYS  15          1HE       LYS  15  -1.640  10.078   5.785
  114   2HE   LYS  15          2HE       LYS  15  -0.060  10.846   5.903
  115   1HZ   LYS  15          1HZ       LYS  15  -0.384  12.021   3.988
  116   2HZ   LYS  15          2HZ       LYS  15  -1.995  11.910   4.527
  117   3HZ   LYS  15          3HZ       LYS  15  -1.439  10.878   3.310
  118    H    PHE  16           H        PHE  16  -0.305   6.184   7.012
  119    HA   PHE  16           HA       PHE  16  -2.676   4.446   6.848
  120   1HB   PHE  16          1HB       PHE  16  -0.620   4.741   9.048
  121   2HB   PHE  16          2HB       PHE  16  -2.116   3.831   9.221
  122    HD1  PHE  16           HD1      PHE  16   0.508   2.623   9.697
  123    HD2  PHE  16           HD2      PHE  16  -1.734   2.983   6.101
  124    HE1  PHE  16           HE1      PHE  16   1.622   0.623   8.815
  125    HE2  PHE  16           HE2      PHE  16  -0.634   0.983   5.205
  126    HZ   PHE  16           HZ       PHE  16   1.061  -0.227   6.557
  127    HA   PRO  17           HA       PRO  17  -4.397   4.181   7.095
  128   1HB   PRO  17          1HB       PRO  17  -6.978   4.868   6.873
  129   2HB   PRO  17          2HB       PRO  17  -6.299   4.301   8.403
  130   1HG   PRO  17          1HG       PRO  17  -7.082   7.053   7.599
  131   2HG   PRO  17          2HG       PRO  17  -7.034   6.324   9.212
  132   1HD   PRO  17          1HD       PRO  17  -5.086   8.027   8.024
  133   2HD   PRO  17          2HD       PRO  17  -4.975   7.189   9.582
  134    H    PHE  18           H        PHE  18  -5.189   3.765   4.961
  135    HA   PHE  18           HA       PHE  18  -5.205   6.134   3.217
  136   1HB   PHE  18          1HB       PHE  18  -4.120   4.884   1.457
  137   2HB   PHE  18          2HB       PHE  18  -3.138   4.798   2.910
  138    HD1  PHE  18           HD1      PHE  18  -5.419   2.900   0.716
  139    HD2  PHE  18           HD2      PHE  18  -2.633   2.727   3.924
  140    HE1  PHE  18           HE1      PHE  18  -5.317   0.462   0.483
  141    HE2  PHE  18           HE2      PHE  18  -2.522   0.283   3.702
  142    HZ   PHE  18           HZ       PHE  18  -3.864  -0.871   1.974
  143    H    LEU  19           H        LEU  19  -6.406   5.773   1.143
  144    HA   LEU  19           HA       LEU  19  -8.860   4.275   1.743
  145   1HB   LEU  19          1HB       LEU  19  -8.993   6.737   1.411
  146   2HB   LEU  19          2HB       LEU  19  -8.438   6.508  -0.236
  147    HG   LEU  19           HG       LEU  19 -10.454   5.078  -0.636
  148   1HD1  LEU  19          1HD1      LEU  19 -12.322   5.738   1.090
  149   2HD1  LEU  19          2HD1      LEU  19 -10.947   5.869   2.187
  150   3HD1  LEU  19          3HD1      LEU  19 -11.278   4.344   1.361
  151   1HD2  LEU  19          1HD2      LEU  19 -11.990   6.972  -0.827
  152   2HD2  LEU  19          2HD2      LEU  19 -10.368   7.399  -1.371
  153   3HD2  LEU  19          3HD2      LEU  19 -10.937   7.933   0.212
  154    H    PHE  20           H        PHE  20  -9.389   2.552   0.606
  155    HA   PHE  20           HA       PHE  20  -8.303   2.202  -2.111
  156   1HB   PHE  20          1HB       PHE  20  -7.088   0.811  -0.308
  157   2HB   PHE  20          2HB       PHE  20  -8.617  -0.042  -0.150
  158    HD1  PHE  20           HD1      PHE  20  -6.974   1.122  -3.290
  159    HD2  PHE  20           HD2      PHE  20  -8.235  -2.119  -0.842
  160    HE1  PHE  20           HE1      PHE  20  -6.392  -0.481  -5.080
  161    HE2  PHE  20           HE2      PHE  20  -7.652  -3.715  -2.615
  162    HZ   PHE  20           HZ       PHE  20  -6.733  -2.886  -4.746
  163    H    ASN  21           H        ASN  21 -10.131   2.408  -3.286
  164    HA   ASN  21           HA       ASN  21 -12.232   2.077  -4.089
  165   1HB   ASN  21          1HB       ASN  21 -11.729  -0.600  -2.801
  166   2HB   ASN  21          2HB       ASN  21 -13.165  -0.261  -3.760
  167   1HD2  ASN  21          1HD2      ASN  21 -13.029  -0.894  -5.760
  168   2HD2  ASN  21          2HD2      ASN  21 -11.595  -0.997  -6.720
  169    H    GLY  22           H        GLY  22 -12.029   3.335  -1.461
  170   1HA   GLY  22          1HA       GLY  22 -13.791   4.288  -0.213
  171   2HA   GLY  22          2HA       GLY  22 -14.813   2.940  -0.676
  172    H    LYS  23           H        LYS  23 -11.859   1.771   0.396
  173    HA   LYS  23           HA       LYS  23 -12.946   1.406   3.112
  174   1HB   LYS  23          1HB       LYS  23 -12.939  -0.666   1.736
  175   2HB   LYS  23          2HB       LYS  23 -11.202  -0.509   1.539
  176   1HG   LYS  23          1HG       LYS  23 -10.871  -0.833   3.914
  177   2HG   LYS  23          2HG       LYS  23 -12.615  -0.890   4.178
  178   1HD   LYS  23          1HD       LYS  23 -12.766  -2.876   2.760
  179   2HD   LYS  23          2HD       LYS  23 -11.021  -2.818   2.499
  180   1HE   LYS  23          1HE       LYS  23 -10.631  -3.193   4.876
  181   2HE   LYS  23          2HE       LYS  23 -12.371  -3.171   5.182
  182   1HZ   LYS  23          1HZ       LYS  23 -12.673  -5.176   4.046
  183   2HZ   LYS  23          2HZ       LYS  23 -11.270  -5.435   4.969
  184   3HZ   LYS  23          3HZ       LYS  23 -11.145  -5.110   3.306
  185    H    GLU  24           H        GLU  24 -11.651   1.896   4.799
  186    HA   GLU  24           HA       GLU  24  -9.035   3.051   4.175
  187   1HB   GLU  24          1HB       GLU  24 -10.691   3.145   6.701
  188   2HB   GLU  24          2HB       GLU  24  -9.146   3.952   6.489
  189   1HG   GLU  24          1HG       GLU  24 -10.102   5.311   4.710
  190   2HG   GLU  24          2HG       GLU  24 -11.650   4.490   4.914
  191    H    TYR  25           H        TYR  25  -7.144   2.245   4.883
  192    HA   TYR  25           HA       TYR  25  -7.254  -0.206   6.512
  193   1HB   TYR  25          1HB       TYR  25  -5.360   0.489   4.284
  194   2HB   TYR  25          2HB       TYR  25  -5.162  -0.908   5.321
  195    HD1  TYR  25           HD1      TYR  25  -7.332   0.643   2.783
  196    HD2  TYR  25           HD2      TYR  25  -6.418  -2.888   4.965
  197    HE1  TYR  25           HE1      TYR  25  -8.804  -0.642   1.285
  198    HE2  TYR  25           HE2      TYR  25  -7.883  -4.195   3.465
  199    HH   TYR  25           HH       TYR  25  -9.324  -4.122   1.763
  200    H    ASN  26           H        ASN  26  -6.102  -0.269   8.313
  201    HA   ASN  26           HA       ASN  26  -4.433   2.054   8.953
  202   1HB   ASN  26          1HB       ASN  26  -5.582  -0.123  10.713
  203   2HB   ASN  26          2HB       ASN  26  -4.506   1.143  11.294
  204   1HD2  ASN  26          1HD2      ASN  26  -6.290   2.528   8.914
  205   2HD2  ASN  26          2HD2      ASN  26  -7.581   3.183   9.859
  206    H    SER  27           H        SER  27  -4.119  -0.923   7.681
  207    HA   SER  27           HA       SER  27  -1.280  -1.022   8.284
  208   1HB   SER  27          1HB       SER  27  -1.510  -3.569   8.587
  209   2HB   SER  27          2HB       SER  27  -1.984  -2.547   9.944
  210    HG   SER  27           HG       SER  27  -3.445  -4.375   9.026
  211    H    CYS  28           H        CYS  28  -0.509  -3.216   6.915
  212    HA   CYS  28           HA       CYS  28  -1.142  -2.452   4.207
  213   1HB   CYS  28          1HB       CYS  28   0.619  -4.673   5.256
  214   2HB   CYS  28          2HB       CYS  28   0.496  -4.188   3.571
  215    H    THR  29           H        THR  29  -1.984  -3.852   2.591
  216    HA   THR  29           HA       THR  29  -3.428  -6.180   3.578
  217    HB   THR  29           HB       THR  29  -4.968  -4.264   3.612
  218    HG1  THR  29           HG1      THR  29  -5.695  -6.406   2.994
  219   1HG2  THR  29          1HG2      THR  29  -3.756  -3.431   1.267
  220   2HG2  THR  29          2HG2      THR  29  -5.218  -2.761   1.997
  221   3HG2  THR  29          3HG2      THR  29  -5.342  -4.007   0.755
  222    H    ASP  30           H        ASP  30  -4.172  -7.611   1.830
  223    HA   ASP  30           HA       ASP  30  -2.372  -7.432  -0.469
  224   1HB   ASP  30          1HB       ASP  30  -3.678  -9.974  -0.157
  225   2HB   ASP  30          2HB       ASP  30  -1.994  -9.629  -0.397
  226    H    THR  31           H        THR  31  -5.238  -6.476   0.269
  227    HA   THR  31           HA       THR  31  -7.088  -7.667  -1.456
  228    HB   THR  31           HB       THR  31  -6.938  -4.773  -0.596
  229    HG1  THR  31           HG1      THR  31  -6.981  -5.887   1.268
  230   1HG2  THR  31          1HG2      THR  31  -9.496  -5.083  -0.600
  231   2HG2  THR  31          2HG2      THR  31  -9.167  -6.415  -1.712
  232   3HG2  THR  31          3HG2      THR  31  -8.659  -4.776  -2.124
  233    H    GLY  32           H        GLY  32  -7.518  -7.424  -3.599
  234   1HA   GLY  32          1HA       GLY  32  -7.425  -6.420  -5.715
  235   2HA   GLY  32          2HA       GLY  32  -6.210  -5.310  -5.099
  236    H    ARG  33           H        ARG  33  -4.504  -7.225  -3.943
  237    HA   ARG  33           HA       ARG  33  -3.057  -8.117  -6.285
  238   1HB   ARG  33          1HB       ARG  33  -2.404  -8.426  -3.343
  239   2HB   ARG  33          2HB       ARG  33  -1.303  -8.698  -4.678
  240   1HG   ARG  33          1HG       ARG  33  -2.551  -6.039  -4.006
  241   2HG   ARG  33          2HG       ARG  33  -0.943  -6.554  -3.490
  242   1HD   ARG  33          1HD       ARG  33  -1.878  -6.234  -6.344
  243   2HD   ARG  33          2HD       ARG  33  -0.851  -5.104  -5.461
  244    HE   ARG  33           HE       ARG  33   0.223  -7.769  -5.583
  245   1HH1  ARG  33          1HH1      ARG  33  -0.046  -4.691  -7.207
  246   2HH1  ARG  33          2HH1      ARG  33   1.349  -4.947  -8.209
  247   1HH2  ARG  33          1HH2      ARG  33   2.023  -8.153  -6.973
  248   2HH2  ARG  33          2HH2      ARG  33   2.524  -6.914  -8.081
  249    H    SER  34           H        SER  34  -3.566 -10.050  -7.172
  250    HA   SER  34           HA       SER  34  -4.831 -12.120  -5.607
  251   1HB   SER  34          1HB       SER  34  -3.827 -12.129  -8.467
  252   2HB   SER  34          2HB       SER  34  -4.781 -13.413  -7.719
  253    HG   SER  34           HG       SER  34  -5.972 -11.003  -7.371
  254    H    ASP  35           H        ASP  35  -1.721 -11.083  -5.931
  255    HA   ASP  35           HA       ASP  35  -0.443 -13.641  -5.905
  256   1HB   ASP  35          1HB       ASP  35   0.622 -10.881  -5.743
  257   2HB   ASP  35          2HB       ASP  35   1.631 -12.300  -5.763
  258    H    GLY  36           H        GLY  36  -1.968 -11.918  -3.646
  259   1HA   GLY  36          1HA       GLY  36  -2.017 -12.021  -1.346
  260   2HA   GLY  36          2HA       GLY  36  -0.945 -13.405  -1.479
  261    H    PHE  37           H        PHE  37  -0.312 -10.067  -2.528
  262    HA   PHE  37           HA       PHE  37   1.912 -10.041  -0.598
  263   1HB   PHE  37          1HB       PHE  37   1.626  -8.816  -3.332
  264   2HB   PHE  37          2HB       PHE  37   2.800  -8.189  -2.181
  265    HD1  PHE  37           HD1      PHE  37   4.179 -10.214  -1.002
  266    HD2  PHE  37           HD2      PHE  37   2.471 -10.257  -4.900
  267    HE1  PHE  37           HE1      PHE  37   5.785 -11.942  -1.674
  268    HE2  PHE  37           HE2      PHE  37   4.080 -11.993  -5.581
  269    HZ   PHE  37           HZ       PHE  37   5.732 -12.838  -3.976
  270    H    LEU  38           H        LEU  38   1.979  -8.510   0.918
  271    HA   LEU  38           HA       LEU  38  -0.264  -6.761   1.234
  272   1HB   LEU  38          1HB       LEU  38   0.864  -6.141   3.323
  273   2HB   LEU  38          2HB       LEU  38   0.654  -7.864   3.168
  274    HG   LEU  38           HG       LEU  38   3.276  -6.585   2.431
  275   1HD1  LEU  38          1HD1      LEU  38   3.684  -5.991   4.527
  276   2HD1  LEU  38          2HD1      LEU  38   3.444  -7.667   5.026
  277   3HD1  LEU  38          3HD1      LEU  38   2.084  -6.542   5.021
  278   1HD2  LEU  38          1HD2      LEU  38   2.215  -9.241   2.608
  279   2HD2  LEU  38          2HD2      LEU  38   3.537  -9.049   3.761
  280   3HD2  LEU  38          3HD2      LEU  38   3.805  -8.710   2.053
  281    H    TRP  39           H        TRP  39  -0.373  -4.654   0.833
  282    HA   TRP  39           HA       TRP  39   2.083  -3.190   0.214
  283   1HB   TRP  39          1HB       TRP  39   1.103  -2.242  -1.821
  284   2HB   TRP  39          2HB       TRP  39   1.194  -3.991  -1.942
  285    HD1  TRP  39           HD1      TRP  39  -1.170  -5.351  -1.759
  286    HE1  TRP  39           HE1      TRP  39  -3.573  -4.616  -2.276
  287    HE3  TRP  39           HE3      TRP  39  -0.495  -0.285  -1.789
  288    HZ2  TRP  39           HZ2      TRP  39  -4.994  -2.203  -2.641
  289    HZ3  TRP  39           HZ3      TRP  39  -2.431   1.163  -2.231
  290    HH2  TRP  39           HH2      TRP  39  -4.634   0.213  -2.642
  291    H    CYS  40           H        CYS  40   1.502  -0.802  -0.200
  292    HA   CYS  40           HA       CYS  40  -0.816   0.199   1.230
  293   1HB   CYS  40          1HB       CYS  40   0.508   1.530   2.803
  294   2HB   CYS  40          2HB       CYS  40   0.846  -0.186   3.026
  295    H    SER  41           H        SER  41  -1.131   2.497   0.729
  296    HA   SER  41           HA       SER  41   0.351   3.253  -1.677
  297   1HB   SER  41          1HB       SER  41  -1.456   4.991  -1.927
  298   2HB   SER  41          2HB       SER  41  -2.035   3.325  -1.961
  299    HG   SER  41           HG       SER  41  -2.533   5.337  -0.147
  300    H    THR  42           H        THR  42   1.197   5.434  -1.908
  301    HA   THR  42           HA       THR  42   2.365   6.387   0.554
  302    HB   THR  42           HB       THR  42   2.939   8.063  -1.675
  303    HG1  THR  42           HG1      THR  42   3.395   6.693  -3.260
  304   1HG2  THR  42          1HG2      THR  42   4.675   7.782  -0.171
  305   2HG2  THR  42          2HG2      THR  42   5.175   6.809  -1.557
  306   3HG2  THR  42          3HG2      THR  42   4.483   6.030  -0.133
  307    H    THR  43           H        THR  43  -0.213   7.136  -1.566
  308    HA   THR  43           HA       THR  43  -0.629   9.762  -0.324
  309    HB   THR  43           HB       THR  43  -2.180  10.150  -2.234
  310    HG1  THR  43           HG1      THR  43  -2.668   8.591  -3.574
  311   1HG2  THR  43          1HG2      THR  43  -0.407  11.007  -3.250
  312   2HG2  THR  43          2HG2      THR  43  -0.125   9.430  -3.989
  313   3HG2  THR  43          3HG2      THR  43   0.664   9.844  -2.466
  314    H    TYR  44           H        TYR  44  -3.169  10.215  -0.224
  315    HA   TYR  44           HA       TYR  44  -4.184   8.218   1.580
  316   1HB   TYR  44          1HB       TYR  44  -4.488  10.719   1.880
  317   2HB   TYR  44          2HB       TYR  44  -5.659  10.661   0.565
  318    HD1  TYR  44           HD1      TYR  44  -7.719   9.141   0.880
  319    HD2  TYR  44           HD2      TYR  44  -5.129  10.218   4.085
  320    HE1  TYR  44           HE1      TYR  44  -9.469   8.532   2.496
  321    HE2  TYR  44           HE2      TYR  44  -6.877   9.614   5.704
  322    HH   TYR  44           HH       TYR  44  -9.346   7.734   5.123
  323    H    ASN  45           H        ASN  45  -5.386   9.623  -1.493
  324    HA   ASN  45           HA       ASN  45  -7.154   7.312  -1.748
  325   1HB   ASN  45          1HB       ASN  45  -7.895   9.728  -2.200
  326   2HB   ASN  45          2HB       ASN  45  -6.975   9.624  -3.682
  327   1HD2  ASN  45          1HD2      ASN  45  -7.841   6.680  -3.841
  328   2HD2  ASN  45          2HD2      ASN  45  -9.429   6.859  -4.416
  329    H    PHE  46           H        PHE  46  -6.107   5.578  -2.521
  330    HA   PHE  46           HA       PHE  46  -3.821   5.656  -4.176
  331   1HB   PHE  46          1HB       PHE  46  -4.283   3.785  -2.690
  332   2HB   PHE  46          2HB       PHE  46  -5.760   3.400  -3.596
  333    HD1  PHE  46           HD1      PHE  46  -2.152   4.051  -4.456
  334    HD2  PHE  46           HD2      PHE  46  -5.533   1.495  -4.876
  335    HE1  PHE  46           HE1      PHE  46  -0.855   2.569  -5.920
  336    HE2  PHE  46           HE2      PHE  46  -4.238   0.015  -6.338
  337    HZ   PHE  46           HZ       PHE  46  -1.895   0.550  -6.865
  338    H    GLU  47           H        GLU  47  -7.227   5.467  -4.914
  339    HA   GLU  47           HA       GLU  47  -7.193   4.458  -7.480
  340   1HB   GLU  47          1HB       GLU  47  -9.188   4.957  -6.047
  341   2HB   GLU  47          2HB       GLU  47  -9.009   6.646  -6.485
  342   1HG   GLU  47          1HG       GLU  47  -9.342   6.042  -8.848
  343   2HG   GLU  47          2HG       GLU  47  -9.591   4.366  -8.358
  344    H    LYS  48           H        LYS  48  -7.109   7.911  -6.582
  345    HA   LYS  48           HA       LYS  48  -6.780   8.716  -9.291
  346   1HB   LYS  48          1HB       LYS  48  -6.458  10.999  -8.354
  347   2HB   LYS  48          2HB       LYS  48  -7.955  10.214  -7.879
  348   1HG   LYS  48          1HG       LYS  48  -7.107   9.771  -5.695
  349   2HG   LYS  48          2HG       LYS  48  -5.488  10.298  -6.155
  350   1HD   LYS  48          1HD       LYS  48  -7.899  12.105  -6.232
  351   2HD   LYS  48          2HD       LYS  48  -6.843  11.964  -4.824
  352   1HE   LYS  48          1HE       LYS  48  -5.933  12.756  -7.594
  353   2HE   LYS  48          2HE       LYS  48  -6.302  13.896  -6.300
  354   1HZ   LYS  48          1HZ       LYS  48  -3.867  13.146  -6.688
  355   2HZ   LYS  48          2HZ       LYS  48  -4.325  11.751  -5.835
  356   3HZ   LYS  48          3HZ       LYS  48  -4.459  13.276  -5.100
  357    H    ASP  49           H        ASP  49  -4.487   8.250  -6.648
  358    HA   ASP  49           HA       ASP  49  -2.398   9.519  -8.195
  359   1HB   ASP  49          1HB       ASP  49  -2.331   8.166  -5.497
  360   2HB   ASP  49          2HB       ASP  49  -0.936   8.937  -6.251
  361    H    GLY  50           H        GLY  50  -2.859   6.226  -6.860
  362   1HA   GLY  50          1HA       GLY  50  -2.401   4.226  -7.971
  363   2HA   GLY  50          2HA       GLY  50  -1.664   5.149  -9.264
  364    H    LYS  51           H        LYS  51  -0.433   6.140  -6.285
  365    HA   LYS  51           HA       LYS  51   2.053   4.722  -6.832
  366   1HB   LYS  51          1HB       LYS  51   1.344   6.960  -4.937
  367   2HB   LYS  51          2HB       LYS  51   2.889   6.133  -4.861
  368   1HG   LYS  51          1HG       LYS  51   3.360   7.992  -6.124
  369   2HG   LYS  51          2HG       LYS  51   3.072   6.764  -7.353
  370   1HD   LYS  51          1HD       LYS  51   0.831   7.594  -7.707
  371   2HD   LYS  51          2HD       LYS  51   1.027   8.764  -6.403
  372   1HE   LYS  51          1HE       LYS  51   1.327   9.836  -8.568
  373   2HE   LYS  51          2HE       LYS  51   2.827   9.859  -7.643
  374   1HZ   LYS  51          1HZ       LYS  51   3.678   8.047  -8.946
  375   2HZ   LYS  51          2HZ       LYS  51   3.126   9.260 -10.007
  376   3HZ   LYS  51          3HZ       LYS  51   2.195   7.864  -9.759
  377    H    TYR  52           H        TYR  52   2.438   2.811  -5.934
  378    HA   TYR  52           HA       TYR  52   1.595   2.347  -3.170
  379   1HB   TYR  52          1HB       TYR  52   0.618   0.230  -3.644
  380   2HB   TYR  52          2HB       TYR  52  -0.072   1.334  -4.832
  381    HD1  TYR  52           HD1      TYR  52   1.305   1.475  -7.101
  382    HD2  TYR  52           HD2      TYR  52   1.434  -1.803  -4.395
  383    HE1  TYR  52           HE1      TYR  52   2.140   0.028  -8.904
  384    HE2  TYR  52           HE2      TYR  52   2.264  -3.261  -6.188
  385    HH   TYR  52           HH       TYR  52   2.770  -2.023  -9.485
  386    H    GLY  53           H        GLY  53   2.668   0.436  -2.252
  387   1HA   GLY  53          1HA       GLY  53   4.962  -0.655  -3.599
  388   2HA   GLY  53          2HA       GLY  53   5.372   0.449  -2.292
  389    H    PHE  54           H        PHE  54   6.016  -2.294  -2.320
  390    HA   PHE  54           HA       PHE  54   4.084  -3.571  -0.593
  391   1HB   PHE  54          1HB       PHE  54   6.749  -4.568  -1.594
  392   2HB   PHE  54          2HB       PHE  54   5.595  -5.527  -0.674
  393    HD1  PHE  54           HD1      PHE  54   3.091  -5.257  -1.762
  394    HD2  PHE  54           HD2      PHE  54   6.802  -5.058  -3.828
  395    HE1  PHE  54           HE1      PHE  54   1.956  -5.884  -3.848
  396    HE2  PHE  54           HE2      PHE  54   5.674  -5.688  -5.920
  397    HZ   PHE  54           HZ       PHE  54   3.254  -6.104  -5.933
  398    H    CYS  55           H        CYS  55   4.298  -3.890   1.560
  399    HA   CYS  55           HA       CYS  55   6.475  -2.403   2.832
  400   1HB   CYS  55          1HB       CYS  55   4.674  -3.027   4.827
  401   2HB   CYS  55          2HB       CYS  55   4.758  -1.508   3.943
  402    HA   PRO  56           HA       PRO  56   7.805  -6.514   4.176
  403   1HB   PRO  56          1HB       PRO  56  10.374  -6.247   3.527
  404   2HB   PRO  56          2HB       PRO  56   9.153  -6.526   2.280
  405   1HG   PRO  56          1HG       PRO  56  10.668  -4.068   2.918
  406   2HG   PRO  56          2HG       PRO  56   9.891  -4.547   1.401
  407   1HD   PRO  56          1HD       PRO  56   8.878  -2.789   3.456
  408   2HD   PRO  56          2HD       PRO  56   8.126  -3.212   1.903
  409    H    HIS  57           H        HIS  57   7.364  -4.222   5.905
  410    HA   HIS  57           HA       HIS  57   9.761  -3.778   7.429
  411   1HB   HIS  57          1HB       HIS  57   7.877  -2.098   7.127
  412   2HB   HIS  57          2HB       HIS  57   6.925  -3.083   8.234
  413    HD1  HIS  57           HD1      HIS  57   8.231  -3.470  10.657
  414    HD2  HIS  57           HD2      HIS  57   9.251  -0.141   8.384
  415    HE1  HIS  57           HE1      HIS  57   9.371  -1.888  12.249
  416    H    GLU  58           H        GLU  58  10.146  -6.085   7.776
  417    HA   GLU  58           HA       GLU  58   8.854  -6.996  10.240
  418   1HB   GLU  58          1HB       GLU  58   9.127  -9.342   9.374
  419   2HB   GLU  58          2HB       GLU  58   7.885  -8.402   8.573
  420   1HG   GLU  58          1HG       GLU  58   9.388  -8.022   6.689
  421   2HG   GLU  58          2HG       GLU  58  10.656  -8.938   7.508
  422    H    ALA  59           H        ALA  59  11.292  -5.521   9.669
  423    HA   ALA  59           HA       ALA  59  13.506  -7.331   9.982
  424   1HB   ALA  59          1HB       ALA  59  13.185  -4.661   9.198
  425   2HB   ALA  59          2HB       ALA  59  14.685  -5.576   9.303
  426   3HB   ALA  59          3HB       ALA  59  14.146  -4.616  10.679
  Start of MODEL   19
    1   1H    ARG   1          1H        ARG   1   6.692   5.665  10.328
    2   2H    ARG   1          2H        ARG   1   6.089   4.057  10.227
    3   3H    ARG   1          3H        ARG   1   5.010   5.365  10.470
    4    HA   ARG   1           HA       ARG   1   5.019   4.491   8.211
    5   1HB   ARG   1          1HB       ARG   1   4.288   6.763   8.693
    6   2HB   ARG   1          2HB       ARG   1   5.951   7.340   8.708
    7   1HG   ARG   1          1HG       ARG   1   6.161   7.018   6.368
    8   2HG   ARG   1          2HG       ARG   1   4.617   6.160   6.284
    9   1HD   ARG   1          1HD       ARG   1   3.390   8.144   6.761
   10   2HD   ARG   1          2HD       ARG   1   4.857   9.018   7.204
   11    HE   ARG   1           HE       ARG   1   5.310   8.353   4.622
   12   1HH1  ARG   1          1HH1      ARG   1   2.625   9.924   6.230
   13   2HH1  ARG   1          2HH1      ARG   1   2.196  10.888   4.850
   14   1HH2  ARG   1          1HH2      ARG   1   4.836   9.706   2.855
   15   2HH2  ARG   1          2HH2      ARG   1   3.471  10.779   2.923
   16    H    ILE   2           H        ILE   2   6.512   3.052   7.377
   17    HA   ILE   2           HA       ILE   2   8.693   4.075   5.910
   18    HB   ILE   2           HB       ILE   2   9.649   4.280   8.177
   19   1HG1  ILE   2          1HG1      ILE   2  11.016   2.315   6.330
   20   2HG1  ILE   2          2HG1      ILE   2  11.160   4.070   6.301
   21   1HG2  ILE   2          1HG2      ILE   2   9.240   1.314   8.222
   22   2HG2  ILE   2          2HG2      ILE   2   8.770   2.519   9.424
   23   3HG2  ILE   2          3HG2      ILE   2  10.470   2.099   9.211
   24   1HD1  ILE   2          1HD1      ILE   2  11.908   3.496   8.845
   25   2HD1  ILE   2          2HD1      ILE   2  13.009   3.737   7.491
   26   3HD1  ILE   2          3HD1      ILE   2  12.530   2.104   7.953
   27    HA   PRO   3           HA       PRO   3   8.595  -0.808   5.708
   28   1HB   PRO   3          1HB       PRO   3   6.126  -1.907   5.804
   29   2HB   PRO   3          2HB       PRO   3   7.172  -1.722   7.217
   30   1HG   PRO   3          1HG       PRO   3   4.930   0.028   6.275
   31   2HG   PRO   3          2HG       PRO   3   5.255  -0.580   7.911
   32   1HD   PRO   3          1HD       PRO   3   5.935   1.914   7.191
   33   2HD   PRO   3          2HD       PRO   3   6.967   0.959   8.276
   34    H    VAL   4           H        VAL   4   8.896   0.492   3.528
   35    HA   VAL   4           HA       VAL   4   7.018  -0.779   1.643
   36    HB   VAL   4           HB       VAL   4   8.142   2.025   1.201
   37   1HG1  VAL   4          1HG1      VAL   4   7.918   0.895  -0.893
   38   2HG1  VAL   4          2HG1      VAL   4   6.522   1.965  -0.734
   39   3HG1  VAL   4          3HG1      VAL   4   6.350   0.235  -0.444
   40   1HG2  VAL   4          1HG2      VAL   4   5.448   1.033   2.066
   41   2HG2  VAL   4          2HG2      VAL   4   5.632   2.567   1.212
   42   3HG2  VAL   4          3HG2      VAL   4   6.435   2.315   2.766
   43    H    LYS   5           H        LYS   5   7.944  -1.772  -0.058
   44    HA   LYS   5           HA       LYS   5  10.876  -1.611  -0.233
   45   1HB   LYS   5          1HB       LYS   5   8.997  -3.882  -0.207
   46   2HB   LYS   5          2HB       LYS   5  10.269  -3.992  -1.410
   47   1HG   LYS   5          1HG       LYS   5  10.655  -3.678   1.564
   48   2HG   LYS   5          2HG       LYS   5  10.862  -5.163   0.623
   49   1HD   LYS   5          1HD       LYS   5  12.710  -4.187  -0.596
   50   2HD   LYS   5          2HD       LYS   5  12.472  -2.642   0.223
   51   1HE   LYS   5          1HE       LYS   5  12.967  -3.743   2.378
   52   2HE   LYS   5          2HE       LYS   5  13.269  -5.250   1.509
   53   1HZ   LYS   5          1HZ       LYS   5  14.980  -3.916   0.216
   54   2HZ   LYS   5          2HZ       LYS   5  15.358  -4.304   1.827
   55   3HZ   LYS   5          3HZ       LYS   5  14.831  -2.738   1.440
   56    H    TYR   6           H        TYR   6   8.944  -3.431  -2.454
   57    HA   TYR   6           HA       TYR   6   9.975  -1.861  -4.654
   58   1HB   TYR   6          1HB       TYR   6   8.263  -4.340  -4.863
   59   2HB   TYR   6          2HB       TYR   6   9.365  -3.676  -6.065
   60    HD1  TYR   6           HD1      TYR   6   9.172  -5.578  -2.903
   61    HD2  TYR   6           HD2      TYR   6  11.773  -4.071  -5.923
   62    HE1  TYR   6           HE1      TYR   6  10.984  -6.983  -2.035
   63    HE2  TYR   6           HE2      TYR   6  13.586  -5.480  -5.063
   64    HH   TYR   6           HH       TYR   6  13.240  -8.044  -3.271
   65    H    GLY   7           H        GLY   7   8.382  -1.734  -6.603
   66   1HA   GLY   7          1HA       GLY   7   6.072  -1.308  -7.248
   67   2HA   GLY   7          2HA       GLY   7   5.813  -0.590  -5.667
   68    H    ASN   8           H        ASN   8   5.128   1.390  -6.655
   69    HA   ASN   8           HA       ASN   8   7.369   2.800  -7.919
   70   1HB   ASN   8          1HB       ASN   8   5.867   4.156  -9.190
   71   2HB   ASN   8          2HB       ASN   8   5.406   2.473  -9.408
   72   1HD2  ASN   8          1HD2      ASN   8   3.892   4.949  -9.754
   73   2HD2  ASN   8          2HD2      ASN   8   2.493   4.778  -8.760
   74    H    ALA   9           H        ALA   9   6.243   2.580  -5.018
   75    HA   ALA   9           HA       ALA   9   6.094   5.430  -4.367
   76   1HB   ALA   9          1HB       ALA   9   5.894   3.266  -2.327
   77   2HB   ALA   9          2HB       ALA   9   4.519   3.588  -3.393
   78   3HB   ALA   9          3HB       ALA   9   5.134   4.866  -2.346
   79    H    ASP  10           H        ASP  10   8.531   4.134  -5.294
   80    HA   ASP  10           HA       ASP  10  10.254   3.516  -3.149
   81   1HB   ASP  10          1HB       ASP  10  10.621   2.948  -5.583
   82   2HB   ASP  10          2HB       ASP  10  11.081   4.631  -5.834
   83    H    GLY  11           H        GLY  11  10.675   4.876  -1.564
   84   1HA   GLY  11          1HA       GLY  11  12.193   6.822  -1.100
   85   2HA   GLY  11          2HA       GLY  11  11.189   7.702  -2.245
   86    H    GLU  12           H        GLU  12   8.678   6.841  -1.531
   87    HA   GLU  12           HA       GLU  12   8.353   8.240   0.996
   88   1HB   GLU  12          1HB       GLU  12   6.341   7.353  -1.078
   89   2HB   GLU  12          2HB       GLU  12   5.924   8.183   0.412
   90   1HG   GLU  12          1HG       GLU  12   5.980   9.966  -0.973
   91   2HG   GLU  12          2HG       GLU  12   7.685   9.932  -0.526
   92    H    TYR  13           H        TYR  13   6.359   7.313   2.315
   93    HA   TYR  13           HA       TYR  13   6.796   4.414   2.612
   94   1HB   TYR  13          1HB       TYR  13   6.403   6.373   4.872
   95   2HB   TYR  13          2HB       TYR  13   6.749   4.642   5.011
   96    HD1  TYR  13           HD1      TYR  13   8.903   3.955   3.497
   97    HD2  TYR  13           HD2      TYR  13   8.226   7.765   5.268
   98    HE1  TYR  13           HE1      TYR  13  11.307   4.421   3.391
   99    HE2  TYR  13           HE2      TYR  13  10.638   8.239   5.172
  100    HH   TYR  13           HH       TYR  13  12.793   6.389   3.321
  101    H    CYS  14           H        CYS  14   4.953   3.795   4.505
  102    HA   CYS  14           HA       CYS  14   2.555   3.855   2.945
  103   1HB   CYS  14          1HB       CYS  14   3.145   2.644   5.638
  104   2HB   CYS  14          2HB       CYS  14   1.641   2.419   4.757
  105    H    LYS  15           H        LYS  15   0.696   4.914   3.266
  106    HA   LYS  15           HA       LYS  15   0.599   6.829   5.500
  107   1HB   LYS  15          1HB       LYS  15   0.412   7.893   3.298
  108   2HB   LYS  15          2HB       LYS  15  -0.908   6.818   2.870
  109   1HG   LYS  15          1HG       LYS  15  -1.741   9.017   3.460
  110   2HG   LYS  15          2HG       LYS  15  -2.304   7.802   4.609
  111   1HD   LYS  15          1HD       LYS  15  -0.518   8.481   6.168
  112   2HD   LYS  15          2HD       LYS  15  -0.010   9.728   5.030
  113   1HE   LYS  15          1HE       LYS  15  -1.394  10.713   6.754
  114   2HE   LYS  15          2HE       LYS  15  -2.233  10.776   5.205
  115   1HZ   LYS  15          1HZ       LYS  15  -3.048   8.411   6.282
  116   2HZ   LYS  15          2HZ       LYS  15  -3.934   9.856   6.286
  117   3HZ   LYS  15          3HZ       LYS  15  -2.980   9.439   7.630
  118    H    PHE  16           H        PHE  16  -0.462   5.967   7.160
  119    HA   PHE  16           HA       PHE  16  -2.816   4.292   6.594
  120   1HB   PHE  16          1HB       PHE  16  -1.043   4.408   9.049
  121   2HB   PHE  16          2HB       PHE  16  -2.472   3.397   8.897
  122    HD1  PHE  16           HD1      PHE  16   0.164   2.305   9.602
  123    HD2  PHE  16           HD2      PHE  16  -1.604   2.962   5.790
  124    HE1  PHE  16           HE1      PHE  16   1.558   0.524   8.669
  125    HE2  PHE  16           HE2      PHE  16  -0.209   1.179   4.835
  126    HZ   PHE  16           HZ       PHE  16   1.387  -0.071   6.265
  127    HA   PRO  17           HA       PRO  17  -4.568   3.921   6.806
  128   1HB   PRO  17          1HB       PRO  17  -7.150   4.504   6.510
  129   2HB   PRO  17          2HB       PRO  17  -6.510   3.973   8.070
  130   1HG   PRO  17          1HG       PRO  17  -7.290   6.713   7.188
  131   2HG   PRO  17          2HG       PRO  17  -7.422   5.967   8.790
  132   1HD   PRO  17          1HD       PRO  17  -5.392   7.712   7.903
  133   2HD   PRO  17          2HD       PRO  17  -5.385   6.749   9.393
  134    H    PHE  18           H        PHE  18  -5.318   3.562   4.659
  135    HA   PHE  18           HA       PHE  18  -5.332   5.965   2.966
  136   1HB   PHE  18          1HB       PHE  18  -4.161   4.811   1.210
  137   2HB   PHE  18          2HB       PHE  18  -3.221   4.660   2.683
  138    HD1  PHE  18           HD1      PHE  18  -5.423   2.847   0.334
  139    HD2  PHE  18           HD2      PHE  18  -2.695   2.544   3.584
  140    HE1  PHE  18           HE1      PHE  18  -5.283   0.425  -0.022
  141    HE2  PHE  18           HE2      PHE  18  -2.555   0.111   3.241
  142    HZ   PHE  18           HZ       PHE  18  -3.847  -0.970   1.441
  143    H    LEU  19           H        LEU  19  -6.643   5.812   1.029
  144    HA   LEU  19           HA       LEU  19  -9.028   4.243   1.581
  145   1HB   LEU  19          1HB       LEU  19  -9.094   6.717   1.165
  146   2HB   LEU  19          2HB       LEU  19  -8.622   6.393  -0.492
  147    HG   LEU  19           HG       LEU  19 -10.702   4.968  -0.680
  148   1HD1  LEU  19          1HD1      LEU  19 -12.035   6.447   1.447
  149   2HD1  LEU  19          2HD1      LEU  19 -10.837   5.290   2.038
  150   3HD1  LEU  19          3HD1      LEU  19 -12.156   4.747   0.996
  151   1HD2  LEU  19          1HD2      LEU  19 -10.444   7.873  -0.619
  152   2HD2  LEU  19          2HD2      LEU  19 -12.102   7.308  -0.426
  153   3HD2  LEU  19          3HD2      LEU  19 -11.161   6.822  -1.834
  154    H    PHE  20           H        PHE  20  -9.504   2.444   0.563
  155    HA   PHE  20           HA       PHE  20  -8.614   2.040  -2.222
  156   1HB   PHE  20          1HB       PHE  20  -7.303   0.674  -0.414
  157   2HB   PHE  20          2HB       PHE  20  -8.822  -0.201  -0.246
  158    HD1  PHE  20           HD1      PHE  20  -7.386  -2.122  -0.788
  159    HD2  PHE  20           HD2      PHE  20  -8.294   0.923  -3.610
  160    HE1  PHE  20           HE1      PHE  20  -6.862  -3.690  -2.604
  161    HE2  PHE  20           HE2      PHE  20  -7.774  -0.641  -5.447
  162    HZ   PHE  20           HZ       PHE  20  -7.062  -2.945  -4.949
  163    H    ASN  21           H        ASN  21 -10.551   2.172  -3.267
  164    HA   ASN  21           HA       ASN  21 -12.716   1.793  -3.846
  165   1HB   ASN  21          1HB       ASN  21 -12.053  -0.796  -2.457
  166   2HB   ASN  21          2HB       ASN  21 -13.625  -0.518  -3.199
  167   1HD2  ASN  21          1HD2      ASN  21 -10.771  -1.933  -3.694
  168   2HD2  ASN  21          2HD2      ASN  21 -10.674  -1.856  -5.418
  169    H    GLY  22           H        GLY  22 -12.245   3.239  -1.374
  170   1HA   GLY  22          1HA       GLY  22 -13.817   4.294  -0.003
  171   2HA   GLY  22          2HA       GLY  22 -14.931   2.972  -0.278
  172    H    LYS  23           H        LYS  23 -12.184   1.440   0.491
  173    HA   LYS  23           HA       LYS  23 -12.924   1.334   3.335
  174   1HB   LYS  23          1HB       LYS  23 -12.971  -0.772   1.958
  175   2HB   LYS  23          2HB       LYS  23 -11.234  -0.609   1.741
  176   1HG   LYS  23          1HG       LYS  23 -10.877  -0.864   4.126
  177   2HG   LYS  23          2HG       LYS  23 -12.621  -0.964   4.397
  178   1HD   LYS  23          1HD       LYS  23 -12.728  -2.990   3.043
  179   2HD   LYS  23          2HD       LYS  23 -10.996  -2.875   2.718
  180   1HE   LYS  23          1HE       LYS  23 -11.448  -4.498   4.474
  181   2HE   LYS  23          2HE       LYS  23 -10.517  -3.134   5.085
  182   1HZ   LYS  23          1HZ       LYS  23 -13.369  -2.784   5.351
  183   2HZ   LYS  23          2HZ       LYS  23 -12.130  -2.557   6.494
  184   3HZ   LYS  23          3HZ       LYS  23 -12.764  -4.113   6.222
  185    H    GLU  24           H        GLU  24 -11.496   1.939   4.897
  186    HA   GLU  24           HA       GLU  24  -8.930   3.020   3.969
  187   1HB   GLU  24          1HB       GLU  24 -10.422   3.526   6.544
  188   2HB   GLU  24          2HB       GLU  24  -8.942   4.329   6.043
  189   1HG   GLU  24          1HG       GLU  24 -10.123   5.258   4.115
  190   2HG   GLU  24          2HG       GLU  24 -11.602   4.472   4.657
  191    H    TYR  25           H        TYR  25  -7.152   1.915   4.321
  192    HA   TYR  25           HA       TYR  25  -7.137  -0.196   6.353
  193   1HB   TYR  25          1HB       TYR  25  -5.304   0.330   4.035
  194   2HB   TYR  25          2HB       TYR  25  -5.124  -1.013   5.147
  195    HD1  TYR  25           HD1      TYR  25  -7.111  -2.651   5.316
  196    HD2  TYR  25           HD2      TYR  25  -6.594   0.113   2.129
  197    HE1  TYR  25           HE1      TYR  25  -8.623  -3.996   3.901
  198    HE2  TYR  25           HE2      TYR  25  -8.097  -1.224   0.706
  199    HH   TYR  25           HH       TYR  25  -8.819  -4.234   1.119
  200    H    ASN  26           H        ASN  26  -6.012   0.018   8.171
  201    HA   ASN  26           HA       ASN  26  -4.085   2.215   8.399
  202   1HB   ASN  26          1HB       ASN  26  -5.745   0.697  10.361
  203   2HB   ASN  26          2HB       ASN  26  -4.194   1.336  10.915
  204   1HD2  ASN  26          1HD2      ASN  26  -7.419   2.006  10.472
  205   2HD2  ASN  26          2HD2      ASN  26  -7.350   3.726  10.605
  206    H    SER  27           H        SER  27  -3.639  -0.290   6.984
  207    HA   SER  27           HA       SER  27  -0.996  -0.851   7.787
  208   1HB   SER  27          1HB       SER  27  -1.451  -3.339   8.275
  209   2HB   SER  27          2HB       SER  27  -1.850  -2.193   9.562
  210    HG   SER  27           HG       SER  27  -3.447  -3.956   8.714
  211    H    CYS  28           H        CYS  28  -0.339  -3.044   6.502
  212    HA   CYS  28           HA       CYS  28  -1.079  -2.482   3.782
  213   1HB   CYS  28          1HB       CYS  28   0.658  -4.686   4.901
  214   2HB   CYS  28          2HB       CYS  28   0.545  -4.222   3.205
  215    H    THR  29           H        THR  29  -2.192  -3.812   2.352
  216    HA   THR  29           HA       THR  29  -3.572  -6.109   3.519
  217    HB   THR  29           HB       THR  29  -5.106  -4.186   3.437
  218    HG1  THR  29           HG1      THR  29  -6.414  -5.793   3.086
  219   1HG2  THR  29          1HG2      THR  29  -5.591  -2.910   1.637
  220   2HG2  THR  29          2HG2      THR  29  -5.212  -4.190   0.486
  221   3HG2  THR  29          3HG2      THR  29  -3.909  -3.283   1.253
  222    H    ASP  30           H        ASP  30  -4.461  -7.605   1.826
  223    HA   ASP  30           HA       ASP  30  -2.593  -7.709  -0.417
  224   1HB   ASP  30          1HB       ASP  30  -4.201 -10.065  -0.115
  225   2HB   ASP  30          2HB       ASP  30  -2.474  -9.934  -0.222
  226    H    THR  31           H        THR  31  -5.459  -6.536   0.212
  227    HA   THR  31           HA       THR  31  -7.254  -7.662  -1.618
  228    HB   THR  31           HB       THR  31  -7.102  -4.789  -0.725
  229    HG1  THR  31           HG1      THR  31  -7.168  -5.984   1.118
  230   1HG2  THR  31          1HG2      THR  31  -9.747  -5.550  -0.801
  231   2HG2  THR  31          2HG2      THR  31  -9.062  -6.250  -2.267
  232   3HG2  THR  31          3HG2      THR  31  -8.918  -4.519  -1.968
  233    H    GLY  32           H        GLY  32  -7.554  -7.411  -3.762
  234   1HA   GLY  32          1HA       GLY  32  -7.365  -6.400  -5.862
  235   2HA   GLY  32          2HA       GLY  32  -6.205  -5.267  -5.183
  236    H    ARG  33           H        ARG  33  -4.797  -7.555  -3.882
  237    HA   ARG  33           HA       ARG  33  -3.164  -8.341  -6.187
  238   1HB   ARG  33          1HB       ARG  33  -2.604  -8.403  -3.213
  239   2HB   ARG  33          2HB       ARG  33  -1.482  -8.953  -4.441
  240   1HG   ARG  33          1HG       ARG  33  -2.509  -6.145  -4.116
  241   2HG   ARG  33          2HG       ARG  33  -0.922  -6.729  -3.617
  242   1HD   ARG  33          1HD       ARG  33  -1.992  -6.570  -6.432
  243   2HD   ARG  33          2HD       ARG  33  -0.766  -5.522  -5.721
  244    HE   ARG  33           HE       ARG  33  -0.133  -8.361  -5.749
  245   1HH1  ARG  33          1HH1      ARG  33   0.222  -5.256  -7.314
  246   2HH1  ARG  33          2HH1      ARG  33   1.546  -5.774  -8.319
  247   1HH2  ARG  33          1HH2      ARG  33   1.573  -9.049  -7.057
  248   2HH2  ARG  33          2HH2      ARG  33   2.327  -7.934  -8.154
  249    H    SER  34           H        SER  34  -3.660 -10.281  -7.005
  250    HA   SER  34           HA       SER  34  -5.027 -12.248  -5.407
  251   1HB   SER  34          1HB       SER  34  -3.944 -12.512  -8.220
  252   2HB   SER  34          2HB       SER  34  -5.150 -13.539  -7.451
  253    HG   SER  34           HG       SER  34  -6.258 -11.310  -7.169
  254    H    ASP  35           H        ASP  35  -1.858 -11.381  -5.697
  255    HA   ASP  35           HA       ASP  35  -0.753 -14.020  -5.546
  256   1HB   ASP  35          1HB       ASP  35   1.064 -11.864  -4.979
  257   2HB   ASP  35          2HB       ASP  35   1.178 -13.103  -6.195
  258    H    GLY  36           H        GLY  36  -2.137 -11.986  -3.421
  259   1HA   GLY  36          1HA       GLY  36  -2.293 -12.027  -1.121
  260   2HA   GLY  36          2HA       GLY  36  -1.273 -13.455  -1.147
  261    H    PHE  37           H        PHE  37  -0.358 -10.361  -2.520
  262    HA   PHE  37           HA       PHE  37   1.881 -10.250  -0.641
  263   1HB   PHE  37          1HB       PHE  37   1.339  -8.887  -3.272
  264   2HB   PHE  37          2HB       PHE  37   2.646  -8.369  -2.209
  265    HD1  PHE  37           HD1      PHE  37   3.783  -8.903  -4.535
  266    HD2  PHE  37           HD2      PHE  37   2.288 -11.836  -1.834
  267    HE1  PHE  37           HE1      PHE  37   5.266 -10.592  -5.542
  268    HE2  PHE  37           HE2      PHE  37   3.767 -13.526  -2.839
  269    HZ   PHE  37           HZ       PHE  37   5.263 -12.897  -4.697
  270    H    LEU  38           H        LEU  38   2.167  -8.663   0.809
  271    HA   LEU  38           HA       LEU  38  -0.073  -6.969   1.443
  272   1HB   LEU  38          1HB       LEU  38   2.600  -7.432   2.684
  273   2HB   LEU  38          2HB       LEU  38   1.585  -6.125   3.232
  274    HG   LEU  38           HG       LEU  38   1.329  -7.975   4.725
  275   1HD1  LEU  38          1HD1      LEU  38  -0.810  -7.486   4.931
  276   2HD1  LEU  38          2HD1      LEU  38  -1.212  -8.522   3.560
  277   3HD1  LEU  38          3HD1      LEU  38  -0.809  -6.824   3.299
  278   1HD2  LEU  38          1HD2      LEU  38   0.073  -9.872   2.916
  279   2HD2  LEU  38          2HD2      LEU  38   1.310 -10.124   4.148
  280   3HD2  LEU  38          3HD2      LEU  38   1.770  -9.582   2.538
  281    H    TRP  39           H        TRP  39  -0.368  -4.941   0.711
  282    HA   TRP  39           HA       TRP  39   2.027  -3.393   0.028
  283   1HB   TRP  39          1HB       TRP  39   1.042  -2.540  -2.009
  284   2HB   TRP  39          2HB       TRP  39   1.113  -4.293  -2.083
  285    HD1  TRP  39           HD1      TRP  39  -1.290  -5.611  -1.829
  286    HE1  TRP  39           HE1      TRP  39  -3.663  -4.847  -2.426
  287    HE3  TRP  39           HE3      TRP  39  -0.495  -0.563  -2.084
  288    HZ2  TRP  39           HZ2      TRP  39  -5.022  -2.430  -2.932
  289    HZ3  TRP  39           HZ3      TRP  39  -2.401   0.899  -2.637
  290    HH2  TRP  39           HH2      TRP  39  -4.613  -0.026  -3.048
  291    H    CYS  40           H        CYS  40   1.490  -1.056  -0.324
  292    HA   CYS  40           HA       CYS  40  -0.852  -0.055   1.082
  293   1HB   CYS  40          1HB       CYS  40   0.320   1.125   2.769
  294   2HB   CYS  40          2HB       CYS  40   1.050  -0.478   2.773
  295    H    SER  41           H        SER  41  -0.853   2.432   0.903
  296    HA   SER  41           HA       SER  41   0.599   3.200  -1.537
  297   1HB   SER  41          1HB       SER  41  -1.289   4.767  -2.000
  298   2HB   SER  41          2HB       SER  41  -1.775   3.068  -2.020
  299    HG   SER  41           HG       SER  41  -2.556   5.101  -0.357
  300    H    THR  42           H        THR  42   1.138   5.476  -1.713
  301    HA   THR  42           HA       THR  42   2.143   6.513   0.802
  302    HB   THR  42           HB       THR  42   2.400   7.451  -2.068
  303    HG1  THR  42           HG1      THR  42   4.076   5.973  -0.338
  304   1HG2  THR  42          1HG2      THR  42   3.086   9.390  -1.247
  305   2HG2  THR  42          2HG2      THR  42   4.518   8.516  -0.704
  306   3HG2  THR  42          3HG2      THR  42   3.164   8.767   0.397
  307    H    THR  43           H        THR  43  -0.217   7.310  -1.648
  308    HA   THR  43           HA       THR  43  -0.966   9.766  -0.276
  309    HB   THR  43           HB       THR  43  -2.372  10.125  -2.285
  310    HG1  THR  43           HG1      THR  43  -2.855   8.464  -3.458
  311   1HG2  THR  43          1HG2      THR  43  -0.554  10.161  -4.002
  312   2HG2  THR  43          2HG2      THR  43   0.496   9.383  -2.816
  313   3HG2  THR  43          3HG2      THR  43  -0.166  10.988  -2.491
  314    H    TYR  44           H        TYR  44  -3.243  10.205   0.162
  315    HA   TYR  44           HA       TYR  44  -4.457   8.089   1.605
  316   1HB   TYR  44          1HB       TYR  44  -4.759  10.477   2.192
  317   2HB   TYR  44          2HB       TYR  44  -5.674  10.714   0.702
  318    HD1  TYR  44           HD1      TYR  44  -5.722   8.391   3.666
  319    HD2  TYR  44           HD2      TYR  44  -7.988  10.753   0.937
  320    HE1  TYR  44           HE1      TYR  44  -7.784   7.778   4.853
  321    HE2  TYR  44           HE2      TYR  44 -10.057  10.143   2.126
  322    HH   TYR  44           HH       TYR  44 -10.001   7.904   4.888
  323    H    ASN  45           H        ASN  45  -5.307   9.717  -1.436
  324    HA   ASN  45           HA       ASN  45  -7.288   7.653  -1.991
  325   1HB   ASN  45          1HB       ASN  45  -7.703  10.121  -2.463
  326   2HB   ASN  45          2HB       ASN  45  -6.517  10.001  -3.743
  327   1HD2  ASN  45          1HD2      ASN  45  -7.691   7.160  -4.221
  328   2HD2  ASN  45          2HD2      ASN  45  -9.062   7.572  -5.123
  329    H    PHE  46           H        PHE  46  -6.339   5.799  -2.661
  330    HA   PHE  46           HA       PHE  46  -3.866   5.732  -4.083
  331   1HB   PHE  46          1HB       PHE  46  -4.364   3.912  -2.619
  332   2HB   PHE  46          2HB       PHE  46  -5.900   3.581  -3.458
  333    HD1  PHE  46           HD1      PHE  46  -5.942   2.074  -5.262
  334    HD2  PHE  46           HD2      PHE  46  -2.185   3.592  -3.941
  335    HE1  PHE  46           HE1      PHE  46  -4.781   0.527  -6.785
  336    HE2  PHE  46           HE2      PHE  46  -1.029   2.041  -5.446
  337    HZ   PHE  46           HZ       PHE  46  -2.327   0.505  -6.878
  338    H    GLU  47           H        GLU  47  -7.244   5.407  -5.011
  339    HA   GLU  47           HA       GLU  47  -6.815   4.528  -7.647
  340   1HB   GLU  47          1HB       GLU  47  -8.998   4.801  -6.137
  341   2HB   GLU  47          2HB       GLU  47  -9.131   6.296  -7.045
  342   1HG   GLU  47          1HG       GLU  47  -9.350   5.186  -9.079
  343   2HG   GLU  47          2HG       GLU  47  -8.743   3.666  -8.419
  344    H    LYS  48           H        LYS  48  -6.796   7.716  -6.208
  345    HA   LYS  48           HA       LYS  48  -6.829   9.149  -8.664
  346   1HB   LYS  48          1HB       LYS  48  -7.642  10.309  -6.768
  347   2HB   LYS  48          2HB       LYS  48  -6.213   9.929  -5.822
  348   1HG   LYS  48          1HG       LYS  48  -6.210  12.262  -6.410
  349   2HG   LYS  48          2HG       LYS  48  -4.887  11.446  -7.241
  350   1HD   LYS  48          1HD       LYS  48  -6.007  13.041  -8.705
  351   2HD   LYS  48          2HD       LYS  48  -6.221  11.389  -9.295
  352   1HE   LYS  48          1HE       LYS  48  -8.458  11.345  -8.243
  353   2HE   LYS  48          2HE       LYS  48  -8.231  13.023  -7.750
  354   1HZ   LYS  48          1HZ       LYS  48  -8.491  11.949 -10.508
  355   2HZ   LYS  48          2HZ       LYS  48  -7.890  13.506 -10.204
  356   3HZ   LYS  48          3HZ       LYS  48  -9.473  13.099  -9.735
  357    H    ASP  49           H        ASP  49  -4.190   8.795  -6.244
  358    HA   ASP  49           HA       ASP  49  -2.269   9.682  -8.202
  359   1HB   ASP  49          1HB       ASP  49  -2.064   8.873  -5.311
  360   2HB   ASP  49          2HB       ASP  49  -0.633   9.225  -6.280
  361    H    GLY  50           H        GLY  50  -2.467   6.714  -6.218
  362   1HA   GLY  50          1HA       GLY  50  -2.295   4.530  -7.117
  363   2HA   GLY  50          2HA       GLY  50  -1.595   5.219  -8.564
  364    H    LYS  51           H        LYS  51  -0.116   6.464  -5.765
  365    HA   LYS  51           HA       LYS  51   2.287   5.004  -6.366
  366   1HB   LYS  51          1HB       LYS  51   1.650   7.040  -4.271
  367   2HB   LYS  51          2HB       LYS  51   3.249   6.344  -4.524
  368   1HG   LYS  51          1HG       LYS  51   3.300   7.207  -6.772
  369   2HG   LYS  51          2HG       LYS  51   1.654   7.825  -6.597
  370   1HD   LYS  51          1HD       LYS  51   2.974   9.664  -6.235
  371   2HD   LYS  51          2HD       LYS  51   2.567   9.106  -4.611
  372   1HE   LYS  51          1HE       LYS  51   4.732   8.013  -4.424
  373   2HE   LYS  51          2HE       LYS  51   5.141   8.498  -6.067
  374   1HZ   LYS  51          1HZ       LYS  51   5.398  10.683  -5.457
  375   2HZ   LYS  51          2HZ       LYS  51   6.006   9.877  -4.090
  376   3HZ   LYS  51          3HZ       LYS  51   4.444  10.541  -4.056
  377    H    TYR  52           H        TYR  52   2.539   2.967  -5.649
  378    HA   TYR  52           HA       TYR  52   1.737   2.340  -2.888
  379   1HB   TYR  52          1HB       TYR  52   0.772   0.268  -3.550
  380   2HB   TYR  52          2HB       TYR  52   0.102   1.483  -4.638
  381    HD1  TYR  52           HD1      TYR  52   2.355  -1.402  -4.367
  382    HD2  TYR  52           HD2      TYR  52   0.702   1.509  -6.996
  383    HE1  TYR  52           HE1      TYR  52   3.182  -2.683  -6.288
  384    HE2  TYR  52           HE2      TYR  52   1.514   0.228  -8.927
  385    HH   TYR  52           HH       TYR  52   3.753  -2.347  -8.608
  386    H    GLY  53           H        GLY  53   2.718   0.310  -2.119
  387   1HA   GLY  53          1HA       GLY  53   5.081  -0.661  -3.434
  388   2HA   GLY  53          2HA       GLY  53   5.414   0.276  -1.988
  389    H    PHE  54           H        PHE  54   6.038  -2.475  -2.307
  390    HA   PHE  54           HA       PHE  54   3.980  -3.875  -0.817
  391   1HB   PHE  54          1HB       PHE  54   6.584  -4.879  -1.944
  392   2HB   PHE  54          2HB       PHE  54   5.374  -5.880  -1.155
  393    HD1  PHE  54           HD1      PHE  54   2.918  -5.515  -2.160
  394    HD2  PHE  54           HD2      PHE  54   6.580  -4.872  -4.226
  395    HE1  PHE  54           HE1      PHE  54   1.759  -5.810  -4.312
  396    HE2  PHE  54           HE2      PHE  54   5.434  -5.164  -6.374
  397    HZ   PHE  54           HZ       PHE  54   3.014  -5.639  -6.421
  398    H    CYS  55           H        CYS  55   4.161  -4.692   1.205
  399    HA   CYS  55           HA       CYS  55   6.518  -3.824   2.749
  400   1HB   CYS  55          1HB       CYS  55   4.331  -4.250   4.501
  401   2HB   CYS  55          2HB       CYS  55   5.123  -2.726   4.108
  402    HA   PRO  56           HA       PRO  56   6.433  -8.335   3.224
  403   1HB   PRO  56          1HB       PRO  56   9.068  -8.737   2.990
  404   2HB   PRO  56          2HB       PRO  56   8.029  -8.489   1.586
  405   1HG   PRO  56          1HG       PRO  56   9.955  -6.633   2.864
  406   2HG   PRO  56          2HG       PRO  56   9.460  -6.742   1.168
  407   1HD   PRO  56          1HD       PRO  56   8.526  -4.893   3.092
  408   2HD   PRO  56          2HD       PRO  56   7.850  -5.176   1.476
  409    H    HIS  57           H        HIS  57   6.285  -9.173   5.208
  410    HA   HIS  57           HA       HIS  57   7.739  -7.913   7.390
  411   1HB   HIS  57          1HB       HIS  57   6.357  -9.517   8.805
  412   2HB   HIS  57          2HB       HIS  57   5.465  -8.281   7.927
  413    HD1  HIS  57           HD1      HIS  57   6.571 -11.842   7.073
  414    HD2  HIS  57           HD2      HIS  57   3.217  -9.378   6.913
  415    HE1  HIS  57           HE1      HIS  57   4.744 -13.252   6.066
  416    H    GLU  58           H        GLU  58   9.493  -9.103   5.763
  417    HA   GLU  58           HA       GLU  58  10.074 -11.788   6.592
  418   1HB   GLU  58          1HB       GLU  58  12.120 -11.524   5.211
  419   2HB   GLU  58          2HB       GLU  58  10.643 -11.155   4.338
  420   1HG   GLU  58          1HG       GLU  58  11.105  -8.730   4.765
  421   2HG   GLU  58          2HG       GLU  58  12.672  -9.212   5.412
  422    H    ALA  59           H        ALA  59  11.109 -12.382   8.324
  423    HA   ALA  59           HA       ALA  59  12.311 -12.373  10.240
  424   1HB   ALA  59          1HB       ALA  59  14.403 -10.649   9.925
  425   2HB   ALA  59          2HB       ALA  59  13.989 -11.047   8.259
  426   3HB   ALA  59          3HB       ALA  59  14.376 -12.335   9.402
  Start of MODEL   20
    1   1H    ARG   1          1H        ARG   1  12.055   5.311   9.116
    2   2H    ARG   1          2H        ARG   1  11.085   6.586   9.746
    3   3H    ARG   1          3H        ARG   1  11.771   6.720   8.175
    4    HA   ARG   1           HA       ARG   1   9.914   4.569   8.883
    5   1HB   ARG   1          1HB       ARG   1   9.011   6.899   9.357
    6   2HB   ARG   1          2HB       ARG   1   9.223   7.244   7.646
    7   1HG   ARG   1          1HG       ARG   1   7.634   5.516   7.069
    8   2HG   ARG   1          2HG       ARG   1   7.464   5.076   8.771
    9   1HD   ARG   1          1HD       ARG   1   6.657   7.386   9.226
   10   2HD   ARG   1          2HD       ARG   1   6.716   7.709   7.492
   11    HE   ARG   1           HE       ARG   1   5.135   5.416   7.936
   12   1HH1  ARG   1          1HH1      ARG   1   5.085   8.881   8.417
   13   2HH1  ARG   1          2HH1      ARG   1   3.352   8.983   8.450
   14   1HH2  ARG   1          1HH2      ARG   1   2.863   5.543   8.010
   15   2HH2  ARG   1          2HH2      ARG   1   2.080   7.079   8.231
   16    H    ILE   2           H        ILE   2   9.996   3.126   7.274
   17    HA   ILE   2           HA       ILE   2  10.041   3.925   4.527
   18    HB   ILE   2           HB       ILE   2  12.420   4.177   5.007
   19   1HG1  ILE   2          1HG1      ILE   2  13.336   2.711   3.264
   20   2HG1  ILE   2          2HG1      ILE   2  11.901   1.696   3.350
   21   1HG2  ILE   2          1HG2      ILE   2  12.020   1.736   6.474
   22   2HG2  ILE   2          2HG2      ILE   2  13.353   2.892   6.554
   23   3HG2  ILE   2          3HG2      ILE   2  13.386   1.588   5.363
   24   1HD1  ILE   2          1HD1      ILE   2  10.572   3.266   2.303
   25   2HD1  ILE   2          2HD1      ILE   2  12.112   3.443   1.466
   26   3HD1  ILE   2          3HD1      ILE   2  11.655   4.607   2.707
   27    HA   PRO   3           HA       PRO   3   8.326  -0.328   5.515
   28   1HB   PRO   3          1HB       PRO   3   5.635   0.712   5.393
   29   2HB   PRO   3          2HB       PRO   3   6.471  -0.002   6.776
   30   1HG   PRO   3          1HG       PRO   3   5.771   2.627   6.682
   31   2HG   PRO   3          2HG       PRO   3   7.192   2.032   7.565
   32   1HD   PRO   3          1HD       PRO   3   7.073   3.224   4.788
   33   2HD   PRO   3          2HD       PRO   3   8.169   3.634   6.134
   34    H    VAL   4           H        VAL   4   8.983   1.098   2.974
   35    HA   VAL   4           HA       VAL   4   7.165  -0.429   1.240
   36    HB   VAL   4           HB       VAL   4   8.038   2.422   0.581
   37   1HG1  VAL   4          1HG1      VAL   4   7.342   0.436  -1.127
   38   2HG1  VAL   4          2HG1      VAL   4   7.113   2.155  -1.443
   39   3HG1  VAL   4          3HG1      VAL   4   5.776   1.188  -0.824
   40   1HG2  VAL   4          1HG2      VAL   4   5.908   1.598   2.281
   41   2HG2  VAL   4          2HG2      VAL   4   5.213   2.225   0.786
   42   3HG2  VAL   4          3HG2      VAL   4   6.320   3.223   1.726
   43    H    LYS   5           H        LYS   5   8.121  -1.444  -0.390
   44    HA   LYS   5           HA       LYS   5  10.960  -0.884  -0.720
   45   1HB   LYS   5          1HB       LYS   5  11.011  -3.400  -1.348
   46   2HB   LYS   5          2HB       LYS   5  11.159  -2.818   0.297
   47   1HG   LYS   5          1HG       LYS   5   8.742  -3.278   0.605
   48   2HG   LYS   5          2HG       LYS   5   8.741  -4.040  -0.989
   49   1HD   LYS   5          1HD       LYS   5  10.562  -5.484  -0.296
   50   2HD   LYS   5          2HD       LYS   5  10.511  -4.751   1.310
   51   1HE   LYS   5          1HE       LYS   5   8.195  -5.569   1.595
   52   2HE   LYS   5          2HE       LYS   5   8.271  -6.317   0.001
   53   1HZ   LYS   5          1HZ       LYS   5   9.597  -7.992   0.743
   54   2HZ   LYS   5          2HZ       LYS   5   8.771  -7.672   2.195
   55   3HZ   LYS   5          3HZ       LYS   5  10.335  -7.053   1.956
   56    H    TYR   6           H        TYR   6   8.602  -2.869  -2.573
   57    HA   TYR   6           HA       TYR   6   9.780  -1.692  -4.990
   58   1HB   TYR   6          1HB       TYR   6   7.921  -4.069  -4.865
   59   2HB   TYR   6          2HB       TYR   6   8.938  -3.564  -6.214
   60    HD1  TYR   6           HD1      TYR   6  11.565  -3.324  -5.472
   61    HD2  TYR   6           HD2      TYR   6   8.677  -5.907  -3.712
   62    HE1  TYR   6           HE1      TYR   6  13.356  -4.733  -4.582
   63    HE2  TYR   6           HE2      TYR   6  10.459  -7.318  -2.820
   64    HH   TYR   6           HH       TYR   6  13.417  -7.415  -3.882
   65    H    GLY   7           H        GLY   7   7.998  -1.859  -6.876
   66   1HA   GLY   7          1HA       GLY   7   5.722  -1.330  -7.464
   67   2HA   GLY   7          2HA       GLY   7   5.561  -0.463  -5.947
   68    H    ASN   8           H        ASN   8   4.934   1.462  -6.959
   69    HA   ASN   8           HA       ASN   8   7.036   2.704  -8.604
   70   1HB   ASN   8          1HB       ASN   8   5.374   4.044  -9.695
   71   2HB   ASN   8          2HB       ASN   8   4.833   2.370  -9.728
   72   1HD2  ASN   8          1HD2      ASN   8   3.394   4.971  -9.894
   73   2HD2  ASN   8          2HD2      ASN   8   2.181   4.879  -8.667
   74    H    ALA   9           H        ALA   9   6.639   2.605  -5.632
   75    HA   ALA   9           HA       ALA   9   6.421   5.437  -4.975
   76   1HB   ALA   9          1HB       ALA   9   6.912   3.588  -2.778
   77   2HB   ALA   9          2HB       ALA   9   5.446   3.235  -3.698
   78   3HB   ALA   9          3HB       ALA   9   5.667   4.826  -2.966
   79    H    ASP  10           H        ASP  10   8.492   2.757  -3.885
   80    HA   ASP  10           HA       ASP  10  10.678   2.615  -3.300
   81   1HB   ASP  10          1HB       ASP  10  10.784   4.259  -5.809
   82   2HB   ASP  10          2HB       ASP  10  12.257   3.815  -4.956
   83    H    GLY  11           H        GLY  11  10.936   3.528  -1.310
   84   1HA   GLY  11          1HA       GLY  11  12.352   5.004  -0.079
   85   2HA   GLY  11          2HA       GLY  11  12.140   6.204  -1.341
   86    H    GLU  12           H        GLU  12   9.133   5.362  -1.097
   87    HA   GLU  12           HA       GLU  12   8.506   7.462   0.799
   88   1HB   GLU  12          1HB       GLU  12   7.031   5.996  -1.340
   89   2HB   GLU  12          2HB       GLU  12   6.104   6.784  -0.069
   90   1HG   GLU  12          1HG       GLU  12   6.541   8.834  -0.841
   91   2HG   GLU  12          2HG       GLU  12   8.207   8.444  -1.240
   92    H    TYR  13           H        TYR  13   6.390   7.014   2.116
   93    HA   TYR  13           HA       TYR  13   6.748   4.482   3.521
   94   1HB   TYR  13          1HB       TYR  13   5.960   5.767   5.511
   95   2HB   TYR  13          2HB       TYR  13   7.561   6.162   4.904
   96    HD1  TYR  13           HD1      TYR  13   4.030   7.269   4.336
   97    HD2  TYR  13           HD2      TYR  13   8.106   8.324   4.862
   98    HE1  TYR  13           HE1      TYR  13   3.412   9.660   4.226
   99    HE2  TYR  13           HE2      TYR  13   7.519  10.714   4.758
  100    HH   TYR  13           HH       TYR  13   5.895  12.200   4.312
  101    H    CYS  14           H        CYS  14   4.789   3.744   4.752
  102    HA   CYS  14           HA       CYS  14   2.518   3.737   3.007
  103   1HB   CYS  14          1HB       CYS  14   2.915   2.566   5.768
  104   2HB   CYS  14          2HB       CYS  14   1.518   2.263   4.741
  105    H    LYS  15           H        LYS  15   0.583   4.793   3.273
  106    HA   LYS  15           HA       LYS  15   0.511   6.767   5.448
  107   1HB   LYS  15          1HB       LYS  15   0.315   7.436   2.962
  108   2HB   LYS  15          2HB       LYS  15  -1.291   6.728   3.030
  109   1HG   LYS  15          1HG       LYS  15  -1.406   9.129   3.338
  110   2HG   LYS  15          2HG       LYS  15  -1.907   8.293   4.813
  111   1HD   LYS  15          1HD       LYS  15   0.324   8.659   5.770
  112   2HD   LYS  15          2HD       LYS  15   0.815   9.492   4.293
  113   1HE   LYS  15          1HE       LYS  15  -1.382  10.350   6.168
  114   2HE   LYS  15          2HE       LYS  15   0.226  11.068   6.067
  115   1HZ   LYS  15          1HZ       LYS  15  -2.071  11.400   4.309
  116   2HZ   LYS  15          2HZ       LYS  15  -0.568  11.268   3.523
  117   3HZ   LYS  15          3HZ       LYS  15  -0.813  12.484   4.684
  118    H    PHE  16           H        PHE  16  -0.477   5.880   7.177
  119    HA   PHE  16           HA       PHE  16  -2.945   4.343   6.702
  120   1HB   PHE  16          1HB       PHE  16  -1.222   4.389   9.183
  121   2HB   PHE  16          2HB       PHE  16  -2.644   3.393   8.930
  122    HD1  PHE  16           HD1      PHE  16  -2.367   2.135   6.422
  123    HD2  PHE  16           HD2      PHE  16   0.682   3.169   9.203
  124    HE1  PHE  16           HE1      PHE  16  -0.957   0.332   5.542
  125    HE2  PHE  16           HE2      PHE  16   2.104   1.374   8.328
  126    HZ   PHE  16           HZ       PHE  16   1.297  -0.084   6.497
  127    HA   PRO  17           HA       PRO  17  -4.641   3.948   7.057
  128   1HB   PRO  17          1HB       PRO  17  -7.289   4.726   6.932
  129   2HB   PRO  17          2HB       PRO  17  -6.563   3.819   8.261
  130   1HG   PRO  17          1HG       PRO  17  -7.570   6.509   8.313
  131   2HG   PRO  17          2HG       PRO  17  -6.847   5.592   9.641
  132   1HD   PRO  17          1HD       PRO  17  -5.642   7.639   7.892
  133   2HD   PRO  17          2HD       PRO  17  -5.152   7.097   9.510
  134    H    PHE  18           H        PHE  18  -5.090   3.572   4.869
  135    HA   PHE  18           HA       PHE  18  -5.363   6.019   3.277
  136   1HB   PHE  18          1HB       PHE  18  -4.408   4.826   1.378
  137   2HB   PHE  18          2HB       PHE  18  -3.318   4.799   2.753
  138    HD1  PHE  18           HD1      PHE  18  -3.155   2.666   4.116
  139    HD2  PHE  18           HD2      PHE  18  -5.113   2.859   0.344
  140    HE1  PHE  18           HE1      PHE  18  -2.955   0.230   3.893
  141    HE2  PHE  18           HE2      PHE  18  -4.919   0.421   0.108
  142    HZ   PHE  18           HZ       PHE  18  -3.830  -0.917   1.879
  143    H    LEU  19           H        LEU  19  -6.627   5.850   1.271
  144    HA   LEU  19           HA       LEU  19  -9.072   4.327   1.813
  145   1HB   LEU  19          1HB       LEU  19  -9.191   6.792   1.577
  146   2HB   LEU  19          2HB       LEU  19  -8.626   6.631  -0.073
  147    HG   LEU  19           HG       LEU  19 -10.651   5.232  -0.545
  148   1HD1  LEU  19          1HD1      LEU  19 -12.051   6.367   1.776
  149   2HD1  LEU  19          2HD1      LEU  19 -10.916   5.063   2.133
  150   3HD1  LEU  19          3HD1      LEU  19 -12.231   4.800   0.987
  151   1HD2  LEU  19          1HD2      LEU  19 -11.530   7.101  -1.362
  152   2HD2  LEU  19          2HD2      LEU  19 -10.320   7.997  -0.441
  153   3HD2  LEU  19          3HD2      LEU  19 -11.916   7.695   0.254
  154    H    PHE  20           H        PHE  20  -9.336   2.501   0.773
  155    HA   PHE  20           HA       PHE  20  -8.340   2.269  -1.995
  156   1HB   PHE  20          1HB       PHE  20  -7.203   0.765  -0.264
  157   2HB   PHE  20          2HB       PHE  20  -8.776   0.007  -0.071
  158    HD1  PHE  20           HD1      PHE  20  -6.955   1.059  -3.156
  159    HD2  PHE  20           HD2      PHE  20  -8.732  -2.056  -0.875
  160    HE1  PHE  20           HE1      PHE  20  -6.510  -0.537  -4.979
  161    HE2  PHE  20           HE2      PHE  20  -8.293  -3.661  -2.690
  162    HZ   PHE  20           HZ       PHE  20  -7.190  -2.897  -4.753
  163    H    ASN  21           H        ASN  21 -10.130   2.665  -3.166
  164    HA   ASN  21           HA       ASN  21 -12.230   2.493  -4.028
  165   1HB   ASN  21          1HB       ASN  21 -11.801  -0.327  -3.045
  166   2HB   ASN  21          2HB       ASN  21 -13.210   0.149  -3.985
  167   1HD2  ASN  21          1HD2      ASN  21 -10.937   2.116  -5.111
  168   2HD2  ASN  21          2HD2      ASN  21 -10.308   1.167  -6.410
  169    H    GLY  22           H        GLY  22 -12.078   3.429  -1.258
  170   1HA   GLY  22          1HA       GLY  22 -13.943   4.297  -0.074
  171   2HA   GLY  22          2HA       GLY  22 -14.881   2.906  -0.587
  172    H    LYS  23           H        LYS  23 -11.912   1.794   0.468
  173    HA   LYS  23           HA       LYS  23 -12.981   1.408   3.189
  174   1HB   LYS  23          1HB       LYS  23 -12.993  -0.660   1.780
  175   2HB   LYS  23          2HB       LYS  23 -11.246  -0.532   1.641
  176   1HG   LYS  23          1HG       LYS  23 -11.035  -0.806   4.066
  177   2HG   LYS  23          2HG       LYS  23 -12.791  -0.933   4.205
  178   1HD   LYS  23          1HD       LYS  23 -12.758  -2.926   2.788
  179   2HD   LYS  23          2HD       LYS  23 -11.004  -2.794   2.643
  180   1HE   LYS  23          1HE       LYS  23 -10.788  -3.085   5.066
  181   2HE   LYS  23          2HE       LYS  23 -12.541  -3.225   5.204
  182   1HZ   LYS  23          1HZ       LYS  23 -11.204  -5.366   5.126
  183   2HZ   LYS  23          2HZ       LYS  23 -10.962  -5.041   3.477
  184   3HZ   LYS  23          3HZ       LYS  23 -12.539  -5.255   4.076
  185    H    GLU  24           H        GLU  24 -11.667   1.895   4.865
  186    HA   GLU  24           HA       GLU  24  -9.050   3.013   4.187
  187   1HB   GLU  24          1HB       GLU  24 -10.684   3.239   6.717
  188   2HB   GLU  24          2HB       GLU  24  -9.162   4.066   6.412
  189   1HG   GLU  24          1HG       GLU  24 -10.170   5.292   4.591
  190   2HG   GLU  24          2HG       GLU  24 -11.682   4.417   4.811
  191    H    TYR  25           H        TYR  25  -7.203   2.063   4.712
  192    HA   TYR  25           HA       TYR  25  -7.280  -0.273   6.507
  193   1HB   TYR  25          1HB       TYR  25  -5.438   0.353   4.219
  194   2HB   TYR  25          2HB       TYR  25  -5.232  -1.025   5.279
  195    HD1  TYR  25           HD1      TYR  25  -7.286  -2.652   5.415
  196    HD2  TYR  25           HD2      TYR  25  -6.622   0.142   2.284
  197    HE1  TYR  25           HE1      TYR  25  -8.778  -3.955   3.932
  198    HE2  TYR  25           HE2      TYR  25  -8.103  -1.147   0.797
  199    HH   TYR  25           HH       TYR  25  -9.248  -4.294   1.636
  200    H    ASN  26           H        ASN  26  -6.092  -0.249   8.298
  201    HA   ASN  26           HA       ASN  26  -4.187   1.961   8.685
  202   1HB   ASN  26          1HB       ASN  26  -5.842   0.328  10.559
  203   2HB   ASN  26          2HB       ASN  26  -4.316   0.981  11.142
  204   1HD2  ASN  26          1HD2      ASN  26  -7.553   1.602  10.521
  205   2HD2  ASN  26          2HD2      ASN  26  -7.548   3.307  10.804
  206    H    SER  27           H        SER  27  -4.103  -0.890   7.431
  207    HA   SER  27           HA       SER  27  -1.364  -1.396   8.191
  208   1HB   SER  27          1HB       SER  27  -1.779  -3.819   8.610
  209   2HB   SER  27          2HB       SER  27  -2.543  -2.781   9.821
  210    HG   SER  27           HG       SER  27  -3.679  -4.603   8.250
  211    H    CYS  28           H        CYS  28  -0.407  -3.085   6.727
  212    HA   CYS  28           HA       CYS  28  -1.135  -2.521   4.032
  213   1HB   CYS  28          1HB       CYS  28   0.706  -4.687   5.090
  214   2HB   CYS  28          2HB       CYS  28   0.673  -4.053   3.443
  215    H    THR  29           H        THR  29  -2.380  -3.694   2.618
  216    HA   THR  29           HA       THR  29  -3.527  -6.186   3.646
  217    HB   THR  29           HB       THR  29  -5.149  -4.333   3.662
  218    HG1  THR  29           HG1      THR  29  -6.060  -6.309   3.300
  219   1HG2  THR  29          1HG2      THR  29  -4.041  -3.492   1.286
  220   2HG2  THR  29          2HG2      THR  29  -5.555  -2.919   1.990
  221   3HG2  THR  29          3HG2      THR  29  -5.575  -4.210   0.789
  222    H    ASP  30           H        ASP  30  -4.335  -7.674   1.920
  223    HA   ASP  30           HA       ASP  30  -2.490  -7.631  -0.347
  224   1HB   ASP  30          1HB       ASP  30  -3.997 -10.061  -0.053
  225   2HB   ASP  30          2HB       ASP  30  -2.277  -9.849  -0.220
  226    H    THR  31           H        THR  31  -5.372  -6.544   0.295
  227    HA   THR  31           HA       THR  31  -7.137  -7.693  -1.573
  228    HB   THR  31           HB       THR  31  -7.132  -4.826  -0.635
  229    HG1  THR  31           HG1      THR  31  -7.007  -6.057   1.212
  230   1HG2  THR  31          1HG2      THR  31  -9.320  -4.680  -1.160
  231   2HG2  THR  31          2HG2      THR  31  -9.618  -6.396  -0.881
  232   3HG2  THR  31          3HG2      THR  31  -8.839  -5.869  -2.371
  233    H    GLY  32           H        GLY  32  -7.541  -7.251  -3.694
  234   1HA   GLY  32          1HA       GLY  32  -7.397  -6.124  -5.721
  235   2HA   GLY  32          2HA       GLY  32  -6.257  -5.010  -4.987
  236    H    ARG  33           H        ARG  33  -4.858  -7.583  -3.970
  237    HA   ARG  33           HA       ARG  33  -3.159  -7.869  -6.335
  238   1HB   ARG  33          1HB       ARG  33  -2.704  -8.707  -3.462
  239   2HB   ARG  33          2HB       ARG  33  -1.539  -8.888  -4.763
  240   1HG   ARG  33          1HG       ARG  33  -2.626  -6.279  -3.723
  241   2HG   ARG  33          2HG       ARG  33  -1.042  -6.958  -3.349
  242   1HD   ARG  33          1HD       ARG  33  -2.018  -6.164  -6.096
  243   2HD   ARG  33          2HD       ARG  33  -0.915  -5.221  -5.090
  244    HE   ARG  33           HE       ARG  33   0.073  -7.861  -5.515
  245   1HH1  ARG  33          1HH1      ARG  33  -0.267  -4.730  -6.997
  246   2HH1  ARG  33          2HH1      ARG  33   1.046  -4.964  -8.110
  247   1HH2  ARG  33          1HH2      ARG  33   1.802  -8.201  -6.983
  248   2HH2  ARG  33          2HH2      ARG  33   2.199  -6.963  -8.133
  249    H    SER  34           H        SER  34  -2.258 -10.060  -6.761
  250    HA   SER  34           HA       SER  34  -4.404 -12.046  -6.469
  251   1HB   SER  34          1HB       SER  34  -2.177 -12.060  -8.511
  252   2HB   SER  34          2HB       SER  34  -3.653 -13.028  -8.518
  253    HG   SER  34           HG       SER  34  -4.802 -11.320  -9.148
  254    H    ASP  35           H        ASP  35  -1.049 -11.432  -5.806
  255    HA   ASP  35           HA       ASP  35  -0.622 -14.202  -5.090
  256   1HB   ASP  35          1HB       ASP  35   1.177 -11.920  -5.574
  257   2HB   ASP  35          2HB       ASP  35   1.761 -13.337  -4.737
  258    H    GLY  36           H        GLY  36  -2.075 -11.980  -3.491
  259   1HA   GLY  36          1HA       GLY  36  -2.364 -11.471  -1.279
  260   2HA   GLY  36          2HA       GLY  36  -1.562 -12.998  -0.954
  261    H    PHE  37           H        PHE  37  -0.408  -9.910  -2.324
  262    HA   PHE  37           HA       PHE  37   1.793 -10.007  -0.386
  263   1HB   PHE  37          1HB       PHE  37   1.458  -8.609  -3.031
  264   2HB   PHE  37          2HB       PHE  37   2.711  -8.125  -1.899
  265    HD1  PHE  37           HD1      PHE  37   3.735  -8.784  -4.354
  266    HD2  PHE  37           HD2      PHE  37   2.451 -11.487  -1.327
  267    HE1  PHE  37           HE1      PHE  37   5.221 -10.521  -5.271
  268    HE2  PHE  37           HE2      PHE  37   3.933 -13.221  -2.241
  269    HZ   PHE  37           HZ       PHE  37   5.319 -12.739  -4.220
  270    H    LEU  38           H        LEU  38   2.072  -8.444   1.113
  271    HA   LEU  38           HA       LEU  38  -0.165  -6.734   1.665
  272   1HB   LEU  38          1HB       LEU  38   2.485  -7.046   3.018
  273   2HB   LEU  38          2HB       LEU  38   1.189  -6.044   3.629
  274    HG   LEU  38           HG       LEU  38   1.082  -9.049   3.286
  275   1HD1  LEU  38          1HD1      LEU  38   2.506  -8.559   5.117
  276   2HD1  LEU  38          2HD1      LEU  38   0.931  -8.967   5.800
  277   3HD1  LEU  38          3HD1      LEU  38   1.439  -7.280   5.696
  278   1HD2  LEU  38          1HD2      LEU  38  -1.000  -7.156   3.421
  279   2HD2  LEU  38          2HD2      LEU  38  -0.931  -7.954   4.992
  280   3HD2  LEU  38          3HD2      LEU  38  -1.120  -8.912   3.521
  281    H    TRP  39           H        TRP  39  -0.434  -4.819   0.757
  282    HA   TRP  39           HA       TRP  39   1.975  -3.235   0.200
  283   1HB   TRP  39          1HB       TRP  39   0.967  -2.373  -1.840
  284   2HB   TRP  39          2HB       TRP  39   1.051  -4.124  -1.907
  285    HD1  TRP  39           HD1      TRP  39  -1.300  -5.476  -1.703
  286    HE1  TRP  39           HE1      TRP  39  -3.700  -4.755  -2.251
  287    HE3  TRP  39           HE3      TRP  39  -0.633  -0.409  -1.824
  288    HZ2  TRP  39           HZ2      TRP  39  -5.121  -2.363  -2.687
  289    HZ3  TRP  39           HZ3      TRP  39  -2.572   1.017  -2.326
  290    HH2  TRP  39           HH2      TRP  39  -4.765   0.053  -2.744
  291    H    CYS  40           H        CYS  40   1.430  -0.909  -0.171
  292    HA   CYS  40           HA       CYS  40  -0.887   0.111   1.263
  293   1HB   CYS  40          1HB       CYS  40   0.433   1.395   2.849
  294   2HB   CYS  40          2HB       CYS  40   0.867  -0.308   3.003
  295    H    SER  41           H        SER  41  -1.067   2.489   0.913
  296    HA   SER  41           HA       SER  41   0.446   3.287  -1.476
  297   1HB   SER  41          1HB       SER  41  -1.436   4.949  -1.810
  298   2HB   SER  41          2HB       SER  41  -1.912   3.255  -1.947
  299    HG   SER  41           HG       SER  41  -2.653   5.156  -0.098
  300    H    THR  42           H        THR  42   1.254   5.472  -1.568
  301    HA   THR  42           HA       THR  42   2.083   6.429   1.044
  302    HB   THR  42           HB       THR  42   2.749   7.586  -1.674
  303    HG1  THR  42           HG1      THR  42   4.162   5.584  -0.241
  304   1HG2  THR  42          1HG2      THR  42   4.508   7.559   0.749
  305   2HG2  THR  42          2HG2      THR  42   3.342   8.853   0.466
  306   3HG2  THR  42          3HG2      THR  42   4.629   8.552  -0.703
  307    H    THR  43           H        THR  43  -0.222   7.090  -1.392
  308    HA   THR  43           HA       THR  43  -0.832   9.730  -0.278
  309    HB   THR  43           HB       THR  43  -2.300   9.924  -2.311
  310    HG1  THR  43           HG1      THR  43  -2.653   8.210  -3.442
  311   1HG2  THR  43          1HG2      THR  43   0.630   9.607  -2.425
  312   2HG2  THR  43          2HG2      THR  43  -0.388  10.972  -2.888
  313   3HG2  THR  43          3HG2      THR  43  -0.230   9.585  -3.965
  314    H    TYR  44           H        TYR  44  -3.282  10.181  -0.183
  315    HA   TYR  44           HA       TYR  44  -4.405   8.235   1.573
  316   1HB   TYR  44          1HB       TYR  44  -4.735  10.697   1.835
  317   2HB   TYR  44          2HB       TYR  44  -5.756  10.675   0.397
  318    HD1  TYR  44           HD1      TYR  44  -5.483   8.618   3.528
  319    HD2  TYR  44           HD2      TYR  44  -8.015  10.802   0.898
  320    HE1  TYR  44           HE1      TYR  44  -7.418   8.054   4.929
  321    HE2  TYR  44           HE2      TYR  44  -9.957  10.248   2.299
  322    HH   TYR  44           HH       TYR  44 -10.027   7.852   4.479
  323    H    ASN  45           H        ASN  45  -5.365   9.481  -1.626
  324    HA   ASN  45           HA       ASN  45  -7.207   7.231  -1.858
  325   1HB   ASN  45          1HB       ASN  45  -7.875   9.645  -2.408
  326   2HB   ASN  45          2HB       ASN  45  -6.866   9.493  -3.825
  327   1HD2  ASN  45          1HD2      ASN  45  -7.908   6.534  -3.855
  328   2HD2  ASN  45          2HD2      ASN  45  -9.411   6.780  -4.601
  329    H    PHE  46           H        PHE  46  -6.324   5.419  -2.689
  330    HA   PHE  46           HA       PHE  46  -3.922   5.429  -4.230
  331   1HB   PHE  46          1HB       PHE  46  -4.410   3.567  -2.763
  332   2HB   PHE  46          2HB       PHE  46  -5.920   3.227  -3.644
  333    HD1  PHE  46           HD1      PHE  46  -2.245   3.655  -4.409
  334    HD2  PHE  46           HD2      PHE  46  -5.821   1.446  -5.113
  335    HE1  PHE  46           HE1      PHE  46  -1.029   2.150  -5.914
  336    HE2  PHE  46           HE2      PHE  46  -4.596  -0.064  -6.612
  337    HZ   PHE  46           HZ       PHE  46  -2.199   0.285  -7.013
  338    H    GLU  47           H        GLU  47  -7.293   5.453  -5.045
  339    HA   GLU  47           HA       GLU  47  -7.196   4.372  -7.616
  340   1HB   GLU  47          1HB       GLU  47  -9.227   4.877  -6.206
  341   2HB   GLU  47          2HB       GLU  47  -9.067   6.554  -6.697
  342   1HG   GLU  47          1HG       GLU  47  -9.395   5.935  -9.008
  343   2HG   GLU  47          2HG       GLU  47  -9.489   4.230  -8.556
  344    H    LYS  48           H        LYS  48  -7.176   7.838  -6.718
  345    HA   LYS  48           HA       LYS  48  -6.736   8.644  -9.404
  346   1HB   LYS  48          1HB       LYS  48  -6.403  10.925  -8.440
  347   2HB   LYS  48          2HB       LYS  48  -7.927  10.159  -8.021
  348   1HG   LYS  48          1HG       LYS  48  -7.232   9.753  -5.802
  349   2HG   LYS  48          2HG       LYS  48  -5.544  10.098  -6.190
  350   1HD   LYS  48          1HD       LYS  48  -7.770  12.127  -6.341
  351   2HD   LYS  48          2HD       LYS  48  -6.702  11.927  -4.951
  352   1HE   LYS  48          1HE       LYS  48  -4.768  12.445  -6.328
  353   2HE   LYS  48          2HE       LYS  48  -5.795  12.567  -7.755
  354   1HZ   LYS  48          1HZ       LYS  48  -6.882  14.467  -6.846
  355   2HZ   LYS  48          2HZ       LYS  48  -5.208  14.740  -6.758
  356   3HZ   LYS  48          3HZ       LYS  48  -6.071  14.309  -5.356
  357    H    ASP  49           H        ASP  49  -4.539   8.534  -6.578
  358    HA   ASP  49           HA       ASP  49  -2.361   9.573  -8.125
  359   1HB   ASP  49          1HB       ASP  49  -2.409   8.321  -5.376
  360   2HB   ASP  49          2HB       ASP  49  -0.983   9.044  -6.117
  361    H    GLY  50           H        GLY  50  -2.980   6.381  -6.657
  362   1HA   GLY  50          1HA       GLY  50  -2.490   4.293  -7.567
  363   2HA   GLY  50          2HA       GLY  50  -1.724   5.107  -8.921
  364    H    LYS  51           H        LYS  51  -0.557   6.368  -6.046
  365    HA   LYS  51           HA       LYS  51   1.983   5.087  -6.428
  366   1HB   LYS  51          1HB       LYS  51   0.992   7.205  -4.586
  367   2HB   LYS  51          2HB       LYS  51   2.607   6.519  -4.422
  368   1HG   LYS  51          1HG       LYS  51   3.270   7.318  -6.501
  369   2HG   LYS  51          2HG       LYS  51   1.609   7.574  -7.028
  370   1HD   LYS  51          1HD       LYS  51   2.533   9.684  -6.584
  371   2HD   LYS  51          2HD       LYS  51   1.416   9.312  -5.277
  372   1HE   LYS  51          1HE       LYS  51   3.492  10.324  -4.439
  373   2HE   LYS  51          2HE       LYS  51   3.262   8.687  -3.833
  374   1HZ   LYS  51          1HZ       LYS  51   5.313   8.291  -4.547
  375   2HZ   LYS  51          2HZ       LYS  51   5.385   9.748  -5.424
  376   3HZ   LYS  51          3HZ       LYS  51   4.710   8.363  -6.138
  377    H    TYR  52           H        TYR  52   2.473   3.152  -5.567
  378    HA   TYR  52           HA       TYR  52   1.637   2.562  -2.850
  379   1HB   TYR  52          1HB       TYR  52   0.617   0.482  -3.408
  380   2HB   TYR  52          2HB       TYR  52  -0.094   1.679  -4.489
  381    HD1  TYR  52           HD1      TYR  52   2.016  -1.291  -4.260
  382    HD2  TYR  52           HD2      TYR  52   0.523   1.707  -6.892
  383    HE1  TYR  52           HE1      TYR  52   2.703  -2.650  -6.188
  384    HE2  TYR  52           HE2      TYR  52   1.202   0.347  -8.825
  385    HH   TYR  52           HH       TYR  52   2.962  -1.483  -9.273
  386    H    GLY  53           H        GLY  53   2.563   0.364  -2.242
  387   1HA   GLY  53          1HA       GLY  53   4.822  -0.622  -3.633
  388   2HA   GLY  53          2HA       GLY  53   5.307   0.385  -2.285
  389    H    PHE  54           H        PHE  54   5.962  -2.292  -2.345
  390    HA   PHE  54           HA       PHE  54   3.977  -3.678  -0.769
  391   1HB   PHE  54          1HB       PHE  54   6.688  -4.558  -1.748
  392   2HB   PHE  54          2HB       PHE  54   5.568  -5.592  -0.873
  393    HD1  PHE  54           HD1      PHE  54   6.553  -6.434  -3.456
  394    HD2  PHE  54           HD2      PHE  54   3.273  -3.895  -2.515
  395    HE1  PHE  54           HE1      PHE  54   5.489  -7.019  -5.595
  396    HE2  PHE  54           HE2      PHE  54   2.199  -4.474  -4.646
  397    HZ   PHE  54           HZ       PHE  54   3.311  -6.036  -6.196
  398    H    CYS  55           H        CYS  55   4.261  -4.392   1.351
  399    HA   CYS  55           HA       CYS  55   5.999  -2.649   2.907
  400   1HB   CYS  55          1HB       CYS  55   3.934  -4.631   3.880
  401   2HB   CYS  55          2HB       CYS  55   4.689  -3.342   4.812
  402    HA   PRO  56           HA       PRO  56   8.806  -6.017   3.764
  403   1HB   PRO  56          1HB       PRO  56  10.538  -4.462   5.204
  404   2HB   PRO  56          2HB       PRO  56  10.500  -4.516   3.445
  405   1HG   PRO  56          1HG       PRO  56   9.788  -2.329   5.175
  406   2HG   PRO  56          2HG       PRO  56   9.814  -2.365   3.405
  407   1HD   PRO  56          1HD       PRO  56   7.540  -2.650   5.255
  408   2HD   PRO  56          2HD       PRO  56   7.548  -2.208   3.533
  409    H    HIS  57           H        HIS  57  10.326  -5.585   6.273
  410    HA   HIS  57           HA       HIS  57  10.332  -6.528   8.313
  411   1HB   HIS  57          1HB       HIS  57   8.698  -5.404   9.958
  412   2HB   HIS  57          2HB       HIS  57   9.925  -4.430   9.168
  413    HD1  HIS  57           HD1      HIS  57   6.195  -5.133   8.986
  414    HD2  HIS  57           HD2      HIS  57   8.967  -2.261   7.806
  415    HE1  HIS  57           HE1      HIS  57   4.844  -3.221   8.076
  416    H    GLU  58           H        GLU  58   6.787  -6.232   8.053
  417    HA   GLU  58           HA       GLU  58   6.405  -8.772   9.299
  418   1HB   GLU  58          1HB       GLU  58   4.014  -8.435   8.763
  419   2HB   GLU  58          2HB       GLU  58   4.716  -7.038   9.556
  420   1HG   GLU  58          1HG       GLU  58   4.888  -5.901   7.401
  421   2HG   GLU  58          2HG       GLU  58   4.203  -7.316   6.601
  422    H    ALA  59           H        ALA  59   6.876  -7.704   6.049
  423    HA   ALA  59           HA       ALA  59   6.766 -10.458   5.115
  424   1HB   ALA  59          1HB       ALA  59   4.704  -8.529   4.527
  425   2HB   ALA  59          2HB       ALA  59   4.777 -10.246   4.133
  426   3HB   ALA  59          3HB       ALA  59   5.511  -9.063   3.050
  Start of MODEL   21
    1   1H    ARG   1          1H        ARG   1  14.785   5.629   4.163
    2   2H    ARG   1          2H        ARG   1  14.739   5.494   5.872
    3   3H    ARG   1          3H        ARG   1  14.036   6.860   5.099
    4    HA   ARG   1           HA       ARG   1  12.466   5.177   5.886
    5   1HB   ARG   1          1HB       ARG   1  12.622   5.855   2.995
    6   2HB   ARG   1          2HB       ARG   1  11.193   5.172   3.729
    7   1HG   ARG   1          1HG       ARG   1  11.210   7.146   5.305
    8   2HG   ARG   1          2HG       ARG   1  12.455   7.851   4.267
    9   1HD   ARG   1          1HD       ARG   1  10.992   8.000   2.435
   10   2HD   ARG   1          2HD       ARG   1   9.826   6.897   3.159
   11    HE   ARG   1           HE       ARG   1   8.930   8.650   4.361
   12   1HH1  ARG   1          1HH1      ARG   1  11.858   9.693   2.745
   13   2HH1  ARG   1          2HH1      ARG   1  11.631  11.367   3.140
   14   1HH2  ARG   1          1HH2      ARG   1   8.638  10.827   4.885
   15   2HH2  ARG   1          2HH2      ARG   1   9.812  12.009   4.389
   16    H    ILE   2           H        ILE   2  11.467   3.098   5.482
   17    HA   ILE   2           HA       ILE   2  12.845   1.256   3.766
   18    HB   ILE   2           HB       ILE   2  14.182   1.347   5.876
   19   1HG1  ILE   2          1HG1      ILE   2  14.360  -1.144   6.096
   20   2HG1  ILE   2          2HG1      ILE   2  12.947  -1.285   5.053
   21   1HG2  ILE   2          1HG2      ILE   2  11.598   0.462   7.002
   22   2HG2  ILE   2          2HG2      ILE   2  12.856   1.475   7.703
   23   3HG2  ILE   2          3HG2      ILE   2  13.064  -0.274   7.654
   24   1HD1  ILE   2          1HD1      ILE   2  14.160  -0.975   3.220
   25   2HD1  ILE   2          2HD1      ILE   2  15.571  -1.232   4.244
   26   3HD1  ILE   2          3HD1      ILE   2  15.013   0.407   3.917
   27    HA   PRO   3           HA       PRO   3   8.767  -0.724   5.895
   28   1HB   PRO   3          1HB       PRO   3   6.735   1.144   5.510
   29   2HB   PRO   3          2HB       PRO   3   7.448   0.673   7.051
   30   1HG   PRO   3          1HG       PRO   3   8.042   3.034   5.337
   31   2HG   PRO   3          2HG       PRO   3   8.000   2.904   7.105
   32   1HD   PRO   3          1HD       PRO   3  10.329   2.991   5.802
   33   2HD   PRO   3          2HD       PRO   3  10.122   1.940   7.218
   34    H    VAL   4           H        VAL   4   9.084   1.373   3.083
   35    HA   VAL   4           HA       VAL   4   7.159  -0.385   1.673
   36    HB   VAL   4           HB       VAL   4   8.201   2.334   0.754
   37   1HG1  VAL   4          1HG1      VAL   4   6.148   0.472  -0.446
   38   2HG1  VAL   4          2HG1      VAL   4   7.734   0.862  -1.118
   39   3HG1  VAL   4          3HG1      VAL   4   6.493   2.110  -1.005
   40   1HG2  VAL   4          1HG2      VAL   4   5.990   3.199   1.193
   41   2HG2  VAL   4          2HG2      VAL   4   6.570   2.433   2.672
   42   3HG2  VAL   4          3HG2      VAL   4   5.398   1.604   1.652
   43    H    LYS   5           H        LYS   5   7.777  -1.732   0.195
   44    HA   LYS   5           HA       LYS   5  10.579  -2.122  -0.305
   45   1HB   LYS   5          1HB       LYS   5   8.066  -3.619  -0.880
   46   2HB   LYS   5          2HB       LYS   5   9.488  -3.991  -1.840
   47   1HG   LYS   5          1HG       LYS   5   9.227  -4.227   1.155
   48   2HG   LYS   5          2HG       LYS   5   9.236  -5.542  -0.030
   49   1HD   LYS   5          1HD       LYS   5  11.526  -5.081  -0.610
   50   2HD   LYS   5          2HD       LYS   5  11.554  -3.674   0.458
   51   1HE   LYS   5          1HE       LYS   5  11.166  -6.548   1.303
   52   2HE   LYS   5          2HE       LYS   5  12.627  -5.588   1.520
   53   1HZ   LYS   5          1HZ       LYS   5  11.506  -4.166   3.038
   54   2HZ   LYS   5          2HZ       LYS   5  11.173  -5.767   3.519
   55   3HZ   LYS   5          3HZ       LYS   5   9.996  -4.868   2.705
   56    H    TYR   6           H        TYR   6   8.509  -2.956  -2.913
   57    HA   TYR   6           HA       TYR   6   9.863  -0.963  -4.597
   58   1HB   TYR   6          1HB       TYR   6   8.577  -3.407  -5.749
   59   2HB   TYR   6          2HB       TYR   6   9.971  -2.502  -6.328
   60    HD1  TYR   6           HD1      TYR   6   8.842  -5.119  -4.002
   61    HD2  TYR   6           HD2      TYR   6  12.211  -2.962  -5.462
   62    HE1  TYR   6           HE1      TYR   6  10.336  -6.755  -2.953
   63    HE2  TYR   6           HE2      TYR   6  13.707  -4.594  -4.422
   64    HH   TYR   6           HH       TYR   6  13.291  -7.294  -3.735
   65    H    GLY   7           H        GLY   7   8.697  -0.354  -6.563
   66   1HA   GLY   7          1HA       GLY   7   6.503  -0.288  -7.675
   67   2HA   GLY   7          2HA       GLY   7   5.790   0.029  -6.110
   68    H    ASN   8           H        ASN   8   5.262   1.675  -8.069
   69    HA   ASN   8           HA       ASN   8   6.985   3.800  -8.556
   70   1HB   ASN   8          1HB       ASN   8   5.109   5.060  -9.398
   71   2HB   ASN   8          2HB       ASN   8   5.024   3.388  -9.934
   72   1HD2  ASN   8          1HD2      ASN   8   2.881   5.080 -10.042
   73   2HD2  ASN   8          2HD2      ASN   8   1.671   4.543  -8.932
   74    H    ALA   9           H        ALA   9   5.395   3.181  -5.657
   75    HA   ALA   9           HA       ALA   9   5.116   5.837  -4.667
   76   1HB   ALA   9          1HB       ALA   9   5.577   3.764  -2.674
   77   2HB   ALA   9          2HB       ALA   9   4.269   3.410  -3.804
   78   3HB   ALA   9          3HB       ALA   9   4.235   4.895  -2.852
   79    H    ASP  10           H        ASP  10   7.791   3.839  -5.182
   80    HA   ASP  10           HA       ASP  10  10.020   4.079  -4.827
   81   1HB   ASP  10          1HB       ASP  10   9.759   6.485  -5.233
   82   2HB   ASP  10          2HB       ASP  10   9.305   6.730  -3.549
   83    H    GLY  11           H        GLY  11   8.831   5.748  -1.950
   84   1HA   GLY  11          1HA       GLY  11   8.698   3.627  -0.205
   85   2HA   GLY  11          2HA       GLY  11  10.383   4.107  -0.212
   86    H    GLU  12           H        GLU  12   7.698   6.389  -0.561
   87    HA   GLU  12           HA       GLU  12   8.676   7.921   1.669
   88   1HB   GLU  12          1HB       GLU  12   6.180   8.265   0.003
   89   2HB   GLU  12          2HB       GLU  12   6.759   9.413   1.195
   90   1HG   GLU  12          1HG       GLU  12   8.233   8.615  -1.304
   91   2HG   GLU  12          2HG       GLU  12   7.275  10.085  -1.096
   92    H    TYR  13           H        TYR  13   8.024   5.458   2.688
   93    HA   TYR  13           HA       TYR  13   6.956   4.446   4.396
   94   1HB   TYR  13          1HB       TYR  13   6.466   7.310   4.889
   95   2HB   TYR  13          2HB       TYR  13   5.369   6.206   5.717
   96    HD1  TYR  13           HD1      TYR  13   9.013   6.781   5.141
   97    HD2  TYR  13           HD2      TYR  13   6.005   5.286   7.746
   98    HE1  TYR  13           HE1      TYR  13  10.714   6.369   6.857
   99    HE2  TYR  13           HE2      TYR  13   7.700   4.873   9.474
  100    HH   TYR  13           HH       TYR  13   9.999   5.762  10.069
  101    H    CYS  14           H        CYS  14   4.820   3.875   5.363
  102    HA   CYS  14           HA       CYS  14   2.868   3.643   3.232
  103   1HB   CYS  14          1HB       CYS  14   3.147   2.291   5.914
  104   2HB   CYS  14          2HB       CYS  14   1.726   2.089   4.901
  105    H    LYS  15           H        LYS  15   0.906   4.618   3.250
  106    HA   LYS  15           HA       LYS  15   0.478   6.657   5.276
  107   1HB   LYS  15          1HB       LYS  15   0.144   7.308   2.954
  108   2HB   LYS  15          2HB       LYS  15  -1.026   6.015   2.729
  109   1HG   LYS  15          1HG       LYS  15  -2.067   8.243   2.976
  110   2HG   LYS  15          2HG       LYS  15  -2.591   7.093   4.207
  111   1HD   LYS  15          1HD       LYS  15  -1.053   8.090   5.812
  112   2HD   LYS  15          2HD       LYS  15  -0.468   9.207   4.575
  113   1HE   LYS  15          1HE       LYS  15  -2.585  10.303   4.453
  114   2HE   LYS  15          2HE       LYS  15  -3.351   9.069   5.454
  115   1HZ   LYS  15          1HZ       LYS  15  -2.889  10.324   7.202
  116   2HZ   LYS  15          2HZ       LYS  15  -2.006  11.427   6.257
  117   3HZ   LYS  15          3HZ       LYS  15  -1.229  10.075   6.928
  118    H    PHE  16           H        PHE  16  -0.451   6.061   7.087
  119    HA   PHE  16           HA       PHE  16  -2.685   4.143   6.962
  120   1HB   PHE  16          1HB       PHE  16  -0.642   4.573   9.162
  121   2HB   PHE  16          2HB       PHE  16  -2.092   3.596   9.350
  122    HD1  PHE  16           HD1      PHE  16   0.610   2.529   9.803
  123    HD2  PHE  16           HD2      PHE  16  -1.712   2.746   6.255
  124    HE1  PHE  16           HE1      PHE  16   1.806   0.582   8.913
  125    HE2  PHE  16           HE2      PHE  16  -0.529   0.808   5.344
  126    HZ   PHE  16           HZ       PHE  16   1.250  -0.305   6.665
  127    HA   PRO  17           HA       PRO  17  -4.318   3.943   6.963
  128   1HB   PRO  17          1HB       PRO  17  -6.931   4.566   6.655
  129   2HB   PRO  17          2HB       PRO  17  -6.284   3.858   8.139
  130   1HG   PRO  17          1HG       PRO  17  -7.268   6.581   7.665
  131   2HG   PRO  17          2HG       PRO  17  -6.992   5.749   9.202
  132   1HD   PRO  17          1HD       PRO  17  -5.295   7.673   7.848
  133   2HD   PRO  17          2HD       PRO  17  -5.100   6.960   9.462
  134    H    PHE  18           H        PHE  18  -4.807   3.564   4.770
  135    HA   PHE  18           HA       PHE  18  -4.820   6.000   3.126
  136   1HB   PHE  18          1HB       PHE  18  -3.920   4.671   1.279
  137   2HB   PHE  18          2HB       PHE  18  -2.869   4.586   2.685
  138    HD1  PHE  18           HD1      PHE  18  -2.849   2.499   4.062
  139    HD2  PHE  18           HD2      PHE  18  -4.894   2.753   0.339
  140    HE1  PHE  18           HE1      PHE  18  -2.889   0.048   3.925
  141    HE2  PHE  18           HE2      PHE  18  -4.938   0.303   0.187
  142    HZ   PHE  18           HZ       PHE  18  -3.926  -1.072   1.975
  143    H    LEU  19           H        LEU  19  -6.148   6.012   1.221
  144    HA   LEU  19           HA       LEU  19  -8.665   4.652   1.736
  145   1HB   LEU  19          1HB       LEU  19  -8.468   7.147   1.369
  146   2HB   LEU  19          2HB       LEU  19  -8.108   6.789  -0.310
  147    HG   LEU  19           HG       LEU  19 -10.322   5.620  -0.452
  148   1HD1  LEU  19          1HD1      LEU  19 -11.015   5.079   1.660
  149   2HD1  LEU  19          2HD1      LEU  19 -11.913   6.576   1.408
  150   3HD1  LEU  19          3HD1      LEU  19 -10.430   6.585   2.363
  151   1HD2  LEU  19          1HD2      LEU  19 -11.428   8.105   0.114
  152   2HD2  LEU  19          2HD2      LEU  19 -10.787   7.557  -1.435
  153   3HD2  LEU  19          3HD2      LEU  19  -9.754   8.446  -0.314
  154    H    PHE  20           H        PHE  20  -9.035   2.795   0.787
  155    HA   PHE  20           HA       PHE  20  -8.094   2.382  -1.986
  156   1HB   PHE  20          1HB       PHE  20  -7.099   0.827  -0.179
  157   2HB   PHE  20          2HB       PHE  20  -8.731   0.195  -0.016
  158    HD1  PHE  20           HD1      PHE  20  -6.905   1.120  -3.133
  159    HD2  PHE  20           HD2      PHE  20  -8.694  -1.908  -0.745
  160    HE1  PHE  20           HE1      PHE  20  -6.542  -0.530  -4.934
  161    HE2  PHE  20           HE2      PHE  20  -8.334  -3.556  -2.528
  162    HZ   PHE  20           HZ       PHE  20  -7.259  -2.862  -4.639
  163    H    ASN  21           H        ASN  21  -9.859   2.883  -3.155
  164    HA   ASN  21           HA       ASN  21 -11.939   2.805  -4.057
  165   1HB   ASN  21          1HB       ASN  21 -12.006   0.147  -2.627
  166   2HB   ASN  21          2HB       ASN  21 -13.246   0.688  -3.758
  167   1HD2  ASN  21          1HD2      ASN  21 -10.705  -1.247  -3.516
  168   2HD2  ASN  21          2HD2      ASN  21 -10.119  -1.214  -5.141
  169    H    GLY  22           H        GLY  22 -11.519   3.696  -1.102
  170   1HA   GLY  22          1HA       GLY  22 -13.261   5.116  -0.159
  171   2HA   GLY  22          2HA       GLY  22 -14.404   3.833  -0.500
  172    H    LYS  23           H        LYS  23 -11.813   2.211   0.565
  173    HA   LYS  23           HA       LYS  23 -12.726   2.358   3.364
  174   1HB   LYS  23          1HB       LYS  23 -13.115   0.177   2.242
  175   2HB   LYS  23          2HB       LYS  23 -11.384   0.041   1.953
  176   1HG   LYS  23          1HG       LYS  23 -10.989   0.044   4.375
  177   2HG   LYS  23          2HG       LYS  23 -12.730   0.129   4.648
  178   1HD   LYS  23          1HD       LYS  23 -11.356  -2.075   3.127
  179   2HD   LYS  23          2HD       LYS  23 -11.760  -2.165   4.841
  180   1HE   LYS  23          1HE       LYS  23 -14.145  -1.779   4.231
  181   2HE   LYS  23          2HE       LYS  23 -13.680  -1.858   2.534
  182   1HZ   LYS  23          1HZ       LYS  23 -12.718  -4.102   4.016
  183   2HZ   LYS  23          2HZ       LYS  23 -13.646  -4.058   2.600
  184   3HZ   LYS  23          3HZ       LYS  23 -14.410  -3.960   4.112
  185    H    GLU  24           H        GLU  24 -11.280   2.759   4.962
  186    HA   GLU  24           HA       GLU  24  -8.560   3.414   4.117
  187   1HB   GLU  24          1HB       GLU  24 -10.152   4.136   6.571
  188   2HB   GLU  24          2HB       GLU  24  -8.437   4.488   6.418
  189   1HG   GLU  24          1HG       GLU  24  -8.884   5.841   4.458
  190   2HG   GLU  24          2HG       GLU  24 -10.607   5.469   4.583
  191    H    TYR  25           H        TYR  25  -6.860   2.218   4.606
  192    HA   TYR  25           HA       TYR  25  -7.190   0.060   6.586
  193   1HB   TYR  25          1HB       TYR  25  -5.299   0.224   4.251
  194   2HB   TYR  25          2HB       TYR  25  -5.333  -1.091   5.401
  195    HD1  TYR  25           HD1      TYR  25  -7.453   0.675   2.913
  196    HD2  TYR  25           HD2      TYR  25  -6.663  -2.969   4.963
  197    HE1  TYR  25           HE1      TYR  25  -9.081  -0.481   1.459
  198    HE2  TYR  25           HE2      TYR  25  -8.291  -4.136   3.510
  199    HH   TYR  25           HH       TYR  25  -9.745  -3.954   1.860
  200    H    ASN  26           H        ASN  26  -6.013   0.178   8.386
  201    HA   ASN  26           HA       ASN  26  -3.826   2.126   8.499
  202   1HB   ASN  26          1HB       ASN  26  -5.596   0.862  10.535
  203   2HB   ASN  26          2HB       ASN  26  -3.977   1.329  11.036
  204   1HD2  ASN  26          1HD2      ASN  26  -7.101   2.334  10.749
  205   2HD2  ASN  26          2HD2      ASN  26  -6.854   4.041  10.810
  206    H    SER  27           H        SER  27  -3.826  -0.571   7.242
  207    HA   SER  27           HA       SER  27  -1.238  -1.408   8.141
  208   1HB   SER  27          1HB       SER  27  -2.013  -3.799   8.507
  209   2HB   SER  27          2HB       SER  27  -2.466  -2.655   9.772
  210    HG   SER  27           HG       SER  27  -4.108  -3.701   7.698
  211    H    CYS  28           H        CYS  28  -0.470  -3.286   6.771
  212    HA   CYS  28           HA       CYS  28  -1.076  -2.710   4.038
  213   1HB   CYS  28          1HB       CYS  28   0.592  -4.941   5.226
  214   2HB   CYS  28          2HB       CYS  28   0.547  -4.494   3.525
  215    H    THR  29           H        THR  29  -2.286  -3.862   2.578
  216    HA   THR  29           HA       THR  29  -3.620  -6.277   3.558
  217    HB   THR  29           HB       THR  29  -5.160  -4.340   3.624
  218    HG1  THR  29           HG1      THR  29  -6.269  -6.147   3.263
  219   1HG2  THR  29          1HG2      THR  29  -4.910  -2.774   2.043
  220   2HG2  THR  29          2HG2      THR  29  -5.961  -3.813   1.083
  221   3HG2  THR  29          3HG2      THR  29  -4.210  -3.903   0.879
  222    H    ASP  30           H        ASP  30  -4.392  -7.731   1.799
  223    HA   ASP  30           HA       ASP  30  -2.551  -7.586  -0.456
  224   1HB   ASP  30          1HB       ASP  30  -4.003 -10.038  -0.396
  225   2HB   ASP  30          2HB       ASP  30  -2.291  -9.806  -0.383
  226    H    THR  31           H        THR  31  -5.420  -6.528   0.215
  227    HA   THR  31           HA       THR  31  -7.225  -7.579  -1.657
  228    HB   THR  31           HB       THR  31  -7.090  -4.766  -0.572
  229    HG1  THR  31           HG1      THR  31  -7.178  -5.936   1.232
  230   1HG2  THR  31          1HG2      THR  31  -8.762  -5.209  -2.390
  231   2HG2  THR  31          2HG2      THR  31  -9.418  -4.625  -0.862
  232   3HG2  THR  31          3HG2      THR  31  -9.546  -6.333  -1.278
  233    H    GLY  32           H        GLY  32  -7.517  -7.220  -3.778
  234   1HA   GLY  32          1HA       GLY  32  -7.394  -6.085  -5.800
  235   2HA   GLY  32          2HA       GLY  32  -6.307  -4.924  -5.058
  236    H    ARG  33           H        ARG  33  -4.952  -7.583  -4.035
  237    HA   ARG  33           HA       ARG  33  -3.112  -7.750  -6.301
  238   1HB   ARG  33          1HB       ARG  33  -2.869  -8.558  -3.409
  239   2HB   ARG  33          2HB       ARG  33  -1.641  -8.917  -4.610
  240   1HG   ARG  33          1HG       ARG  33  -2.583  -6.163  -3.830
  241   2HG   ARG  33          2HG       ARG  33  -1.104  -6.935  -3.265
  242   1HD   ARG  33          1HD       ARG  33  -1.765  -6.203  -6.119
  243   2HD   ARG  33          2HD       ARG  33  -0.636  -5.360  -5.061
  244    HE   ARG  33           HE       ARG  33   0.095  -8.087  -5.300
  245   1HH1  ARG  33          1HH1      ARG  33   0.098  -5.080  -7.077
  246   2HH1  ARG  33          2HH1      ARG  33   1.471  -5.515  -8.057
  247   1HH2  ARG  33          1HH2      ARG  33   1.851  -8.695  -6.615
  248   2HH2  ARG  33          2HH2      ARG  33   2.475  -7.567  -7.781
  249    H    SER  34           H        SER  34  -2.036 -10.024  -6.450
  250    HA   SER  34           HA       SER  34  -4.150 -12.076  -6.339
  251   1HB   SER  34          1HB       SER  34  -2.059 -12.005  -8.511
  252   2HB   SER  34          2HB       SER  34  -3.605 -12.853  -8.498
  253    HG   SER  34           HG       SER  34  -3.839 -11.057  -9.801
  254    H    ASP  35           H        ASP  35  -0.829 -11.224  -5.885
  255    HA   ASP  35           HA       ASP  35   0.062 -13.904  -5.502
  256   1HB   ASP  35          1HB       ASP  35   1.850 -11.863  -4.566
  257   2HB   ASP  35          2HB       ASP  35   2.127 -13.079  -5.770
  258    H    GLY  36           H        GLY  36  -1.686 -11.976  -3.589
  259   1HA   GLY  36          1HA       GLY  36  -2.200 -12.123  -1.343
  260   2HA   GLY  36          2HA       GLY  36  -1.058 -13.453  -1.233
  261    H    PHE  37           H        PHE  37   0.278 -10.698  -2.640
  262    HA   PHE  37           HA       PHE  37   2.009 -10.254  -0.378
  263   1HB   PHE  37          1HB       PHE  37   1.872  -9.243  -3.192
  264   2HB   PHE  37          2HB       PHE  37   2.804  -8.336  -2.010
  265    HD1  PHE  37           HD1      PHE  37   2.398 -12.006  -2.651
  266    HD2  PHE  37           HD2      PHE  37   5.046  -8.682  -2.349
  267    HE1  PHE  37           HE1      PHE  37   4.320 -13.504  -3.004
  268    HE2  PHE  37           HE2      PHE  37   6.965 -10.176  -2.702
  269    HZ   PHE  37           HZ       PHE  37   6.603 -12.592  -3.034
  270    H    LEU  38           H        LEU  38   1.877  -8.669   1.079
  271    HA   LEU  38           HA       LEU  38  -0.467  -7.003   1.073
  272   1HB   LEU  38          1HB       LEU  38   1.812  -6.966   3.016
  273   2HB   LEU  38          2HB       LEU  38   0.237  -6.255   3.247
  274    HG   LEU  38           HG       LEU  38  -0.536  -8.784   2.892
  275   1HD1  LEU  38          1HD1      LEU  38   1.171 -10.132   4.280
  276   2HD1  LEU  38          2HD1      LEU  38   2.325  -8.910   3.753
  277   3HD1  LEU  38          3HD1      LEU  38   1.473  -9.887   2.558
  278   1HD2  LEU  38          1HD2      LEU  38  -0.256  -8.983   5.447
  279   2HD2  LEU  38          2HD2      LEU  38  -1.242  -7.671   4.802
  280   3HD2  LEU  38          3HD2      LEU  38   0.406  -7.350   5.343
  281    H    TRP  39           H        TRP  39  -0.572  -4.803   0.856
  282    HA   TRP  39           HA       TRP  39   1.917  -3.385   0.260
  283   1HB   TRP  39          1HB       TRP  39   0.962  -2.360  -1.760
  284   2HB   TRP  39          2HB       TRP  39   1.016  -4.110  -1.918
  285    HD1  TRP  39           HD1      TRP  39  -1.354  -5.433  -1.763
  286    HE1  TRP  39           HE1      TRP  39  -3.744  -4.665  -2.287
  287    HE3  TRP  39           HE3      TRP  39  -0.628  -0.374  -1.700
  288    HZ2  TRP  39           HZ2      TRP  39  -5.140  -2.244  -2.634
  289    HZ3  TRP  39           HZ3      TRP  39  -2.555   1.100  -2.147
  290    HH2  TRP  39           HH2      TRP  39  -4.754   0.173  -2.601
  291    H    CYS  40           H        CYS  40   1.443  -0.990  -0.034
  292    HA   CYS  40           HA       CYS  40  -0.845  -0.046   1.515
  293   1HB   CYS  40          1HB       CYS  40   0.537   1.257   3.030
  294   2HB   CYS  40          2HB       CYS  40   1.023  -0.429   3.136
  295    H    SER  41           H        SER  41  -1.230   2.254   1.130
  296    HA   SER  41           HA       SER  41  -0.045   3.115  -1.402
  297   1HB   SER  41          1HB       SER  41  -2.419   4.263   0.084
  298   2HB   SER  41          2HB       SER  41  -1.891   4.703  -1.541
  299    HG   SER  41           HG       SER  41  -2.981   2.249  -0.648
  300    H    THR  42           H        THR  42   0.797   5.267  -1.642
  301    HA   THR  42           HA       THR  42   1.819   6.373   0.879
  302    HB   THR  42           HB       THR  42   2.909   6.586  -1.941
  303    HG1  THR  42           HG1      THR  42   4.009   5.280   0.323
  304   1HG2  THR  42          1HG2      THR  42   3.386   8.555  -0.372
  305   2HG2  THR  42          2HG2      THR  42   4.747   7.769  -1.169
  306   3HG2  THR  42          3HG2      THR  42   4.392   7.416   0.521
  307    H    THR  43           H        THR  43   0.101   7.119  -2.066
  308    HA   THR  43           HA       THR  43  -0.025   9.958  -1.433
  309    HB   THR  43           HB       THR  43  -1.539   9.841  -3.562
  310    HG1  THR  43           HG1      THR  43  -1.785   7.911  -4.284
  311   1HG2  THR  43          1HG2      THR  43   1.340   9.113  -4.000
  312   2HG2  THR  43          2HG2      THR  43   0.827  10.719  -3.477
  313   3HG2  THR  43          3HG2      THR  43   0.278  10.084  -5.028
  314    H    TYR  44           H        TYR  44  -1.418   7.679   0.109
  315    HA   TYR  44           HA       TYR  44  -3.296   7.453   1.348
  316   1HB   TYR  44          1HB       TYR  44  -3.262   9.830   1.745
  317   2HB   TYR  44          2HB       TYR  44  -3.985  10.159   0.176
  318    HD1  TYR  44           HD1      TYR  44  -4.798   8.031   3.175
  319    HD2  TYR  44           HD2      TYR  44  -6.203  10.803   0.264
  320    HE1  TYR  44           HE1      TYR  44  -7.029   7.968   4.194
  321    HE2  TYR  44           HE2      TYR  44  -8.436  10.746   1.280
  322    HH   TYR  44           HH       TYR  44  -9.141   8.663   4.068
  323    H    ASN  45           H        ASN  45  -4.709   9.126  -1.470
  324    HA   ASN  45           HA       ASN  45  -6.638   7.005  -1.750
  325   1HB   ASN  45          1HB       ASN  45  -7.119   9.492  -2.121
  326   2HB   ASN  45          2HB       ASN  45  -6.256   9.344  -3.634
  327   1HD2  ASN  45          1HD2      ASN  45  -7.496   6.517  -3.817
  328   2HD2  ASN  45          2HD2      ASN  45  -9.046   6.907  -4.381
  329    H    PHE  46           H        PHE  46  -5.996   5.157  -2.696
  330    HA   PHE  46           HA       PHE  46  -3.817   5.085  -4.576
  331   1HB   PHE  46          1HB       PHE  46  -4.162   3.303  -2.916
  332   2HB   PHE  46          2HB       PHE  46  -5.712   2.894  -3.678
  333    HD1  PHE  46           HD1      PHE  46  -2.079   3.278  -4.568
  334    HD2  PHE  46           HD2      PHE  46  -5.713   1.148  -5.205
  335    HE1  PHE  46           HE1      PHE  46  -0.922   1.735  -6.087
  336    HE2  PHE  46           HE2      PHE  46  -4.556  -0.388  -6.718
  337    HZ   PHE  46           HZ       PHE  46  -2.146  -0.094  -7.163
  338    H    GLU  47           H        GLU  47  -7.291   5.052  -4.772
  339    HA   GLU  47           HA       GLU  47  -7.681   3.885  -7.250
  340   1HB   GLU  47          1HB       GLU  47  -9.360   4.707  -5.433
  341   2HB   GLU  47          2HB       GLU  47  -9.376   6.188  -6.375
  342   1HG   GLU  47          1HG       GLU  47 -10.168   5.031  -8.309
  343   2HG   GLU  47          2HG       GLU  47  -9.977   3.471  -7.513
  344    H    LYS  48           H        LYS  48  -7.069   7.343  -6.572
  345    HA   LYS  48           HA       LYS  48  -7.123   7.836  -9.430
  346   1HB   LYS  48          1HB       LYS  48  -7.106  10.184  -8.928
  347   2HB   LYS  48          2HB       LYS  48  -8.324   9.389  -7.941
  348   1HG   LYS  48          1HG       LYS  48  -6.878   9.499  -6.004
  349   2HG   LYS  48          2HG       LYS  48  -5.572  10.174  -6.983
  350   1HD   LYS  48          1HD       LYS  48  -7.139  12.089  -7.524
  351   2HD   LYS  48          2HD       LYS  48  -8.207  11.459  -6.267
  352   1HE   LYS  48          1HE       LYS  48  -6.830  13.200  -5.333
  353   2HE   LYS  48          2HE       LYS  48  -6.334  11.650  -4.653
  354   1HZ   LYS  48          1HZ       LYS  48  -4.550  13.282  -5.484
  355   2HZ   LYS  48          2HZ       LYS  48  -4.970  12.727  -7.037
  356   3HZ   LYS  48          3HZ       LYS  48  -4.384  11.636  -5.868
  357    H    ASP  49           H        ASP  49  -4.779   7.980  -6.788
  358    HA   ASP  49           HA       ASP  49  -2.755   9.058  -8.524
  359   1HB   ASP  49          1HB       ASP  49  -2.622   8.041  -5.690
  360   2HB   ASP  49          2HB       ASP  49  -1.267   8.777  -6.539
  361    H    GLY  50           H        GLY  50  -3.090   5.966  -6.777
  362   1HA   GLY  50          1HA       GLY  50  -2.580   3.848  -7.605
  363   2HA   GLY  50          2HA       GLY  50  -1.881   4.603  -9.023
  364    H    LYS  51           H        LYS  51  -0.669   5.951  -6.140
  365    HA   LYS  51           HA       LYS  51   1.902   4.731  -6.611
  366   1HB   LYS  51          1HB       LYS  51   0.862   6.898  -4.832
  367   2HB   LYS  51          2HB       LYS  51   2.416   6.169  -4.469
  368   1HG   LYS  51          1HG       LYS  51   2.593   8.237  -5.771
  369   2HG   LYS  51          2HG       LYS  51   3.290   6.844  -6.593
  370   1HD   LYS  51          1HD       LYS  51   1.284   6.656  -7.983
  371   2HD   LYS  51          2HD       LYS  51   0.578   8.046  -7.154
  372   1HE   LYS  51          1HE       LYS  51   3.120   8.052  -8.786
  373   2HE   LYS  51          2HE       LYS  51   1.545   8.657  -9.314
  374   1HZ   LYS  51          1HZ       LYS  51   1.611  10.345  -7.627
  375   2HZ   LYS  51          2HZ       LYS  51   3.045  10.429  -8.526
  376   3HZ   LYS  51          3HZ       LYS  51   3.055   9.726  -6.975
  377    H    TYR  52           H        TYR  52   2.337   2.783  -5.843
  378    HA   TYR  52           HA       TYR  52   1.467   2.119  -3.121
  379   1HB   TYR  52          1HB       TYR  52   0.749  -0.070  -3.779
  380   2HB   TYR  52          2HB       TYR  52  -0.044   1.073  -4.859
  381    HD1  TYR  52           HD1      TYR  52   1.521   1.608  -7.040
  382    HD2  TYR  52           HD2      TYR  52   1.527  -1.988  -4.769
  383    HE1  TYR  52           HE1      TYR  52   2.461   0.407  -8.959
  384    HE2  TYR  52           HE2      TYR  52   2.472  -3.200  -6.687
  385    HH   TYR  52           HH       TYR  52   2.410  -2.149  -9.735
  386    H    GLY  53           H        GLY  53   2.584   0.270  -2.242
  387   1HA   GLY  53          1HA       GLY  53   5.067  -0.571  -3.431
  388   2HA   GLY  53          2HA       GLY  53   5.247   0.425  -1.996
  389    H    PHE  54           H        PHE  54   6.034  -2.320  -2.212
  390    HA   PHE  54           HA       PHE  54   3.972  -3.816  -0.867
  391   1HB   PHE  54          1HB       PHE  54   6.755  -4.604  -1.689
  392   2HB   PHE  54          2HB       PHE  54   5.591  -5.698  -0.956
  393    HD1  PHE  54           HD1      PHE  54   6.731  -6.462  -3.462
  394    HD2  PHE  54           HD2      PHE  54   3.435  -3.874  -2.714
  395    HE1  PHE  54           HE1      PHE  54   5.813  -6.992  -5.681
  396    HE2  PHE  54           HE2      PHE  54   2.513  -4.394  -4.929
  397    HZ   PHE  54           HZ       PHE  54   3.700  -5.964  -6.420
  398    H    CYS  55           H        CYS  55   4.233  -4.932   1.103
  399    HA   CYS  55           HA       CYS  55   6.356  -4.178   2.902
  400   1HB   CYS  55          1HB       CYS  55   4.561  -3.435   4.633
  401   2HB   CYS  55          2HB       CYS  55   5.094  -2.284   3.415
  402    HA   PRO  56           HA       PRO  56   5.445  -8.176   4.527
  403   1HB   PRO  56          1HB       PRO  56   6.116  -7.985   7.122
  404   2HB   PRO  56          2HB       PRO  56   7.318  -7.940   5.830
  405   1HG   PRO  56          1HG       PRO  56   6.100  -5.668   7.356
  406   2HG   PRO  56          2HG       PRO  56   7.797  -5.928   6.912
  407   1HD   PRO  56          1HD       PRO  56   6.149  -4.266   5.538
  408   2HD   PRO  56          2HD       PRO  56   7.478  -5.150   4.764
  409    H    HIS  57           H        HIS  57   4.297  -9.362   6.380
  410    HA   HIS  57           HA       HIS  57   1.674  -8.158   6.636
  411   1HB   HIS  57          1HB       HIS  57   0.941 -10.354   7.514
  412   2HB   HIS  57          2HB       HIS  57   1.703 -10.483   5.936
  413    HD1  HIS  57           HD1      HIS  57   4.313 -11.340   6.042
  414    HD2  HIS  57           HD2      HIS  57   1.911 -12.069   9.364
  415    HE1  HIS  57           HE1      HIS  57   5.499 -13.129   7.364
  416    H    GLU  58           H        GLU  58   0.923  -7.202   8.370
  417    HA   GLU  58           HA       GLU  58   2.408  -7.522  10.887
  418   1HB   GLU  58          1HB       GLU  58   1.728  -5.242  11.433
  419   2HB   GLU  58          2HB       GLU  58   2.662  -5.284   9.950
  420   1HG   GLU  58          1HG       GLU  58   0.501  -5.192   8.699
  421   2HG   GLU  58          2HG       GLU  58  -0.311  -4.932  10.240
  422    H    ALA  59           H        ALA  59  -0.684  -7.489   9.312
  423    HA   ALA  59           HA       ALA  59  -1.920  -8.838  11.534
  424   1HB   ALA  59          1HB       ALA  59  -2.626  -6.013  10.819
  425   2HB   ALA  59          2HB       ALA  59  -2.461  -6.759  12.406
  426   3HB   ALA  59          3HB       ALA  59  -3.871  -7.113  11.412
  Start of MODEL   22
    1   1H    ARG   1          1H        ARG   1   2.831   5.045  10.510
    2   2H    ARG   1          2H        ARG   1   4.314   4.320  10.975
    3   3H    ARG   1          3H        ARG   1   3.060   3.356  10.291
    4    HA   ARG   1           HA       ARG   1   3.300   4.374   8.212
    5   1HB   ARG   1          1HB       ARG   1   3.781   6.619   9.359
    6   2HB   ARG   1          2HB       ARG   1   5.452   6.096   9.448
    7   1HG   ARG   1          1HG       ARG   1   5.574   5.974   7.026
    8   2HG   ARG   1          2HG       ARG   1   3.874   6.451   6.908
    9   1HD   ARG   1          1HD       ARG   1   4.416   8.561   8.068
   10   2HD   ARG   1          2HD       ARG   1   6.114   8.088   8.093
   11    HE   ARG   1           HE       ARG   1   5.256   8.002   5.428
   12   1HH1  ARG   1          1HH1      ARG   1   5.669  10.359   7.974
   13   2HH1  ARG   1          2HH1      ARG   1   6.018  11.665   6.885
   14   1HH2  ARG   1          1HH2      ARG   1   5.692   9.693   3.994
   15   2HH2  ARG   1          2HH2      ARG   1   6.046  11.279   4.605
   16    H    ILE   2           H        ILE   2   4.002   2.085   8.284
   17    HA   ILE   2           HA       ILE   2   6.750   1.483   8.810
   18    HB   ILE   2           HB       ILE   2   6.171  -0.773   7.815
   19   1HG1  ILE   2          1HG1      ILE   2   3.475   0.561   7.574
   20   2HG1  ILE   2          2HG1      ILE   2   4.409  -0.238   6.313
   21   1HG2  ILE   2          1HG2      ILE   2   4.717  -1.476   9.687
   22   2HG2  ILE   2          2HG2      ILE   2   4.421   0.215  10.080
   23   3HG2  ILE   2          3HG2      ILE   2   6.049  -0.453  10.223
   24   1HD1  ILE   2          1HD1      ILE   2   3.817  -2.023   8.508
   25   2HD1  ILE   2          2HD1      ILE   2   3.504  -2.204   6.781
   26   3HD1  ILE   2          3HD1      ILE   2   2.362  -1.329   7.799
   27    HA   PRO   3           HA       PRO   3   8.918   2.007   5.073
   28   1HB   PRO   3          1HB       PRO   3  10.077  -0.467   4.728
   29   2HB   PRO   3          2HB       PRO   3  10.667   0.772   5.842
   30   1HG   PRO   3          1HG       PRO   3   8.877  -1.573   6.398
   31   2HG   PRO   3          2HG       PRO   3  10.287  -0.999   7.316
   32   1HD   PRO   3          1HD       PRO   3   7.846  -0.417   8.156
   33   2HD   PRO   3          2HD       PRO   3   9.109   0.838   8.195
   34    H    VAL   4           H        VAL   4   9.257   1.335   2.893
   35    HA   VAL   4           HA       VAL   4   7.174  -0.421   1.752
   36    HB   VAL   4           HB       VAL   4   8.138   2.241   0.596
   37   1HG1  VAL   4          1HG1      VAL   4   6.020   0.390  -0.506
   38   2HG1  VAL   4          2HG1      VAL   4   7.678   0.476  -1.105
   39   3HG1  VAL   4          3HG1      VAL   4   6.623   1.884  -1.224
   40   1HG2  VAL   4          1HG2      VAL   4   5.296   1.623   1.298
   41   2HG2  VAL   4          2HG2      VAL   4   6.114   3.183   1.180
   42   3HG2  VAL   4          3HG2      VAL   4   6.422   2.125   2.558
   43    H    LYS   5           H        LYS   5   7.875  -1.572  -0.156
   44    HA   LYS   5           HA       LYS   5  10.809  -1.526  -0.478
   45   1HB   LYS   5          1HB       LYS   5   9.027  -3.689   0.213
   46   2HB   LYS   5          2HB       LYS   5   9.903  -4.064  -1.263
   47   1HG   LYS   5          1HG       LYS   5  11.145  -3.270   1.368
   48   2HG   LYS   5          2HG       LYS   5  11.063  -4.906   0.693
   49   1HD   LYS   5          1HD       LYS   5  12.485  -4.316  -1.123
   50   2HD   LYS   5          2HD       LYS   5  12.411  -2.603  -0.707
   51   1HE   LYS   5          1HE       LYS   5  13.644  -4.779   0.988
   52   2HE   LYS   5          2HE       LYS   5  14.533  -3.632  -0.018
   53   1HZ   LYS   5          1HZ       LYS   5  14.616  -2.706   2.092
   54   2HZ   LYS   5          2HZ       LYS   5  13.007  -3.113   2.464
   55   3HZ   LYS   5          3HZ       LYS   5  13.334  -1.858   1.368
   56    H    TYR   6           H        TYR   6   8.419  -3.380  -2.282
   57    HA   TYR   6           HA       TYR   6   9.596  -2.423  -4.759
   58   1HB   TYR   6          1HB       TYR   6   7.437  -4.507  -4.391
   59   2HB   TYR   6          2HB       TYR   6   8.449  -4.259  -5.810
   60    HD1  TYR   6           HD1      TYR   6   8.084  -6.866  -4.266
   61    HD2  TYR   6           HD2      TYR   6  11.043  -3.813  -3.991
   62    HE1  TYR   6           HE1      TYR   6   9.686  -8.500  -3.399
   63    HE2  TYR   6           HE2      TYR   6  12.649  -5.448  -3.122
   64    HH   TYR   6           HH       TYR   6  13.029  -7.836  -3.147
   65    H    GLY   7           H        GLY   7   8.260  -1.834  -6.594
   66   1HA   GLY   7          1HA       GLY   7   5.994  -1.228  -7.327
   67   2HA   GLY   7          2HA       GLY   7   5.791  -0.412  -5.791
   68    H    ASN   8           H        ASN   8   5.309   1.524  -6.916
   69    HA   ASN   8           HA       ASN   8   7.614   2.728  -8.303
   70   1HB   ASN   8          1HB       ASN   8   6.109   4.102  -9.543
   71   2HB   ASN   8          2HB       ASN   8   5.493   2.458  -9.617
   72   1HD2  ASN   8          1HD2      ASN   8   4.070   4.925 -10.060
   73   2HD2  ASN   8          2HD2      ASN   8   2.808   4.991  -8.880
   74    H    ALA   9           H        ALA   9   6.404   2.748  -5.328
   75    HA   ALA   9           HA       ALA   9   6.205   5.543  -4.763
   76   1HB   ALA   9          1HB       ALA   9   6.812   4.122  -2.411
   77   2HB   ALA   9          2HB       ALA   9   5.729   3.119  -3.376
   78   3HB   ALA   9          3HB       ALA   9   5.258   4.762  -2.938
   79    H    ASP  10           H        ASP  10   7.673   6.875  -3.724
   80    HA   ASP  10           HA       ASP  10  10.442   6.268  -4.265
   81   1HB   ASP  10          1HB       ASP  10   9.080   8.689  -3.090
   82   2HB   ASP  10          2HB       ASP  10  10.826   8.566  -3.263
   83    H    GLY  11           H        GLY  11   9.272   7.856  -1.334
   84   1HA   GLY  11          1HA       GLY  11  10.051   5.685   0.363
   85   2HA   GLY  11          2HA       GLY  11  11.219   6.994   0.371
   86    H    GLU  12           H        GLU  12   7.688   7.288   0.134
   87    HA   GLU  12           HA       GLU  12   7.743   9.011   2.495
   88   1HB   GLU  12          1HB       GLU  12   5.634   8.397   0.429
   89   2HB   GLU  12          2HB       GLU  12   5.253   9.272   1.904
   90   1HG   GLU  12          1HG       GLU  12   7.348  10.144  -0.071
   91   2HG   GLU  12          2HG       GLU  12   5.674  10.707  -0.083
   92    H    TYR  13           H        TYR  13   7.747   5.869   2.163
   93    HA   TYR  13           HA       TYR  13   7.101   4.062   3.333
   94   1HB   TYR  13          1HB       TYR  13   6.398   6.086   5.439
   95   2HB   TYR  13          2HB       TYR  13   6.438   4.337   5.695
   96    HD1  TYR  13           HD1      TYR  13   8.722   6.980   4.304
   97    HD2  TYR  13           HD2      TYR  13   8.285   3.538   6.762
   98    HE1  TYR  13           HE1      TYR  13  11.099   7.109   4.899
   99    HE2  TYR  13           HE2      TYR  13  10.660   3.657   7.362
  100    HH   TYR  13           HH       TYR  13  12.783   6.149   5.994
  101    H    CYS  14           H        CYS  14   5.062   3.248   4.785
  102    HA   CYS  14           HA       CYS  14   2.897   3.351   2.943
  103   1HB   CYS  14          1HB       CYS  14   3.308   2.048   5.603
  104   2HB   CYS  14          2HB       CYS  14   1.705   2.088   4.884
  105    H    LYS  15           H        LYS  15   1.217   4.689   2.875
  106    HA   LYS  15           HA       LYS  15   0.981   6.733   4.928
  107   1HB   LYS  15          1HB       LYS  15   0.432   6.581   2.128
  108   2HB   LYS  15          2HB       LYS  15  -1.068   6.970   2.959
  109   1HG   LYS  15          1HG       LYS  15   1.516   8.483   3.310
  110   2HG   LYS  15          2HG       LYS  15   0.225   8.947   2.199
  111   1HD   LYS  15          1HD       LYS  15  -1.323   9.178   4.066
  112   2HD   LYS  15          2HD       LYS  15  -0.070   8.662   5.195
  113   1HE   LYS  15          1HE       LYS  15   0.126  11.094   3.426
  114   2HE   LYS  15          2HE       LYS  15  -0.409  11.133   5.105
  115   1HZ   LYS  15          1HZ       LYS  15   2.283  10.587   4.025
  116   2HZ   LYS  15          2HZ       LYS  15   1.832   9.939   5.532
  117   3HZ   LYS  15          3HZ       LYS  15   1.816  11.620   5.295
  118    H    PHE  16           H        PHE  16  -0.068   6.131   6.679
  119    HA   PHE  16           HA       PHE  16  -2.520   4.539   6.372
  120   1HB   PHE  16          1HB       PHE  16  -0.597   4.755   8.697
  121   2HB   PHE  16          2HB       PHE  16  -2.133   3.896   8.770
  122    HD1  PHE  16           HD1      PHE  16   0.483   2.653   9.363
  123    HD2  PHE  16           HD2      PHE  16  -1.654   3.021   5.711
  124    HE1  PHE  16           HE1      PHE  16   1.585   0.629   8.522
  125    HE2  PHE  16           HE2      PHE  16  -0.562   1.012   4.848
  126    HZ   PHE  16           HZ       PHE  16   1.085  -0.215   6.247
  127    HA   PRO  17           HA       PRO  17  -4.191   4.173   6.791
  128   1HB   PRO  17          1HB       PRO  17  -6.833   4.829   6.617
  129   2HB   PRO  17          2HB       PRO  17  -6.074   4.187   8.077
  130   1HG   PRO  17          1HG       PRO  17  -7.119   6.858   7.598
  131   2HG   PRO  17          2HG       PRO  17  -6.554   6.144   9.116
  132   1HD   PRO  17          1HD       PRO  17  -5.165   7.958   7.297
  133   2HD   PRO  17          2HD       PRO  17  -4.746   7.495   8.958
  134    H    PHE  18           H        PHE  18  -4.678   3.565   4.667
  135    HA   PHE  18           HA       PHE  18  -4.912   5.832   2.826
  136   1HB   PHE  18          1HB       PHE  18  -3.943   4.486   1.084
  137   2HB   PHE  18          2HB       PHE  18  -2.903   4.438   2.495
  138    HD1  PHE  18           HD1      PHE  18  -3.018   2.352   3.976
  139    HD2  PHE  18           HD2      PHE  18  -4.675   2.530   0.060
  140    HE1  PHE  18           HE1      PHE  18  -2.992  -0.106   3.852
  141    HE2  PHE  18           HE2      PHE  18  -4.657   0.080  -0.073
  142    HZ   PHE  18           HZ       PHE  18  -3.810  -1.261   1.825
  143    H    LEU  19           H        LEU  19  -6.441   5.911   1.256
  144    HA   LEU  19           HA       LEU  19  -8.840   4.386   1.778
  145   1HB   LEU  19          1HB       LEU  19  -8.809   6.858   1.394
  146   2HB   LEU  19          2HB       LEU  19  -8.350   6.541  -0.268
  147    HG   LEU  19           HG       LEU  19 -10.511   5.201  -0.457
  148   1HD1  LEU  19          1HD1      LEU  19 -10.613   5.545   2.249
  149   2HD1  LEU  19          2HD1      LEU  19 -11.980   5.105   1.226
  150   3HD1  LEU  19          3HD1      LEU  19 -11.720   6.791   1.665
  151   1HD2  LEU  19          1HD2      LEU  19 -11.757   7.111  -1.039
  152   2HD2  LEU  19          2HD2      LEU  19 -10.067   7.539  -1.318
  153   3HD2  LEU  19          3HD2      LEU  19 -10.899   8.121   0.128
  154    H    PHE  20           H        PHE  20  -8.966   2.436   0.926
  155    HA   PHE  20           HA       PHE  20  -8.093   2.027  -1.852
  156   1HB   PHE  20          1HB       PHE  20  -7.152   0.500  -0.033
  157   2HB   PHE  20          2HB       PHE  20  -8.791  -0.106   0.158
  158    HD1  PHE  20           HD1      PHE  20  -7.585  -2.251  -0.247
  159    HD2  PHE  20           HD2      PHE  20  -8.134   0.702  -3.256
  160    HE1  PHE  20           HE1      PHE  20  -7.243  -3.974  -1.966
  161    HE2  PHE  20           HE2      PHE  20  -7.782  -1.022  -4.990
  162    HZ   PHE  20           HZ       PHE  20  -7.346  -3.353  -4.348
  163    H    ASN  21           H        ASN  21  -9.821   2.703  -2.966
  164    HA   ASN  21           HA       ASN  21 -11.899   2.792  -3.879
  165   1HB   ASN  21          1HB       ASN  21 -11.728  -0.089  -3.031
  166   2HB   ASN  21          2HB       ASN  21 -13.145   0.537  -3.865
  167   1HD2  ASN  21          1HD2      ASN  21 -13.087  -0.033  -5.913
  168   2HD2  ASN  21          2HD2      ASN  21 -11.698  -0.014  -6.941
  169    H    GLY  22           H        GLY  22 -11.647   3.437  -0.966
  170   1HA   GLY  22          1HA       GLY  22 -13.582   4.543   0.035
  171   2HA   GLY  22          2HA       GLY  22 -14.501   3.103  -0.319
  172    H    LYS  23           H        LYS  23 -11.876   1.671   0.638
  173    HA   LYS  23           HA       LYS  23 -12.644   1.790   3.477
  174   1HB   LYS  23          1HB       LYS  23 -12.979  -0.385   2.268
  175   2HB   LYS  23          2HB       LYS  23 -11.238  -0.472   2.041
  176   1HG   LYS  23          1HG       LYS  23 -10.977  -0.461   4.512
  177   2HG   LYS  23          2HG       LYS  23 -12.728  -0.505   4.663
  178   1HD   LYS  23          1HD       LYS  23 -11.370  -2.573   2.998
  179   2HD   LYS  23          2HD       LYS  23 -11.274  -2.700   4.752
  180   1HE   LYS  23          1HE       LYS  23 -13.147  -3.986   4.050
  181   2HE   LYS  23          2HE       LYS  23 -13.759  -2.535   4.843
  182   1HZ   LYS  23          1HZ       LYS  23 -13.546  -2.876   1.890
  183   2HZ   LYS  23          2HZ       LYS  23 -14.255  -1.567   2.715
  184   3HZ   LYS  23          3HZ       LYS  23 -14.964  -3.104   2.792
  185    H    GLU  24           H        GLU  24 -11.211   2.600   4.872
  186    HA   GLU  24           HA       GLU  24  -8.507   3.128   3.924
  187   1HB   GLU  24          1HB       GLU  24  -9.842   3.981   6.495
  188   2HB   GLU  24          2HB       GLU  24  -8.284   4.538   5.908
  189   1HG   GLU  24          1HG       GLU  24  -9.446   5.479   3.929
  190   2HG   GLU  24          2HG       GLU  24 -10.979   5.039   4.684
  191    H    TYR  25           H        TYR  25  -6.799   1.939   4.471
  192    HA   TYR  25           HA       TYR  25  -7.127  -0.097   6.564
  193   1HB   TYR  25          1HB       TYR  25  -5.202   0.075   4.259
  194   2HB   TYR  25          2HB       TYR  25  -5.150  -1.195   5.464
  195    HD1  TYR  25           HD1      TYR  25  -7.295   0.336   2.870
  196    HD2  TYR  25           HD2      TYR  25  -6.496  -3.125   5.207
  197    HE1  TYR  25           HE1      TYR  25  -8.905  -0.936   1.496
  198    HE2  TYR  25           HE2      TYR  25  -8.102  -4.415   3.828
  199    HH   TYR  25           HH       TYR  25 -10.031  -2.863   1.298
  200    H    ASN  26           H        ASN  26  -5.845  -0.143   8.322
  201    HA   ASN  26           HA       ASN  26  -4.018   2.117   8.688
  202   1HB   ASN  26          1HB       ASN  26  -5.096   0.059  10.635
  203   2HB   ASN  26          2HB       ASN  26  -3.912   1.284  11.069
  204   1HD2  ASN  26          1HD2      ASN  26  -6.089   2.432   8.768
  205   2HD2  ASN  26          2HD2      ASN  26  -7.145   3.287   9.839
  206    H    SER  27           H        SER  27  -3.720  -0.671   7.262
  207    HA   SER  27           HA       SER  27  -0.901  -0.884   7.739
  208   1HB   SER  27          1HB       SER  27  -0.994  -3.336   8.285
  209   2HB   SER  27          2HB       SER  27  -1.633  -2.303   9.563
  210    HG   SER  27           HG       SER  27  -3.574  -3.112   9.261
  211    H    CYS  28           H        CYS  28  -0.189  -3.037   6.387
  212    HA   CYS  28           HA       CYS  28  -1.163  -2.478   3.723
  213   1HB   CYS  28          1HB       CYS  28   0.954  -4.351   4.784
  214   2HB   CYS  28          2HB       CYS  28   0.388  -4.466   3.128
  215    H    THR  29           H        THR  29  -2.178  -3.975   2.312
  216    HA   THR  29           HA       THR  29  -3.384  -6.301   3.605
  217    HB   THR  29           HB       THR  29  -4.998  -4.438   3.626
  218    HG1  THR  29           HG1      THR  29  -5.937  -6.416   3.453
  219   1HG2  THR  29          1HG2      THR  29  -5.550  -3.143   1.899
  220   2HG2  THR  29          2HG2      THR  29  -5.594  -4.500   0.772
  221   3HG2  THR  29          3HG2      THR  29  -4.058  -3.724   1.157
  222    H    ASP  30           H        ASP  30  -4.277  -7.879   1.981
  223    HA   ASP  30           HA       ASP  30  -2.552  -7.874  -0.378
  224   1HB   ASP  30          1HB       ASP  30  -3.987 -10.334   0.083
  225   2HB   ASP  30          2HB       ASP  30  -2.293 -10.084  -0.224
  226    H    THR  31           H        THR  31  -5.429  -6.883   0.443
  227    HA   THR  31           HA       THR  31  -7.282  -8.032  -1.304
  228    HB   THR  31           HB       THR  31  -7.157  -5.170  -0.336
  229    HG1  THR  31           HG1      THR  31  -7.178  -6.224   1.513
  230   1HG2  THR  31          1HG2      THR  31  -9.545  -5.130  -0.452
  231   2HG2  THR  31          2HG2      THR  31  -9.598  -6.812  -0.980
  232   3HG2  THR  31          3HG2      THR  31  -8.910  -5.575  -2.035
  233    H    GLY  32           H        GLY  32  -7.783  -7.683  -3.422
  234   1HA   GLY  32          1HA       GLY  32  -7.756  -6.548  -5.482
  235   2HA   GLY  32          2HA       GLY  32  -6.461  -5.531  -4.871
  236    H    ARG  33           H        ARG  33  -4.937  -7.822  -3.871
  237    HA   ARG  33           HA       ARG  33  -3.633  -8.521  -6.375
  238   1HB   ARG  33          1HB       ARG  33  -2.792  -9.263  -3.566
  239   2HB   ARG  33          2HB       ARG  33  -1.792  -9.257  -5.009
  240   1HG   ARG  33          1HG       ARG  33  -2.994  -6.803  -3.740
  241   2HG   ARG  33          2HG       ARG  33  -1.340  -7.359  -3.492
  242   1HD   ARG  33          1HD       ARG  33  -2.541  -6.583  -6.152
  243   2HD   ARG  33          2HD       ARG  33  -1.517  -5.539  -5.168
  244    HE   ARG  33           HE       ARG  33  -0.293  -8.074  -5.801
  245   1HH1  ARG  33          1HH1      ARG  33  -0.845  -4.787  -6.860
  246   2HH1  ARG  33          2HH1      ARG  33   0.478  -4.792  -7.990
  247   1HH2  ARG  33          1HH2      ARG  33   1.423  -8.092  -7.349
  248   2HH2  ARG  33          2HH2      ARG  33   1.728  -6.664  -8.292
  249    H    SER  34           H        SER  34  -3.154 -10.721  -6.944
  250    HA   SER  34           HA       SER  34  -5.248 -12.556  -6.059
  251   1HB   SER  34          1HB       SER  34  -3.247 -12.910  -8.306
  252   2HB   SER  34          2HB       SER  34  -4.706 -13.860  -8.025
  253    HG   SER  34           HG       SER  34  -5.958 -12.145  -8.613
  254    H    ASP  35           H        ASP  35  -1.749 -12.200  -6.059
  255    HA   ASP  35           HA       ASP  35  -1.350 -14.832  -4.996
  256   1HB   ASP  35          1HB       ASP  35   0.525 -12.626  -5.641
  257   2HB   ASP  35          2HB       ASP  35   1.040 -14.176  -5.037
  258    H    GLY  36           H        GLY  36  -2.572 -12.354  -3.542
  259   1HA   GLY  36          1HA       GLY  36  -2.746 -11.677  -1.363
  260   2HA   GLY  36          2HA       GLY  36  -1.964 -13.193  -0.952
  261    H    PHE  37           H        PHE  37  -0.660 -10.395  -2.758
  262    HA   PHE  37           HA       PHE  37   1.602 -10.427  -0.928
  263   1HB   PHE  37          1HB       PHE  37   1.071  -8.971  -3.503
  264   2HB   PHE  37          2HB       PHE  37   2.406  -8.516  -2.461
  265    HD1  PHE  37           HD1      PHE  37   3.411  -9.096  -4.879
  266    HD2  PHE  37           HD2      PHE  37   1.996 -11.938  -2.045
  267    HE1  PHE  37           HE1      PHE  37   4.793 -10.838  -5.930
  268    HE2  PHE  37           HE2      PHE  37   3.378 -13.681  -3.088
  269    HZ   PHE  37           HZ       PHE  37   4.783 -13.128  -5.040
  270    H    LEU  38           H        LEU  38   2.029  -8.934   0.575
  271    HA   LEU  38           HA       LEU  38  -0.127  -7.247   1.463
  272   1HB   LEU  38          1HB       LEU  38   1.672  -8.613   2.801
  273   2HB   LEU  38          2HB       LEU  38   2.652  -7.174   2.580
  274    HG   LEU  38           HG       LEU  38   0.809  -5.864   3.702
  275   1HD1  LEU  38          1HD1      LEU  38  -0.234  -8.265   4.994
  276   2HD1  LEU  38          2HD1      LEU  38  -0.684  -8.101   3.296
  277   3HD1  LEU  38          3HD1      LEU  38  -1.072  -6.816   4.443
  278   1HD2  LEU  38          1HD2      LEU  38   2.828  -7.519   4.793
  279   2HD2  LEU  38          2HD2      LEU  38   1.424  -7.624   5.854
  280   3HD2  LEU  38          3HD2      LEU  38   2.129  -6.053   5.477
  281    H    TRP  39           H        TRP  39  -0.496  -5.257   0.609
  282    HA   TRP  39           HA       TRP  39   1.837  -3.562   0.009
  283   1HB   TRP  39          1HB       TRP  39   0.863  -2.783  -2.053
  284   2HB   TRP  39          2HB       TRP  39   0.912  -4.539  -2.097
  285    HD1  TRP  39           HD1      TRP  39  -1.511  -5.828  -1.827
  286    HE1  TRP  39           HE1      TRP  39  -3.883  -5.042  -2.376
  287    HE3  TRP  39           HE3      TRP  39  -0.654  -0.800  -2.172
  288    HZ2  TRP  39           HZ2      TRP  39  -5.220  -2.610  -2.906
  289    HZ3  TRP  39           HZ3      TRP  39  -2.540   0.681  -2.720
  290    HH2  TRP  39           HH2      TRP  39  -4.774  -0.214  -3.076
  291    H    CYS  40           H        CYS  40   1.232  -1.278  -0.370
  292    HA   CYS  40           HA       CYS  40  -1.170  -0.277   0.947
  293   1HB   CYS  40          1HB       CYS  40  -0.029   1.010   2.600
  294   2HB   CYS  40          2HB       CYS  40   0.641  -0.612   2.733
  295    H    SER  41           H        SER  41  -1.158   2.221   0.659
  296    HA   SER  41           HA       SER  41   0.264   2.804  -1.839
  297   1HB   SER  41          1HB       SER  41  -1.420   4.613  -2.196
  298   2HB   SER  41          2HB       SER  41  -2.111   2.991  -2.167
  299    HG   SER  41           HG       SER  41  -2.461   5.111  -0.427
  300    H    THR  42           H        THR  42   1.213   4.929  -2.112
  301    HA   THR  42           HA       THR  42   2.408   5.860   0.367
  302    HB   THR  42           HB       THR  42   3.010   7.258  -2.168
  303    HG1  THR  42           HG1      THR  42   3.542   4.493  -1.804
  304   1HG2  THR  42          1HG2      THR  42   5.321   6.115  -1.199
  305   2HG2  THR  42          2HG2      THR  42   4.395   6.482   0.259
  306   3HG2  THR  42          3HG2      THR  42   4.762   7.760  -0.902
  307    H    THR  43           H        THR  43  -0.233   6.594  -1.521
  308    HA   THR  43           HA       THR  43  -0.402   9.312  -0.425
  309    HB   THR  43           HB       THR  43  -1.992   9.699  -2.374
  310    HG1  THR  43           HG1      THR  43  -2.419   8.041  -3.564
  311   1HG2  THR  43          1HG2      THR  43  -0.140  10.782  -3.001
  312   2HG2  THR  43          2HG2      THR  43   0.100   9.412  -4.085
  313   3HG2  THR  43          3HG2      THR  43   0.922   9.460  -2.524
  314    H    TYR  44           H        TYR  44  -2.875   9.961  -0.363
  315    HA   TYR  44           HA       TYR  44  -4.093   8.106   1.422
  316   1HB   TYR  44          1HB       TYR  44  -4.733  10.804   0.423
  317   2HB   TYR  44          2HB       TYR  44  -6.085   9.844   1.015
  318    HD1  TYR  44           HD1      TYR  44  -5.568  12.294   2.396
  319    HD2  TYR  44           HD2      TYR  44  -3.638   8.535   2.920
  320    HE1  TYR  44           HE1      TYR  44  -5.006  12.906   4.707
  321    HE2  TYR  44           HE2      TYR  44  -3.075   9.143   5.231
  322    HH   TYR  44           HH       TYR  44  -4.465  11.356   6.960
  323    H    ASN  45           H        ASN  45  -5.109   9.358  -1.764
  324    HA   ASN  45           HA       ASN  45  -6.966   7.107  -1.944
  325   1HB   ASN  45          1HB       ASN  45  -7.660   9.491  -2.494
  326   2HB   ASN  45          2HB       ASN  45  -6.646   9.376  -3.912
  327   1HD2  ASN  45          1HD2      ASN  45  -7.580   6.415  -4.046
  328   2HD2  ASN  45          2HD2      ASN  45  -9.098   6.631  -4.780
  329    H    PHE  46           H        PHE  46  -6.025   5.287  -2.702
  330    HA   PHE  46           HA       PHE  46  -3.663   5.203  -4.228
  331   1HB   PHE  46          1HB       PHE  46  -4.210   3.282  -2.935
  332   2HB   PHE  46          2HB       PHE  46  -5.799   3.120  -3.723
  333    HD1  PHE  46           HD1      PHE  46  -6.026   1.827  -5.662
  334    HD2  PHE  46           HD2      PHE  46  -2.115   2.899  -4.352
  335    HE1  PHE  46           HE1      PHE  46  -5.056   0.329  -7.345
  336    HE2  PHE  46           HE2      PHE  46  -1.144   1.394  -6.034
  337    HZ   PHE  46           HZ       PHE  46  -2.608   0.108  -7.533
  338    H    GLU  47           H        GLU  47  -7.051   4.874  -5.235
  339    HA   GLU  47           HA       GLU  47  -6.559   4.272  -7.921
  340   1HB   GLU  47          1HB       GLU  47  -8.739   4.064  -6.685
  341   2HB   GLU  47          2HB       GLU  47  -8.937   5.797  -6.862
  342   1HG   GLU  47          1HG       GLU  47  -8.922   5.567  -9.282
  343   2HG   GLU  47          2HG       GLU  47  -8.687   3.826  -9.120
  344    H    LYS  48           H        LYS  48  -7.295   7.415  -6.438
  345    HA   LYS  48           HA       LYS  48  -7.152   8.911  -8.795
  346   1HB   LYS  48          1HB       LYS  48  -8.117  10.296  -7.346
  347   2HB   LYS  48          2HB       LYS  48  -7.459   9.430  -5.967
  348   1HG   LYS  48          1HG       LYS  48  -5.483  10.740  -5.974
  349   2HG   LYS  48          2HG       LYS  48  -5.873  11.439  -7.548
  350   1HD   LYS  48          1HD       LYS  48  -7.742  12.628  -6.614
  351   2HD   LYS  48          2HD       LYS  48  -7.527  11.830  -5.053
  352   1HE   LYS  48          1HE       LYS  48  -5.501  13.647  -6.365
  353   2HE   LYS  48          2HE       LYS  48  -6.635  14.142  -5.109
  354   1HZ   LYS  48          1HZ       LYS  48  -4.348  13.553  -4.332
  355   2HZ   LYS  48          2HZ       LYS  48  -4.673  11.943  -4.736
  356   3HZ   LYS  48          3HZ       LYS  48  -5.602  12.720  -3.544
  357    H    ASP  49           H        ASP  49  -4.577   8.294  -6.385
  358    HA   ASP  49           HA       ASP  49  -2.752   9.885  -7.997
  359   1HB   ASP  49          1HB       ASP  49  -2.416   8.496  -5.343
  360   2HB   ASP  49          2HB       ASP  49  -1.127   9.387  -6.149
  361    H    GLY  50           H        GLY  50  -2.827   6.492  -6.836
  362   1HA   GLY  50          1HA       GLY  50  -2.265   4.632  -8.145
  363   2HA   GLY  50          2HA       GLY  50  -1.516   5.712  -9.302
  364    H    LYS  51           H        LYS  51  -0.506   6.352  -6.117
  365    HA   LYS  51           HA       LYS  51   2.061   5.077  -6.697
  366   1HB   LYS  51          1HB       LYS  51   1.260   7.145  -4.649
  367   2HB   LYS  51          2HB       LYS  51   2.847   6.403  -4.687
  368   1HG   LYS  51          1HG       LYS  51   3.127   8.419  -5.787
  369   2HG   LYS  51          2HG       LYS  51   2.977   7.240  -7.089
  370   1HD   LYS  51          1HD       LYS  51   0.557   7.850  -7.250
  371   2HD   LYS  51          2HD       LYS  51   0.868   9.149  -6.095
  372   1HE   LYS  51          1HE       LYS  51   2.504  10.124  -7.623
  373   2HE   LYS  51          2HE       LYS  51   2.215   8.817  -8.776
  374   1HZ   LYS  51          1HZ       LYS  51  -0.146   9.572  -8.842
  375   2HZ   LYS  51          2HZ       LYS  51   0.961  10.684  -9.481
  376   3HZ   LYS  51          3HZ       LYS  51   0.308  10.929  -7.923
  377    H    TYR  52           H        TYR  52   2.674   3.234  -5.706
  378    HA   TYR  52           HA       TYR  52   1.576   2.572  -3.099
  379   1HB   TYR  52          1HB       TYR  52   0.695   0.439  -3.765
  380   2HB   TYR  52          2HB       TYR  52  -0.014   1.660  -4.818
  381    HD1  TYR  52           HD1      TYR  52   1.290   2.076  -7.073
  382    HD2  TYR  52           HD2      TYR  52   1.619  -1.444  -4.711
  383    HE1  TYR  52           HE1      TYR  52   2.140   0.858  -9.024
  384    HE2  TYR  52           HE2      TYR  52   2.472  -2.678  -6.652
  385    HH   TYR  52           HH       TYR  52   3.559  -1.196  -9.445
  386    H    GLY  53           H        GLY  53   2.428   0.374  -2.415
  387   1HA   GLY  53          1HA       GLY  53   4.833  -0.602  -3.539
  388   2HA   GLY  53          2HA       GLY  53   5.156   0.407  -2.143
  389    H    PHE  54           H        PHE  54   5.745  -2.357  -2.255
  390    HA   PHE  54           HA       PHE  54   3.635  -3.640  -0.718
  391   1HB   PHE  54          1HB       PHE  54   6.250  -4.722  -1.748
  392   2HB   PHE  54          2HB       PHE  54   5.035  -5.674  -0.908
  393    HD1  PHE  54           HD1      PHE  54   5.768  -6.763  -3.338
  394    HD2  PHE  54           HD2      PHE  54   3.101  -3.515  -2.686
  395    HE1  PHE  54           HE1      PHE  54   4.674  -7.229  -5.487
  396    HE2  PHE  54           HE2      PHE  54   1.999  -3.971  -4.833
  397    HZ   PHE  54           HZ       PHE  54   2.785  -5.838  -6.243
  398    H    CYS  55           H        CYS  55   3.863  -4.385   1.391
  399    HA   CYS  55           HA       CYS  55   5.558  -2.820   3.056
  400   1HB   CYS  55          1HB       CYS  55   3.464  -4.851   3.491
  401   2HB   CYS  55          2HB       CYS  55   4.679  -4.734   4.756
  402    HA   PRO  56           HA       PRO  56   8.196  -6.629   3.749
  403   1HB   PRO  56          1HB       PRO  56   7.445  -9.090   3.058
  404   2HB   PRO  56          2HB       PRO  56   6.789  -8.286   4.484
  405   1HG   PRO  56          1HG       PRO  56   5.508  -8.850   1.885
  406   2HG   PRO  56          2HG       PRO  56   4.766  -8.614   3.474
  407   1HD   PRO  56          1HD       PRO  56   5.038  -6.713   1.346
  408   2HD   PRO  56          2HD       PRO  56   4.314  -6.464   2.946
  409    H    HIS  57           H        HIS  57   9.512  -8.456   2.569
  410    HA   HIS  57           HA       HIS  57   9.604  -7.879  -0.312
  411   1HB   HIS  57          1HB       HIS  57  12.025  -7.755  -0.271
  412   2HB   HIS  57          2HB       HIS  57  11.377  -6.577   0.865
  413    HD1  HIS  57           HD1      HIS  57  11.265  -7.670   3.483
  414    HD2  HIS  57           HD2      HIS  57  14.065  -9.154   0.778
  415    HE1  HIS  57           HE1      HIS  57  13.008  -8.837   4.877
  416    H    GLU  58           H        GLU  58  11.160  -9.538  -1.400
  417    HA   GLU  58           HA       GLU  58  10.681 -12.141  -0.146
  418   1HB   GLU  58          1HB       GLU  58  10.560 -13.077  -2.466
  419   2HB   GLU  58          2HB       GLU  58   9.211 -12.064  -2.004
  420   1HG   GLU  58          1HG       GLU  58  10.170 -10.223  -3.311
  421   2HG   GLU  58          2HG       GLU  58  11.515 -11.269  -3.775
  422    H    ALA  59           H        ALA  59  12.518 -12.897   0.583
  423    HA   ALA  59           HA       ALA  59  14.991 -12.332  -0.886
  424   1HB   ALA  59          1HB       ALA  59  15.355 -13.640   1.670
  425   2HB   ALA  59          2HB       ALA  59  14.398 -12.168   1.822
  426   3HB   ALA  59          3HB       ALA  59  16.000 -12.103   1.088
  Start of MODEL   23
    1   1H    ARG   1          1H        ARG   1   5.936  -1.256   8.477
    2   2H    ARG   1          2H        ARG   1   4.685  -0.574   9.433
    3   3H    ARG   1          3H        ARG   1   6.333  -0.351   9.880
    4    HA   ARG   1           HA       ARG   1   5.559   0.528   7.233
    5   1HB   ARG   1          1HB       ARG   1   3.690   1.154   8.857
    6   2HB   ARG   1          2HB       ARG   1   4.886   2.116   9.711
    7   1HG   ARG   1          1HG       ARG   1   5.244   3.135   7.289
    8   2HG   ARG   1          2HG       ARG   1   3.572   2.596   7.105
    9   1HD   ARG   1          1HD       ARG   1   3.288   4.737   7.900
   10   2HD   ARG   1          2HD       ARG   1   3.224   3.795   9.390
   11    HE   ARG   1           HE       ARG   1   5.875   4.508   9.016
   12   1HH1  ARG   1          1HH1      ARG   1   2.807   6.124   9.473
   13   2HH1  ARG   1          2HH1      ARG   1   3.497   7.518  10.248
   14   1HH2  ARG   1          1HH2      ARG   1   6.808   6.333  10.035
   15   2HH2  ARG   1          2HH2      ARG   1   5.786   7.631  10.584
   16    H    ILE   2           H        ILE   2   7.715   0.892   6.619
   17    HA   ILE   2           HA       ILE   2   9.061   2.989   8.027
   18    HB   ILE   2           HB       ILE   2  10.014   0.191   8.358
   19   1HG1  ILE   2          1HG1      ILE   2   9.083   1.583  10.206
   20   2HG1  ILE   2          2HG1      ILE   2  10.718   1.000  10.512
   21   1HG2  ILE   2          1HG2      ILE   2  11.678   1.595   6.907
   22   2HG2  ILE   2          2HG2      ILE   2  12.255   0.549   8.207
   23   3HG2  ILE   2          3HG2      ILE   2  12.110   2.291   8.474
   24   1HD1  ILE   2          1HD1      ILE   2  11.655   3.111  10.161
   25   2HD1  ILE   2          2HD1      ILE   2  10.194   3.413  11.106
   26   3HD1  ILE   2          3HD1      ILE   2  10.205   3.723   9.370
   27    HA   PRO   3           HA       PRO   3  11.436   2.472   4.090
   28   1HB   PRO   3          1HB       PRO   3  12.053   0.123   3.011
   29   2HB   PRO   3          2HB       PRO   3  12.733   0.660   4.551
   30   1HG   PRO   3          1HG       PRO   3  10.725  -1.430   4.014
   31   2HG   PRO   3          2HG       PRO   3  11.788  -1.223   5.415
   32   1HD   PRO   3          1HD       PRO   3   9.000  -0.428   5.121
   33   2HD   PRO   3          2HD       PRO   3  10.022  -0.350   6.571
   34    H    VAL   4           H        VAL   4   8.910   0.048   3.360
   35    HA   VAL   4           HA       VAL   4   7.508  -0.231   1.564
   36    HB   VAL   4           HB       VAL   4   8.487   2.514   0.662
   37   1HG1  VAL   4          1HG1      VAL   4   7.559   2.112  -1.310
   38   2HG1  VAL   4          2HG1      VAL   4   6.012   1.777  -0.531
   39   3HG1  VAL   4          3HG1      VAL   4   7.169   0.473  -0.808
   40   1HG2  VAL   4          1HG2      VAL   4   7.151   2.985   2.471
   41   2HG2  VAL   4          2HG2      VAL   4   6.104   1.588   2.209
   42   3HG2  VAL   4          3HG2      VAL   4   5.977   3.005   1.159
   43    H    LYS   5           H        LYS   5   7.887  -1.557  -0.099
   44    HA   LYS   5           HA       LYS   5  10.600  -1.617  -1.128
   45   1HB   LYS   5          1HB       LYS   5   8.440  -3.590  -0.798
   46   2HB   LYS   5          2HB       LYS   5   9.424  -3.801  -2.237
   47   1HG   LYS   5          1HG       LYS   5  10.379  -3.747   0.618
   48   2HG   LYS   5          2HG       LYS   5  10.306  -5.149  -0.467
   49   1HD   LYS   5          1HD       LYS   5  12.098  -4.461  -1.727
   50   2HD   LYS   5          2HD       LYS   5  11.893  -2.762  -1.294
   51   1HE   LYS   5          1HE       LYS   5  12.688  -3.260   0.985
   52   2HE   LYS   5          2HE       LYS   5  12.921  -4.948   0.521
   53   1HZ   LYS   5          1HZ       LYS   5  14.922  -3.390   0.456
   54   2HZ   LYS   5          2HZ       LYS   5  14.229  -2.741  -0.941
   55   3HZ   LYS   5          3HZ       LYS   5  14.667  -4.387  -0.901
   56    H    TYR   6           H        TYR   6   9.425  -3.239  -3.422
   57    HA   TYR   6           HA       TYR   6   9.797  -1.372  -5.428
   58   1HB   TYR   6          1HB       TYR   6   8.158  -3.858  -5.834
   59   2HB   TYR   6          2HB       TYR   6   9.310  -3.101  -6.936
   60    HD1  TYR   6           HD1      TYR   6   8.999  -5.202  -3.901
   61    HD2  TYR   6           HD2      TYR   6  11.680  -3.560  -6.778
   62    HE1  TYR   6           HE1      TYR   6  10.777  -6.663  -3.065
   63    HE2  TYR   6           HE2      TYR   6  13.457  -5.034  -5.954
   64    HH   TYR   6           HH       TYR   6  13.043  -7.676  -4.259
   65    H    GLY   7           H        GLY   7   8.299  -0.824  -7.155
   66   1HA   GLY   7          1HA       GLY   7   5.871  -0.646  -7.708
   67   2HA   GLY   7          2HA       GLY   7   5.670  -0.002  -6.090
   68    H    ASN   8           H        ASN   8   4.877   1.972  -6.876
   69    HA   ASN   8           HA       ASN   8   6.958   3.598  -8.172
   70   1HB   ASN   8          1HB       ASN   8   5.239   4.886  -9.329
   71   2HB   ASN   8          2HB       ASN   8   5.115   3.175  -9.728
   72   1HD2  ASN   8          1HD2      ASN   8   3.142   5.366  -9.824
   73   2HD2  ASN   8          2HD2      ASN   8   1.809   4.799  -8.889
   74    H    ALA   9           H        ALA   9   6.160   3.195  -5.294
   75    HA   ALA   9           HA       ALA   9   5.518   5.955  -4.552
   76   1HB   ALA   9          1HB       ALA   9   5.609   3.533  -2.786
   77   2HB   ALA   9          2HB       ALA   9   4.148   4.161  -3.557
   78   3HB   ALA   9          3HB       ALA   9   5.006   5.139  -2.365
   79    H    ASP  10           H        ASP  10   8.134   4.589  -5.467
   80    HA   ASP  10           HA       ASP  10  10.359   4.737  -5.081
   81   1HB   ASP  10          1HB       ASP  10   9.443   7.089  -3.429
   82   2HB   ASP  10          2HB       ASP  10  11.144   6.697  -3.666
   83    H    GLY  11           H        GLY  11  10.586   6.055  -2.038
   84   1HA   GLY  11          1HA       GLY  11  10.450   3.482  -0.672
   85   2HA   GLY  11          2HA       GLY  11  11.982   4.340  -0.678
   86    H    GLU  12           H        GLU  12   8.579   5.300  -0.200
   87    HA   GLU  12           HA       GLU  12   9.409   7.006   2.002
   88   1HB   GLU  12          1HB       GLU  12   6.674   6.599   0.771
   89   2HB   GLU  12          2HB       GLU  12   7.102   7.839   1.939
   90   1HG   GLU  12          1HG       GLU  12   8.289   7.593  -0.816
   91   2HG   GLU  12          2HG       GLU  12   6.956   8.664  -0.381
   92    H    TYR  13           H        TYR  13   6.415   6.422   2.874
   93    HA   TYR  13           HA       TYR  13   6.897   3.971   4.360
   94   1HB   TYR  13          1HB       TYR  13   6.230   5.011   6.373
   95   2HB   TYR  13          2HB       TYR  13   7.547   5.944   5.690
   96    HD1  TYR  13           HD1      TYR  13   3.931   5.849   6.318
   97    HD2  TYR  13           HD2      TYR  13   7.239   8.162   5.011
   98    HE1  TYR  13           HE1      TYR  13   2.549   7.884   6.479
   99    HE2  TYR  13           HE2      TYR  13   5.882  10.213   5.167
  100    HH   TYR  13           HH       TYR  13   3.545  10.882   5.160
  101    H    CYS  14           H        CYS  14   4.841   3.084   5.260
  102    HA   CYS  14           HA       CYS  14   2.744   3.262   3.325
  103   1HB   CYS  14          1HB       CYS  14   2.829   1.861   6.007
  104   2HB   CYS  14          2HB       CYS  14   1.533   1.693   4.835
  105    H    LYS  15           H        LYS  15   1.174   4.751   3.279
  106    HA   LYS  15           HA       LYS  15   0.809   6.503   5.553
  107   1HB   LYS  15          1HB       LYS  15   0.873   7.313   3.176
  108   2HB   LYS  15          2HB       LYS  15  -0.674   6.519   2.916
  109   1HG   LYS  15          1HG       LYS  15  -1.787   7.988   4.389
  110   2HG   LYS  15          2HG       LYS  15  -0.266   8.619   5.031
  111   1HD   LYS  15          1HD       LYS  15   0.250   9.565   2.811
  112   2HD   LYS  15          2HD       LYS  15  -1.304   8.969   2.220
  113   1HE   LYS  15          1HE       LYS  15  -2.510  10.417   3.660
  114   2HE   LYS  15          2HE       LYS  15  -1.055  10.839   4.562
  115   1HZ   LYS  15          1HZ       LYS  15  -1.698  11.599   1.763
  116   2HZ   LYS  15          2HZ       LYS  15  -0.194  11.863   2.498
  117   3HZ   LYS  15          3HZ       LYS  15  -1.584  12.627   3.111
  118    H    PHE  16           H        PHE  16  -0.514   6.032   7.142
  119    HA   PHE  16           HA       PHE  16  -2.926   4.444   6.550
  120   1HB   PHE  16          1HB       PHE  16  -1.308   4.513   9.106
  121   2HB   PHE  16          2HB       PHE  16  -2.799   3.608   8.875
  122    HD1  PHE  16           HD1      PHE  16  -2.436   2.406   6.252
  123    HD2  PHE  16           HD2      PHE  16   0.358   2.989   9.402
  124    HE1  PHE  16           HE1      PHE  16  -1.142   0.485   5.455
  125    HE2  PHE  16           HE2      PHE  16   1.667   1.080   8.615
  126    HZ   PHE  16           HZ       PHE  16   0.937  -0.200   6.620
  127    HA   PRO  17           HA       PRO  17  -4.639   4.122   6.772
  128   1HB   PRO  17          1HB       PRO  17  -7.256   4.925   6.477
  129   2HB   PRO  17          2HB       PRO  17  -6.618   4.095   7.898
  130   1HG   PRO  17          1HG       PRO  17  -7.578   6.803   7.722
  131   2HG   PRO  17          2HG       PRO  17  -6.970   5.947   9.146
  132   1HD   PRO  17          1HD       PRO  17  -5.591   7.864   7.376
  133   2HD   PRO  17          2HD       PRO  17  -5.223   7.404   9.053
  134    H    PHE  18           H        PHE  18  -4.774   3.697   4.585
  135    HA   PHE  18           HA       PHE  18  -4.979   6.049   2.845
  136   1HB   PHE  18          1HB       PHE  18  -3.959   4.738   1.081
  137   2HB   PHE  18          2HB       PHE  18  -2.957   4.687   2.523
  138    HD1  PHE  18           HD1      PHE  18  -2.963   2.606   3.928
  139    HD2  PHE  18           HD2      PHE  18  -4.780   2.777   0.083
  140    HE1  PHE  18           HE1      PHE  18  -2.923   0.150   3.802
  141    HE2  PHE  18           HE2      PHE  18  -4.749   0.329  -0.055
  142    HZ   PHE  18           HZ       PHE  18  -3.809  -1.010   1.805
  143    H    LEU  19           H        LEU  19  -6.332   5.982   0.967
  144    HA   LEU  19           HA       LEU  19  -8.768   4.479   1.511
  145   1HB   LEU  19          1HB       LEU  19  -8.712   6.972   1.124
  146   2HB   LEU  19          2HB       LEU  19  -8.331   6.623  -0.552
  147    HG   LEU  19           HG       LEU  19 -10.472   5.342  -0.704
  148   1HD1  LEU  19          1HD1      LEU  19 -11.101   4.724   1.413
  149   2HD1  LEU  19          2HD1      LEU  19 -12.126   6.133   1.153
  150   3HD1  LEU  19          3HD1      LEU  19 -10.660   6.281   2.118
  151   1HD2  LEU  19          1HD2      LEU  19 -11.874   7.319  -0.857
  152   2HD2  LEU  19          2HD2      LEU  19 -10.268   7.645  -1.505
  153   3HD2  LEU  19          3HD2      LEU  19 -10.707   8.238   0.096
  154    H    PHE  20           H        PHE  20  -9.169   2.642   0.544
  155    HA   PHE  20           HA       PHE  20  -8.249   2.208  -2.232
  156   1HB   PHE  20          1HB       PHE  20  -7.081   0.789  -0.387
  157   2HB   PHE  20          2HB       PHE  20  -8.646   0.015  -0.214
  158    HD1  PHE  20           HD1      PHE  20  -7.307  -2.017  -0.639
  159    HD2  PHE  20           HD2      PHE  20  -7.995   0.949  -3.610
  160    HE1  PHE  20           HE1      PHE  20  -6.782  -3.678  -2.378
  161    HE2  PHE  20           HE2      PHE  20  -7.477  -0.707  -5.365
  162    HZ   PHE  20           HZ       PHE  20  -6.872  -3.017  -4.757
  163    H    ASN  21           H        ASN  21 -10.115   2.509  -3.338
  164    HA   ASN  21           HA       ASN  21 -12.245   2.239  -4.082
  165   1HB   ASN  21          1HB       ASN  21 -11.717  -0.402  -2.780
  166   2HB   ASN  21          2HB       ASN  21 -13.327  -0.044  -3.389
  167   1HD2  ASN  21          1HD2      ASN  21 -13.652  -0.867  -5.303
  168   2HD2  ASN  21          2HD2      ASN  21 -12.494  -0.990  -6.579
  169    H    GLY  22           H        GLY  22 -11.829   3.567  -1.489
  170   1HA   GLY  22          1HA       GLY  22 -13.514   4.733  -0.313
  171   2HA   GLY  22          2HA       GLY  22 -14.615   3.401  -0.597
  172    H    LYS  23           H        LYS  23 -11.973   1.832   0.369
  173    HA   LYS  23           HA       LYS  23 -12.842   1.964   3.173
  174   1HB   LYS  23          1HB       LYS  23 -12.990  -0.238   1.896
  175   2HB   LYS  23          2HB       LYS  23 -11.234  -0.264   1.900
  176   1HG   LYS  23          1HG       LYS  23 -12.695   0.025   4.487
  177   2HG   LYS  23          2HG       LYS  23 -12.588  -1.549   3.716
  178   1HD   LYS  23          1HD       LYS  23 -10.225  -1.556   3.824
  179   2HD   LYS  23          2HD       LYS  23 -10.173   0.158   4.241
  180   1HE   LYS  23          1HE       LYS  23  -9.734  -1.338   6.163
  181   2HE   LYS  23          2HE       LYS  23 -11.123  -0.282   6.401
  182   1HZ   LYS  23          1HZ       LYS  23 -11.393  -2.671   7.089
  183   2HZ   LYS  23          2HZ       LYS  23 -11.401  -3.076   5.439
  184   3HZ   LYS  23          3HZ       LYS  23 -12.605  -2.052   6.071
  185    H    GLU  24           H        GLU  24 -11.426   2.457   4.776
  186    HA   GLU  24           HA       GLU  24  -8.757   3.338   3.919
  187   1HB   GLU  24          1HB       GLU  24 -10.258   3.917   6.478
  188   2HB   GLU  24          2HB       GLU  24  -8.714   4.615   6.015
  189   1HG   GLU  24          1HG       GLU  24  -9.797   5.677   4.092
  190   2HG   GLU  24          2HG       GLU  24 -11.343   5.013   4.614
  191    H    TYR  25           H        TYR  25  -7.132   1.977   4.264
  192    HA   TYR  25           HA       TYR  25  -7.394  -0.103   6.290
  193   1HB   TYR  25          1HB       TYR  25  -5.355   0.335   4.134
  194   2HB   TYR  25          2HB       TYR  25  -5.294  -1.006   5.261
  195    HD1  TYR  25           HD1      TYR  25  -7.221   0.515   2.532
  196    HD2  TYR  25           HD2      TYR  25  -6.683  -2.929   4.964
  197    HE1  TYR  25           HE1      TYR  25  -8.745  -0.741   1.050
  198    HE2  TYR  25           HE2      TYR  25  -8.198  -4.206   3.481
  199    HH   TYR  25           HH       TYR  25  -9.659  -2.717   0.594
  200    H    ASN  26           H        ASN  26  -6.361  -0.133   8.147
  201    HA   ASN  26           HA       ASN  26  -4.599   2.115   8.766
  202   1HB   ASN  26          1HB       ASN  26  -5.849   0.036  10.588
  203   2HB   ASN  26          2HB       ASN  26  -4.828   1.359  11.131
  204   1HD2  ASN  26          1HD2      ASN  26  -6.797   2.279   8.530
  205   2HD2  ASN  26          2HD2      ASN  26  -8.042   3.065   9.436
  206    H    SER  27           H        SER  27  -4.253  -0.810   7.476
  207    HA   SER  27           HA       SER  27  -1.474  -1.015   8.247
  208   1HB   SER  27          1HB       SER  27  -1.672  -3.470   8.700
  209   2HB   SER  27          2HB       SER  27  -2.471  -2.460   9.911
  210    HG   SER  27           HG       SER  27  -3.532  -4.411   8.452
  211    H    CYS  28           H        CYS  28  -0.620  -3.157   6.969
  212    HA   CYS  28           HA       CYS  28  -1.155  -2.530   4.211
  213   1HB   CYS  28          1HB       CYS  28   0.615  -4.677   5.402
  214   2HB   CYS  28          2HB       CYS  28   0.593  -4.181   3.712
  215    H    THR  29           H        THR  29  -2.184  -3.809   2.691
  216    HA   THR  29           HA       THR  29  -3.485  -6.222   3.699
  217    HB   THR  29           HB       THR  29  -5.097  -4.386   3.670
  218    HG1  THR  29           HG1      THR  29  -5.972  -6.363   3.194
  219   1HG2  THR  29          1HG2      THR  29  -4.664  -4.193   0.691
  220   2HG2  THR  29          2HG2      THR  29  -4.122  -3.005   1.873
  221   3HG2  THR  29          3HG2      THR  29  -5.845  -3.300   1.652
  222    H    ASP  30           H        ASP  30  -4.236  -7.702   1.958
  223    HA   ASP  30           HA       ASP  30  -2.348  -7.645  -0.271
  224   1HB   ASP  30          1HB       ASP  30  -3.810 -10.110  -0.002
  225   2HB   ASP  30          2HB       ASP  30  -2.096  -9.856  -0.153
  226    H    THR  31           H        THR  31  -5.238  -6.574   0.321
  227    HA   THR  31           HA       THR  31  -6.997  -7.736  -1.527
  228    HB   THR  31           HB       THR  31  -6.915  -4.848  -0.645
  229    HG1  THR  31           HG1      THR  31  -7.008  -5.946   1.227
  230   1HG2  THR  31          1HG2      THR  31  -9.243  -4.766  -0.995
  231   2HG2  THR  31          2HG2      THR  31  -9.328  -6.498  -1.310
  232   3HG2  THR  31          3HG2      THR  31  -8.535  -5.427  -2.466
  233    H    GLY  32           H        GLY  32  -7.310  -7.452  -3.678
  234   1HA   GLY  32          1HA       GLY  32  -7.104  -6.442  -5.769
  235   2HA   GLY  32          2HA       GLY  32  -5.955  -5.307  -5.075
  236    H    ARG  33           H        ARG  33  -4.599  -7.720  -3.810
  237    HA   ARG  33           HA       ARG  33  -2.906  -8.386  -6.116
  238   1HB   ARG  33          1HB       ARG  33  -2.415  -8.769  -3.152
  239   2HB   ARG  33          2HB       ARG  33  -1.253  -9.072  -4.429
  240   1HG   ARG  33          1HG       ARG  33  -2.429  -6.389  -3.740
  241   2HG   ARG  33          2HG       ARG  33  -0.840  -6.963  -3.240
  242   1HD   ARG  33          1HD       ARG  33  -1.788  -6.457  -6.062
  243   2HD   ARG  33          2HD       ARG  33  -0.636  -5.491  -5.146
  244    HE   ARG  33           HE       ARG  33   0.139  -8.254  -5.529
  245   1HH1  ARG  33          1HH1      ARG  33   0.312  -4.967  -6.707
  246   2HH1  ARG  33          2HH1      ARG  33   1.664  -5.287  -7.761
  247   1HH2  ARG  33          1HH2      ARG  33   1.873  -8.689  -6.910
  248   2HH2  ARG  33          2HH2      ARG  33   2.553  -7.413  -7.880
  249    H    SER  34           H        SER  34  -3.256 -10.320  -7.041
  250    HA   SER  34           HA       SER  34  -4.777 -12.342  -5.639
  251   1HB   SER  34          1HB       SER  34  -3.441 -12.454  -8.351
  252   2HB   SER  34          2HB       SER  34  -4.616 -13.614  -7.729
  253    HG   SER  34           HG       SER  34  -5.095 -11.396  -9.061
  254    H    ASP  35           H        ASP  35  -1.574 -11.442  -5.768
  255    HA   ASP  35           HA       ASP  35  -0.460 -14.061  -5.551
  256   1HB   ASP  35          1HB       ASP  35   1.298 -11.910  -4.851
  257   2HB   ASP  35          2HB       ASP  35   1.491 -13.111  -6.095
  258    H    GLY  36           H        GLY  36  -1.974 -12.049  -3.498
  259   1HA   GLY  36          1HA       GLY  36  -2.241 -12.042  -1.215
  260   2HA   GLY  36          2HA       GLY  36  -1.292 -13.522  -1.177
  261    H    PHE  37           H        PHE  37  -0.341 -10.299  -2.329
  262    HA   PHE  37           HA       PHE  37   1.834 -10.361  -0.357
  263   1HB   PHE  37          1HB       PHE  37   1.629  -9.100  -3.078
  264   2HB   PHE  37          2HB       PHE  37   2.817  -8.538  -1.908
  265    HD1  PHE  37           HD1      PHE  37   3.919 -10.803  -0.675
  266    HD2  PHE  37           HD2      PHE  37   2.596 -10.398  -4.699
  267    HE1  PHE  37           HE1      PHE  37   5.469 -12.585  -1.356
  268    HE2  PHE  37           HE2      PHE  37   4.143 -12.187  -5.390
  269    HZ   PHE  37           HZ       PHE  37   5.580 -13.284  -3.718
  270    H    LEU  38           H        LEU  38   2.131  -8.727   1.052
  271    HA   LEU  38           HA       LEU  38  -0.086  -6.949   1.473
  272   1HB   LEU  38          1HB       LEU  38   2.523  -7.295   2.905
  273   2HB   LEU  38          2HB       LEU  38   1.319  -6.128   3.395
  274    HG   LEU  38           HG       LEU  38   0.934  -9.119   3.329
  275   1HD1  LEU  38          1HD1      LEU  38   0.693  -7.834   5.900
  276   2HD1  LEU  38          2HD1      LEU  38   2.284  -7.550   5.199
  277   3HD1  LEU  38          3HD1      LEU  38   1.699  -9.198   5.416
  278   1HD2  LEU  38          1HD2      LEU  38  -1.029  -8.032   4.901
  279   2HD2  LEU  38          2HD2      LEU  38  -1.230  -8.566   3.232
  280   3HD2  LEU  38          3HD2      LEU  38  -0.906  -6.869   3.580
  281    H    TRP  39           H        TRP  39  -0.238  -4.866   0.948
  282    HA   TRP  39           HA       TRP  39   2.181  -3.409   0.186
  283   1HB   TRP  39          1HB       TRP  39   1.174  -2.522  -1.846
  284   2HB   TRP  39          2HB       TRP  39   1.201  -4.275  -1.918
  285    HD1  TRP  39           HD1      TRP  39  -1.184  -5.538  -1.611
  286    HE1  TRP  39           HE1      TRP  39  -3.557  -4.764  -2.179
  287    HE3  TRP  39           HE3      TRP  39  -0.354  -0.504  -1.896
  288    HZ2  TRP  39           HZ2      TRP  39  -4.908  -2.333  -2.669
  289    HZ3  TRP  39           HZ3      TRP  39  -2.251   0.974  -2.423
  290    HH2  TRP  39           HH2      TRP  39  -4.478   0.067  -2.797
  291    H    CYS  40           H        CYS  40   1.476  -1.013  -0.250
  292    HA   CYS  40           HA       CYS  40  -0.789  -0.115   1.298
  293   1HB   CYS  40          1HB       CYS  40   0.594   1.199   2.885
  294   2HB   CYS  40          2HB       CYS  40   0.816  -0.536   3.082
  295    H    SER  41           H        SER  41  -1.066   2.214   1.115
  296    HA   SER  41           HA       SER  41   0.184   3.249  -1.319
  297   1HB   SER  41          1HB       SER  41  -2.254   3.300  -1.303
  298   2HB   SER  41          2HB       SER  41  -2.253   4.186   0.220
  299    HG   SER  41           HG       SER  41  -2.216   5.910  -0.959
  300    H    THR  42           H        THR  42   0.760   5.557  -1.328
  301    HA   THR  42           HA       THR  42   1.870   6.386   1.274
  302    HB   THR  42           HB       THR  42   2.944   7.114  -1.464
  303    HG1  THR  42           HG1      THR  42   4.023   5.199   0.324
  304   1HG2  THR  42          1HG2      THR  42   3.867   8.671  -0.038
  305   2HG2  THR  42          2HG2      THR  42   5.065   7.379  -0.001
  306   3HG2  THR  42          3HG2      THR  42   3.915   7.552   1.323
  307    H    THR  43           H        THR  43  -0.348   6.995  -1.100
  308    HA   THR  43           HA       THR  43  -0.613   9.812  -0.361
  309    HB   THR  43           HB       THR  43  -0.198   9.581  -2.723
  310    HG1  THR  43           HG1      THR  43  -1.601  11.146  -2.731
  311   1HG2  THR  43          1HG2      THR  43  -2.119   7.385  -2.506
  312   2HG2  THR  43          2HG2      THR  43  -0.757   7.615  -3.604
  313   3HG2  THR  43          3HG2      THR  43  -2.295   8.418  -3.925
  314    H    TYR  44           H        TYR  44  -2.925  10.566  -0.289
  315    HA   TYR  44           HA       TYR  44  -4.404   8.924   1.481
  316   1HB   TYR  44          1HB       TYR  44  -4.453  11.474   1.323
  317   2HB   TYR  44          2HB       TYR  44  -5.520  11.275  -0.064
  318    HD1  TYR  44           HD1      TYR  44  -7.601   9.592   0.478
  319    HD2  TYR  44           HD2      TYR  44  -5.449  11.870   3.365
  320    HE1  TYR  44           HE1      TYR  44  -9.523   9.471   2.005
  321    HE2  TYR  44           HE2      TYR  44  -7.370  11.753   4.891
  322    HH   TYR  44           HH       TYR  44 -10.320   9.980   4.013
  323    H    ASN  45           H        ASN  45  -5.369  10.095  -1.765
  324    HA   ASN  45           HA       ASN  45  -7.169   7.814  -1.953
  325   1HB   ASN  45          1HB       ASN  45  -7.861  10.187  -2.591
  326   2HB   ASN  45          2HB       ASN  45  -6.834  10.017  -3.999
  327   1HD2  ASN  45          1HD2      ASN  45  -7.701   7.065  -4.050
  328   2HD2  ASN  45          2HD2      ASN  45  -9.246   7.199  -4.738
  329    H    PHE  46           H        PHE  46  -6.045   6.028  -2.478
  330    HA   PHE  46           HA       PHE  46  -3.804   6.040  -4.259
  331   1HB   PHE  46          1HB       PHE  46  -3.775   4.412  -2.533
  332   2HB   PHE  46          2HB       PHE  46  -5.409   3.844  -2.943
  333    HD1  PHE  46           HD1      PHE  46  -5.735   2.243  -4.702
  334    HD2  PHE  46           HD2      PHE  46  -1.853   3.849  -3.981
  335    HE1  PHE  46           HE1      PHE  46  -4.774   0.542  -6.168
  336    HE2  PHE  46           HE2      PHE  46  -0.888   2.133  -5.459
  337    HZ   PHE  46           HZ       PHE  46  -2.331   0.481  -6.546
  338    H    GLU  47           H        GLU  47  -7.211   5.424  -4.585
  339    HA   GLU  47           HA       GLU  47  -7.352   3.969  -6.909
  340   1HB   GLU  47          1HB       GLU  47  -9.204   4.698  -5.341
  341   2HB   GLU  47          2HB       GLU  47  -9.226   6.218  -6.217
  342   1HG   GLU  47          1HG       GLU  47  -9.804   5.067  -8.261
  343   2HG   GLU  47          2HG       GLU  47  -9.705   3.511  -7.435
  344    H    LYS  48           H        LYS  48  -7.276   7.542  -6.655
  345    HA   LYS  48           HA       LYS  48  -7.167   7.743  -9.537
  346   1HB   LYS  48          1HB       LYS  48  -7.249  10.138  -9.253
  347   2HB   LYS  48          2HB       LYS  48  -8.470   9.375  -8.249
  348   1HG   LYS  48          1HG       LYS  48  -7.383   9.918  -6.284
  349   2HG   LYS  48          2HG       LYS  48  -5.814  10.098  -7.077
  350   1HD   LYS  48          1HD       LYS  48  -8.168  11.946  -7.501
  351   2HD   LYS  48          2HD       LYS  48  -6.838  12.261  -6.382
  352   1HE   LYS  48          1HE       LYS  48  -5.246  12.265  -8.208
  353   2HE   LYS  48          2HE       LYS  48  -6.515  11.821  -9.350
  354   1HZ   LYS  48          1HZ       LYS  48  -6.140  14.136  -9.553
  355   2HZ   LYS  48          2HZ       LYS  48  -6.227  14.388  -7.879
  356   3HZ   LYS  48          3HZ       LYS  48  -7.630  13.959  -8.745
  357    H    ASP  49           H        ASP  49  -4.862   7.851  -6.929
  358    HA   ASP  49           HA       ASP  49  -2.844   9.078  -8.605
  359   1HB   ASP  49          1HB       ASP  49  -2.974   8.222  -5.748
  360   2HB   ASP  49          2HB       ASP  49  -1.394   8.401  -6.507
  361    H    GLY  50           H        GLY  50  -2.914   6.034  -6.765
  362   1HA   GLY  50          1HA       GLY  50  -2.450   3.910  -7.664
  363   2HA   GLY  50          2HA       GLY  50  -1.762   4.696  -9.072
  364    H    LYS  51           H        LYS  51  -0.605   6.108  -6.231
  365    HA   LYS  51           HA       LYS  51   1.996   4.907  -6.653
  366   1HB   LYS  51          1HB       LYS  51   1.041   7.061  -4.764
  367   2HB   LYS  51          2HB       LYS  51   2.670   6.422  -4.717
  368   1HG   LYS  51          1HG       LYS  51   2.971   8.273  -5.996
  369   2HG   LYS  51          2HG       LYS  51   2.664   7.070  -7.249
  370   1HD   LYS  51          1HD       LYS  51   0.367   7.794  -7.438
  371   2HD   LYS  51          2HD       LYS  51   0.576   8.908  -6.081
  372   1HE   LYS  51          1HE       LYS  51   2.254  10.149  -7.387
  373   2HE   LYS  51          2HE       LYS  51   1.991   9.054  -8.746
  374   1HZ   LYS  51          1HZ       LYS  51  -0.301  10.512  -7.598
  375   2HZ   LYS  51          2HZ       LYS  51  -0.066   9.936  -9.185
  376   3HZ   LYS  51          3HZ       LYS  51   0.758  11.318  -8.655
  377    H    TYR  52           H        TYR  52   2.399   2.965  -5.819
  378    HA   TYR  52           HA       TYR  52   1.629   2.468  -3.029
  379   1HB   TYR  52          1HB       TYR  52   0.868   0.239  -3.550
  380   2HB   TYR  52          2HB       TYR  52  -0.007   1.365  -4.582
  381    HD1  TYR  52           HD1      TYR  52   2.592  -1.236  -4.482
  382    HD2  TYR  52           HD2      TYR  52   0.324   1.353  -6.978
  383    HE1  TYR  52           HE1      TYR  52   3.344  -2.491  -6.449
  384    HE2  TYR  52           HE2      TYR  52   1.069   0.101  -8.955
  385    HH   TYR  52           HH       TYR  52   3.622  -1.844  -9.058
  386    H    GLY  53           H        GLY  53   2.759   0.595  -2.131
  387   1HA   GLY  53          1HA       GLY  53   5.221  -0.229  -3.430
  388   2HA   GLY  53          2HA       GLY  53   5.402   0.706  -1.952
  389    H    PHE  54           H        PHE  54   6.189  -2.033  -2.378
  390    HA   PHE  54           HA       PHE  54   4.195  -3.649  -1.165
  391   1HB   PHE  54          1HB       PHE  54   7.054  -4.209  -1.871
  392   2HB   PHE  54          2HB       PHE  54   6.022  -5.404  -1.095
  393    HD1  PHE  54           HD1      PHE  54   5.978  -3.078  -4.011
  394    HD2  PHE  54           HD2      PHE  54   4.889  -6.874  -2.432
  395    HE1  PHE  54           HE1      PHE  54   5.063  -3.718  -6.196
  396    HE2  PHE  54           HE2      PHE  54   3.973  -7.525  -4.615
  397    HZ   PHE  54           HZ       PHE  54   4.061  -5.941  -6.509
  398    H    CYS  55           H        CYS  55   4.130  -4.610   0.787
  399    HA   CYS  55           HA       CYS  55   5.437  -3.103   2.925
  400   1HB   CYS  55          1HB       CYS  55   2.886  -3.498   2.708
  401   2HB   CYS  55          2HB       CYS  55   3.236  -5.137   3.239
  402    HA   PRO  56           HA       PRO  56   8.223  -6.570   3.450
  403   1HB   PRO  56          1HB       PRO  56   9.236  -5.735   5.851
  404   2HB   PRO  56          2HB       PRO  56   9.811  -5.188   4.278
  405   1HG   PRO  56          1HG       PRO  56   7.954  -3.843   6.187
  406   2HG   PRO  56          2HG       PRO  56   9.223  -3.142   5.166
  407   1HD   PRO  56          1HD       PRO  56   6.610  -2.985   4.523
  408   2HD   PRO  56          2HD       PRO  56   7.881  -3.116   3.293
  409    H    HIS  57           H        HIS  57   6.870  -8.272   3.812
  410    HA   HIS  57           HA       HIS  57   5.841  -8.610   6.544
  411   1HB   HIS  57          1HB       HIS  57   4.329 -10.346   5.529
  412   2HB   HIS  57          2HB       HIS  57   4.032  -8.704   4.977
  413    HD1  HIS  57           HD1      HIS  57   5.315  -8.174   2.552
  414    HD2  HIS  57           HD2      HIS  57   4.439 -12.123   3.529
  415    HE1  HIS  57           HE1      HIS  57   5.416  -9.448   0.384
  416    H    GLU  58           H        GLU  58   5.929 -10.779   7.449
  417    HA   GLU  58           HA       GLU  58   8.528 -11.875   7.199
  418   1HB   GLU  58          1HB       GLU  58   7.693 -13.604   8.811
  419   2HB   GLU  58          2HB       GLU  58   7.490 -11.943   9.348
  420   1HG   GLU  58          1HG       GLU  58   5.108 -12.127   8.448
  421   2HG   GLU  58          2HG       GLU  58   5.405 -13.864   8.374
  422    H    ALA  59           H        ALA  59   9.282 -13.435   5.969
  423    HA   ALA  59           HA       ALA  59   7.587 -15.509   4.893
  424   1HB   ALA  59          1HB       ALA  59   7.480 -14.880   2.736
  425   2HB   ALA  59          2HB       ALA  59   9.112 -14.218   2.744
  426   3HB   ALA  59          3HB       ALA  59   7.771 -13.262   3.368
  Start of MODEL   24
    1   1H    ARG   1          1H        ARG   1   6.597   5.486  10.655
    2   2H    ARG   1          2H        ARG   1   7.424   5.907   9.209
    3   3H    ARG   1          3H        ARG   1   8.214   6.064  10.727
    4    HA   ARG   1           HA       ARG   1   8.500   3.875  10.971
    5   1HB   ARG   1          1HB       ARG   1   7.259   2.217   9.526
    6   2HB   ARG   1          2HB       ARG   1   6.304   3.079  10.727
    7   1HG   ARG   1          1HG       ARG   1   5.184   4.282   9.183
    8   2HG   ARG   1          2HG       ARG   1   6.505   4.229   8.013
    9   1HD   ARG   1          1HD       ARG   1   4.920   1.787   8.782
   10   2HD   ARG   1          2HD       ARG   1   4.439   2.850   7.454
   11    HE   ARG   1           HE       ARG   1   7.015   2.274   6.856
   12   1HH1  ARG   1          1HH1      ARG   1   4.341   0.215   7.779
   13   2HH1  ARG   1          2HH1      ARG   1   4.847  -1.108   6.776
   14   1HH2  ARG   1          1HH2      ARG   1   7.665   0.566   5.488
   15   2HH2  ARG   1          2HH2      ARG   1   6.727  -0.893   5.435
   16    H    ILE   2           H        ILE   2   9.180   2.036   9.233
   17    HA   ILE   2           HA       ILE   2  11.256   3.239   7.712
   18    HB   ILE   2           HB       ILE   2  11.572   0.904   6.767
   19   1HG1  ILE   2          1HG1      ILE   2   9.352   0.260   8.722
   20   2HG1  ILE   2          2HG1      ILE   2   9.273   0.127   6.965
   21   1HG2  ILE   2          1HG2      ILE   2  12.429  -0.078   8.863
   22   2HG2  ILE   2          2HG2      ILE   2  11.567   1.145   9.791
   23   3HG2  ILE   2          3HG2      ILE   2  12.875   1.621   8.707
   24   1HD1  ILE   2          1HD1      ILE   2  10.215  -1.886   6.984
   25   2HD1  ILE   2          2HD1      ILE   2   9.903  -1.886   8.716
   26   3HD1  ILE   2          3HD1      ILE   2  11.479  -1.375   8.111
   27    HA   PRO   3           HA       PRO   3   9.683   4.011   3.726
   28   1HB   PRO   3          1HB       PRO   3  11.472   2.712   2.101
   29   2HB   PRO   3          2HB       PRO   3  11.794   4.254   2.907
   30   1HG   PRO   3          1HG       PRO   3  12.522   1.475   3.778
   31   2HG   PRO   3          2HG       PRO   3  13.540   2.931   3.735
   32   1HD   PRO   3          1HD       PRO   3  12.467   2.137   6.032
   33   2HD   PRO   3          2HD       PRO   3  12.485   3.864   5.606
   34    H    VAL   4           H        VAL   4   9.474   2.901   1.474
   35    HA   VAL   4           HA       VAL   4   7.894   0.429   1.827
   36    HB   VAL   4           HB       VAL   4   7.736   2.700  -0.188
   37   1HG1  VAL   4          1HG1      VAL   4   7.513   0.225  -1.067
   38   2HG1  VAL   4          2HG1      VAL   4   6.439   1.515  -1.615
   39   3HG1  VAL   4          3HG1      VAL   4   5.901   0.386  -0.371
   40   1HG2  VAL   4          1HG2      VAL   4   5.219   1.928   0.804
   41   2HG2  VAL   4          2HG2      VAL   4   6.118   3.403   1.158
   42   3HG2  VAL   4          3HG2      VAL   4   6.308   1.984   2.189
   43    H    LYS   5           H        LYS   5   8.096  -1.230   0.300
   44    HA   LYS   5           HA       LYS   5  10.815  -1.560  -0.595
   45   1HB   LYS   5          1HB       LYS   5   8.419  -3.306  -0.303
   46   2HB   LYS   5          2HB       LYS   5   9.768  -3.852  -1.287
   47   1HG   LYS   5          1HG       LYS   5   9.700  -3.286   1.658
   48   2HG   LYS   5          2HG       LYS   5  10.100  -4.792   0.821
   49   1HD   LYS   5          1HD       LYS   5  12.212  -4.129   1.305
   50   2HD   LYS   5          2HD       LYS   5  12.010  -3.257  -0.215
   51   1HE   LYS   5          1HE       LYS   5  11.211  -1.300   1.169
   52   2HE   LYS   5          2HE       LYS   5  11.767  -2.185   2.587
   53   1HZ   LYS   5          1HZ       LYS   5  13.340  -0.938   0.442
   54   2HZ   LYS   5          2HZ       LYS   5  13.962  -2.331   1.202
   55   3HZ   LYS   5          3HZ       LYS   5  13.603  -0.950   2.121
   56    H    TYR   6           H        TYR   6   9.047  -3.469  -2.513
   57    HA   TYR   6           HA       TYR   6   9.827  -2.102  -4.886
   58   1HB   TYR   6          1HB       TYR   6   8.105  -4.565  -4.772
   59   2HB   TYR   6          2HB       TYR   6   9.284  -4.103  -6.002
   60    HD1  TYR   6           HD1      TYR   6  11.767  -3.761  -5.025
   61    HD2  TYR   6           HD2      TYR   6   8.771  -6.228  -3.266
   62    HE1  TYR   6           HE1      TYR   6  13.498  -5.002  -3.819
   63    HE2  TYR   6           HE2      TYR   6  10.504  -7.477  -2.063
   64    HH   TYR   6           HH       TYR   6  13.709  -7.379  -2.830
   65    H    GLY   7           H        GLY   7   8.376  -1.779  -6.723
   66   1HA   GLY   7          1HA       GLY   7   5.945  -1.618  -7.334
   67   2HA   GLY   7          2HA       GLY   7   5.768  -0.703  -5.851
   68    H    ASN   8           H        ASN   8   5.038   1.140  -7.050
   69    HA   ASN   8           HA       ASN   8   7.065   2.280  -8.821
   70   1HB   ASN   8          1HB       ASN   8   5.415   3.680  -9.777
   71   2HB   ASN   8          2HB       ASN   8   4.698   2.086  -9.623
   72   1HD2  ASN   8          1HD2      ASN   8   3.417   4.626  -9.943
   73   2HD2  ASN   8          2HD2      ASN   8   2.375   4.821  -8.579
   74    H    ALA   9           H        ALA   9   6.359   2.411  -5.660
   75    HA   ALA   9           HA       ALA   9   6.808   5.224  -5.198
   76   1HB   ALA   9          1HB       ALA   9   7.117   3.220  -3.019
   77   2HB   ALA   9          2HB       ALA   9   5.506   3.446  -3.708
   78   3HB   ALA   9          3HB       ALA   9   6.361   4.813  -2.986
   79    H    ASP  10           H        ASP  10   8.823   6.138  -4.763
   80    HA   ASP  10           HA       ASP  10  11.063   4.238  -4.909
   81   1HB   ASP  10          1HB       ASP  10  12.382   6.086  -5.896
   82   2HB   ASP  10          2HB       ASP  10  10.975   5.641  -6.852
   83    H    GLY  11           H        GLY  11   9.657   5.790  -2.448
   84   1HA   GLY  11          1HA       GLY  11  11.870   5.600  -0.780
   85   2HA   GLY  11          2HA       GLY  11  11.878   7.243  -1.382
   86    H    GLU  12           H        GLU  12   8.678   6.356  -1.166
   87    HA   GLU  12           HA       GLU  12   8.452   7.820   1.331
   88   1HB   GLU  12          1HB       GLU  12   6.419   6.961  -0.719
   89   2HB   GLU  12          2HB       GLU  12   5.983   7.750   0.792
   90   1HG   GLU  12          1HG       GLU  12   7.911   8.956  -1.168
   91   2HG   GLU  12          2HG       GLU  12   6.179   9.236  -1.247
   92    H    TYR  13           H        TYR  13   6.507   7.018   2.751
   93    HA   TYR  13           HA       TYR  13   7.013   4.212   3.366
   94   1HB   TYR  13          1HB       TYR  13   6.509   4.752   5.639
   95   2HB   TYR  13          2HB       TYR  13   7.726   5.870   5.051
   96    HD1  TYR  13           HD1      TYR  13   6.780   8.104   4.075
   97    HD2  TYR  13           HD2      TYR  13   4.687   5.548   6.743
   98    HE1  TYR  13           HE1      TYR  13   5.325   9.987   4.721
   99    HE2  TYR  13           HE2      TYR  13   3.225   7.419   7.410
  100    HH   TYR  13           HH       TYR  13   3.881  10.681   6.485
  101    H    CYS  14           H        CYS  14   5.102   3.235   4.700
  102    HA   CYS  14           HA       CYS  14   2.799   3.282   3.026
  103   1HB   CYS  14          1HB       CYS  14   3.301   1.938   5.685
  104   2HB   CYS  14          2HB       CYS  14   1.845   1.710   4.726
  105    H    LYS  15           H        LYS  15   1.119   4.637   3.170
  106    HA   LYS  15           HA       LYS  15   0.910   6.306   5.549
  107   1HB   LYS  15          1HB       LYS  15   0.878   7.435   3.389
  108   2HB   LYS  15          2HB       LYS  15  -0.501   6.471   2.882
  109   1HG   LYS  15          1HG       LYS  15  -1.955   7.567   4.353
  110   2HG   LYS  15          2HG       LYS  15  -0.628   8.263   5.281
  111   1HD   LYS  15          1HD       LYS  15  -1.252   8.958   2.407
  112   2HD   LYS  15          2HD       LYS  15  -1.783   9.899   3.804
  113   1HE   LYS  15          1HE       LYS  15   1.055   9.363   2.936
  114   2HE   LYS  15          2HE       LYS  15   0.203  10.906   2.892
  115   1HZ   LYS  15          1HZ       LYS  15   1.368  11.143   4.819
  116   2HZ   LYS  15          2HZ       LYS  15   1.361   9.490   5.181
  117   3HZ   LYS  15          3HZ       LYS  15  -0.030  10.419   5.455
  118    H    PHE  16           H        PHE  16  -0.417   5.865   7.121
  119    HA   PHE  16           HA       PHE  16  -2.795   4.230   6.541
  120   1HB   PHE  16          1HB       PHE  16  -1.184   4.302   9.103
  121   2HB   PHE  16          2HB       PHE  16  -2.622   3.327   8.818
  122    HD1  PHE  16           HD1      PHE  16  -2.251   2.064   6.305
  123    HD2  PHE  16           HD2      PHE  16   0.668   2.990   9.254
  124    HE1  PHE  16           HE1      PHE  16  -0.846   0.226   5.484
  125    HE2  PHE  16           HE2      PHE  16   2.079   1.161   8.443
  126    HZ   PHE  16           HZ       PHE  16   1.331  -0.262   6.559
  127    HA   PRO  17           HA       PRO  17  -4.531   3.946   6.770
  128   1HB   PRO  17          1HB       PRO  17  -7.119   4.738   6.446
  129   2HB   PRO  17          2HB       PRO  17  -6.506   3.967   7.909
  130   1HG   PRO  17          1HG       PRO  17  -7.384   6.713   7.530
  131   2HG   PRO  17          2HG       PRO  17  -6.996   5.871   9.040
  132   1HD   PRO  17          1HD       PRO  17  -5.362   7.726   7.483
  133   2HD   PRO  17          2HD       PRO  17  -5.110   7.121   9.132
  134    H    PHE  18           H        PHE  18  -5.240   3.500   4.638
  135    HA   PHE  18           HA       PHE  18  -5.185   5.828   2.840
  136   1HB   PHE  18          1HB       PHE  18  -4.115   4.481   1.132
  137   2HB   PHE  18          2HB       PHE  18  -3.160   4.407   2.603
  138    HD1  PHE  18           HD1      PHE  18  -5.573   2.531   0.524
  139    HD2  PHE  18           HD2      PHE  18  -2.655   2.351   3.615
  140    HE1  PHE  18           HE1      PHE  18  -5.592   0.083   0.387
  141    HE2  PHE  18           HE2      PHE  18  -2.666  -0.104   3.489
  142    HZ   PHE  18           HZ       PHE  18  -4.139  -1.261   1.875
  143    H    LEU  19           H        LEU  19  -6.578   5.731   0.996
  144    HA   LEU  19           HA       LEU  19  -8.990   4.225   1.626
  145   1HB   LEU  19          1HB       LEU  19  -8.964   6.705   1.149
  146   2HB   LEU  19          2HB       LEU  19  -8.612   6.300  -0.523
  147    HG   LEU  19           HG       LEU  19 -10.761   4.988  -0.557
  148   1HD1  LEU  19          1HD1      LEU  19 -12.421   5.573   1.171
  149   2HD1  LEU  19          2HD1      LEU  19 -11.142   6.365   2.088
  150   3HD1  LEU  19          3HD1      LEU  19 -11.071   4.627   1.802
  151   1HD2  LEU  19          1HD2      LEU  19 -12.141   7.250  -0.290
  152   2HD2  LEU  19          2HD2      LEU  19 -11.077   6.941  -1.664
  153   3HD2  LEU  19          3HD2      LEU  19 -10.513   7.922  -0.311
  154    H    PHE  20           H        PHE  20  -9.525   2.415   0.643
  155    HA   PHE  20           HA       PHE  20  -8.584   1.916  -2.117
  156   1HB   PHE  20          1HB       PHE  20  -7.418   0.558  -0.223
  157   2HB   PHE  20          2HB       PHE  20  -8.970  -0.252  -0.081
  158    HD1  PHE  20           HD1      PHE  20  -7.628  -2.264  -0.477
  159    HD2  PHE  20           HD2      PHE  20  -8.201   0.718  -3.456
  160    HE1  PHE  20           HE1      PHE  20  -7.024  -3.905  -2.206
  161    HE2  PHE  20           HE2      PHE  20  -7.601  -0.925  -5.197
  162    HZ   PHE  20           HZ       PHE  20  -7.017  -3.232  -4.579
  163    H    ASN  21           H        ASN  21 -10.450   2.097  -3.259
  164    HA   ASN  21           HA       ASN  21 -12.602   1.827  -3.939
  165   1HB   ASN  21          1HB       ASN  21 -12.246  -0.792  -2.480
  166   2HB   ASN  21          2HB       ASN  21 -13.629  -0.416  -3.503
  167   1HD2  ASN  21          1HD2      ASN  21 -10.908  -2.091  -3.478
  168   2HD2  ASN  21          2HD2      ASN  21 -10.470  -2.016  -5.147
  169    H    GLY  22           H        GLY  22 -12.252   3.262  -1.449
  170   1HA   GLY  22          1HA       GLY  22 -13.926   4.361  -0.221
  171   2HA   GLY  22          2HA       GLY  22 -14.999   3.008  -0.511
  172    H    LYS  23           H        LYS  23 -12.038   1.817   0.559
  173    HA   LYS  23           HA       LYS  23 -13.011   1.833   3.345
  174   1HB   LYS  23          1HB       LYS  23 -13.229  -0.396   2.318
  175   2HB   LYS  23          2HB       LYS  23 -11.515  -0.390   1.930
  176   1HG   LYS  23          1HG       LYS  23 -10.983  -0.311   4.324
  177   2HG   LYS  23          2HG       LYS  23 -12.704  -0.357   4.698
  178   1HD   LYS  23          1HD       LYS  23 -12.902  -2.546   3.677
  179   2HD   LYS  23          2HD       LYS  23 -11.208  -2.495   3.183
  180   1HE   LYS  23          1HE       LYS  23 -10.533  -2.400   5.534
  181   2HE   LYS  23          2HE       LYS  23 -12.226  -2.462   6.025
  182   1HZ   LYS  23          1HZ       LYS  23 -11.428  -4.645   6.202
  183   2HZ   LYS  23          2HZ       LYS  23 -10.621  -4.575   4.709
  184   3HZ   LYS  23          3HZ       LYS  23 -12.314  -4.630   4.753
  185    H    GLU  24           H        GLU  24 -11.576   2.353   4.933
  186    HA   GLU  24           HA       GLU  24  -8.928   3.230   4.038
  187   1HB   GLU  24          1HB       GLU  24 -10.419   3.835   6.595
  188   2HB   GLU  24          2HB       GLU  24  -8.862   4.509   6.142
  189   1HG   GLU  24          1HG       GLU  24  -9.909   5.601   4.222
  190   2HG   GLU  24          2HG       GLU  24 -11.466   4.924   4.696
  191    H    TYR  25           H        TYR  25  -7.257   1.954   4.418
  192    HA   TYR  25           HA       TYR  25  -7.508  -0.134   6.448
  193   1HB   TYR  25          1HB       TYR  25  -5.550   0.239   4.208
  194   2HB   TYR  25          2HB       TYR  25  -5.442  -1.073   5.363
  195    HD1  TYR  25           HD1      TYR  25  -7.620   0.428   2.784
  196    HD2  TYR  25           HD2      TYR  25  -6.707  -3.052   5.050
  197    HE1  TYR  25           HE1      TYR  25  -9.184  -0.868   1.378
  198    HE2  TYR  25           HE2      TYR  25  -8.267  -4.367   3.643
  199    HH   TYR  25           HH       TYR  25  -9.509  -4.372   1.785
  200    H    ASN  26           H        ASN  26  -6.497  -0.045   8.304
  201    HA   ASN  26           HA       ASN  26  -4.657   2.155   8.810
  202   1HB   ASN  26          1HB       ASN  26  -5.891   0.095  10.656
  203   2HB   ASN  26          2HB       ASN  26  -4.739   1.313  11.191
  204   1HD2  ASN  26          1HD2      ASN  26  -6.836   2.372   8.719
  205   2HD2  ASN  26          2HD2      ASN  26  -7.932   3.258   9.720
  206    H    SER  27           H        SER  27  -4.429  -0.848   7.608
  207    HA   SER  27           HA       SER  27  -1.597  -1.027   8.186
  208   1HB   SER  27          1HB       SER  27  -1.726  -3.420   8.799
  209   2HB   SER  27          2HB       SER  27  -2.607  -2.417   9.956
  210    HG   SER  27           HG       SER  27  -3.560  -4.485   8.783
  211    H    CYS  28           H        CYS  28  -0.757  -3.056   6.857
  212    HA   CYS  28           HA       CYS  28  -1.525  -2.554   4.147
  213   1HB   CYS  28          1HB       CYS  28   0.316  -4.688   5.240
  214   2HB   CYS  28          2HB       CYS  28   0.235  -4.120   3.570
  215    H    THR  29           H        THR  29  -2.397  -4.009   2.647
  216    HA   THR  29           HA       THR  29  -3.679  -6.397   3.726
  217    HB   THR  29           HB       THR  29  -5.322  -4.560   3.704
  218    HG1  THR  29           HG1      THR  29  -6.406  -6.366   3.354
  219   1HG2  THR  29          1HG2      THR  29  -5.897  -4.371   0.928
  220   2HG2  THR  29          2HG2      THR  29  -4.218  -3.891   1.187
  221   3HG2  THR  29          3HG2      THR  29  -5.516  -3.084   2.071
  222    H    ASP  30           H        ASP  30  -4.466  -7.870   1.948
  223    HA   ASP  30           HA       ASP  30  -2.549  -7.779  -0.251
  224   1HB   ASP  30          1HB       ASP  30  -4.021 -10.226  -0.114
  225   2HB   ASP  30          2HB       ASP  30  -2.300  -9.991  -0.132
  226    H    THR  31           H        THR  31  -5.476  -6.793   0.372
  227    HA   THR  31           HA       THR  31  -7.215  -7.868  -1.522
  228    HB   THR  31           HB       THR  31  -7.090  -5.045  -0.465
  229    HG1  THR  31           HG1      THR  31  -7.236  -6.283   1.306
  230   1HG2  THR  31          1HG2      THR  31  -9.580  -6.517  -1.240
  231   2HG2  THR  31          2HG2      THR  31  -8.704  -5.487  -2.371
  232   3HG2  THR  31          3HG2      THR  31  -9.374  -4.799  -0.894
  233    H    GLY  32           H        GLY  32  -7.519  -7.528  -3.668
  234   1HA   GLY  32          1HA       GLY  32  -7.353  -6.427  -5.719
  235   2HA   GLY  32          2HA       GLY  32  -6.255  -5.277  -4.978
  236    H    ARG  33           H        ARG  33  -4.650  -7.501  -3.834
  237    HA   ARG  33           HA       ARG  33  -2.959  -7.920  -6.158
  238   1HB   ARG  33          1HB       ARG  33  -2.595  -8.523  -3.222
  239   2HB   ARG  33          2HB       ARG  33  -1.406  -8.928  -4.441
  240   1HG   ARG  33          1HG       ARG  33  -2.374  -6.161  -3.778
  241   2HG   ARG  33          2HG       ARG  33  -0.851  -6.877  -3.255
  242   1HD   ARG  33          1HD       ARG  33  -1.677  -6.272  -6.103
  243   2HD   ARG  33          2HD       ARG  33  -0.492  -5.393  -5.141
  244    HE   ARG  33           HE       ARG  33   0.152  -8.179  -5.455
  245   1HH1  ARG  33          1HH1      ARG  33   0.404  -4.987  -6.859
  246   2HH1  ARG  33          2HH1      ARG  33   1.745  -5.404  -7.883
  247   1HH2  ARG  33          1HH2      ARG  33   1.913  -8.736  -6.808
  248   2HH2  ARG  33          2HH2      ARG  33   2.613  -7.530  -7.851
  249    H    SER  34           H        SER  34  -2.762  -9.784  -7.229
  250    HA   SER  34           HA       SER  34  -4.531 -11.959  -6.556
  251   1HB   SER  34          1HB       SER  34  -2.504 -11.719  -8.799
  252   2HB   SER  34          2HB       SER  34  -3.768 -12.946  -8.666
  253    HG   SER  34           HG       SER  34  -5.322 -11.330  -8.880
  254    H    ASP  35           H        ASP  35  -1.273 -11.135  -5.969
  255    HA   ASP  35           HA       ASP  35  -0.423 -13.838  -5.550
  256   1HB   ASP  35          1HB       ASP  35   1.392 -11.801  -4.655
  257   2HB   ASP  35          2HB       ASP  35   1.662 -13.073  -5.811
  258    H    GLY  36           H        GLY  36  -2.186 -11.847  -3.748
  259   1HA   GLY  36          1HA       GLY  36  -2.651 -11.701  -1.494
  260   2HA   GLY  36          2HA       GLY  36  -1.828 -13.251  -1.344
  261    H    PHE  37           H        PHE  37  -0.614 -10.102  -2.387
  262    HA   PHE  37           HA       PHE  37   1.543 -10.345  -0.426
  263   1HB   PHE  37          1HB       PHE  37   1.751  -9.888  -3.058
  264   2HB   PHE  37          2HB       PHE  37   1.578  -8.222  -2.518
  265    HD1  PHE  37           HD1      PHE  37   3.122  -7.778  -0.284
  266    HD2  PHE  37           HD2      PHE  37   3.898 -10.564  -3.406
  267    HE1  PHE  37           HE1      PHE  37   5.521  -7.717   0.254
  268    HE2  PHE  37           HE2      PHE  37   6.297 -10.501  -2.871
  269    HZ   PHE  37           HZ       PHE  37   7.110  -9.077  -1.039
  270    H    LEU  38           H        LEU  38   1.932  -8.846   1.109
  271    HA   LEU  38           HA       LEU  38  -0.223  -7.073   1.798
  272   1HB   LEU  38          1HB       LEU  38   2.493  -7.365   3.036
  273   2HB   LEU  38          2HB       LEU  38   1.137  -6.521   3.746
  274    HG   LEU  38           HG       LEU  38   1.141  -9.483   3.156
  275   1HD1  LEU  38          1HD1      LEU  38   2.734  -9.316   4.828
  276   2HD1  LEU  38          2HD1      LEU  38   1.238  -9.545   5.734
  277   3HD1  LEU  38          3HD1      LEU  38   1.939  -7.934   5.585
  278   1HD2  LEU  38          1HD2      LEU  38  -0.692  -9.123   5.061
  279   2HD2  LEU  38          2HD2      LEU  38  -1.071  -9.033   3.340
  280   3HD2  LEU  38          3HD2      LEU  38  -0.807  -7.554   4.267
  281    H    TRP  39           H        TRP  39  -0.468  -5.166   0.821
  282    HA   TRP  39           HA       TRP  39   1.961  -3.597   0.270
  283   1HB   TRP  39          1HB       TRP  39   0.966  -2.695  -1.749
  284   2HB   TRP  39          2HB       TRP  39   1.004  -4.445  -1.848
  285    HD1  TRP  39           HD1      TRP  39  -1.388  -5.738  -1.634
  286    HE1  TRP  39           HE1      TRP  39  -3.764  -4.957  -2.178
  287    HE3  TRP  39           HE3      TRP  39  -0.612  -0.667  -1.709
  288    HZ2  TRP  39           HZ2      TRP  39  -5.131  -2.529  -2.581
  289    HZ3  TRP  39           HZ3      TRP  39  -2.528   0.806  -2.197
  290    HH2  TRP  39           HH2      TRP  39  -4.735  -0.119  -2.615
  291    H    CYS  40           H        CYS  40   1.395  -1.239  -0.101
  292    HA   CYS  40           HA       CYS  40  -0.861  -0.295   1.496
  293   1HB   CYS  40          1HB       CYS  40   0.607   1.119   2.874
  294   2HB   CYS  40          2HB       CYS  40   0.992  -0.587   3.095
  295    H    SER  41           H        SER  41  -1.171   2.033   1.200
  296    HA   SER  41           HA       SER  41  -0.216   2.855  -1.433
  297   1HB   SER  41          1HB       SER  41  -2.648   2.926  -1.079
  298   2HB   SER  41          2HB       SER  41  -2.422   4.020   0.285
  299    HG   SER  41           HG       SER  41  -2.385   5.600  -1.081
  300    H    THR  42           H        THR  42   0.425   5.099  -1.723
  301    HA   THR  42           HA       THR  42   2.076   6.005   0.521
  302    HB   THR  42           HB       THR  42   2.067   6.901  -2.371
  303    HG1  THR  42           HG1      THR  42   2.758   4.712  -2.020
  304   1HG2  THR  42          1HG2      THR  42   3.049   8.629  -1.105
  305   2HG2  THR  42          2HG2      THR  42   4.369   7.693  -1.810
  306   3HG2  THR  42          3HG2      THR  42   3.946   7.481  -0.111
  307    H    THR  43           H        THR  43  -0.425   7.021  -1.707
  308    HA   THR  43           HA       THR  43  -0.785   9.534  -0.252
  309    HB   THR  43           HB       THR  43  -2.293  10.099  -2.176
  310    HG1  THR  43           HG1      THR  43  -2.957   8.230  -3.046
  311   1HG2  THR  43          1HG2      THR  43   0.306  10.411  -2.157
  312   2HG2  THR  43          2HG2      THR  43  -0.636  10.704  -3.624
  313   3HG2  THR  43          3HG2      THR  43   0.244   9.186  -3.422
  314    H    TYR  44           H        TYR  44  -3.139  10.166   0.111
  315    HA   TYR  44           HA       TYR  44  -4.409   8.169   1.670
  316   1HB   TYR  44          1HB       TYR  44  -4.626  10.591   2.127
  317   2HB   TYR  44          2HB       TYR  44  -5.539  10.785   0.633
  318    HD1  TYR  44           HD1      TYR  44  -5.725   8.313   3.458
  319    HD2  TYR  44           HD2      TYR  44  -7.753  11.242   1.127
  320    HE1  TYR  44           HE1      TYR  44  -7.804   7.841   4.680
  321    HE2  TYR  44           HE2      TYR  44  -9.834  10.779   2.343
  322    HH   TYR  44           HH       TYR  44  -9.986   8.245   4.838
  323    H    ASN  45           H        ASN  45  -5.439   9.773  -1.342
  324    HA   ASN  45           HA       ASN  45  -7.349   7.651  -1.857
  325   1HB   ASN  45          1HB       ASN  45  -7.790  10.105  -2.358
  326   2HB   ASN  45          2HB       ASN  45  -6.614   9.983  -3.648
  327   1HD2  ASN  45          1HD2      ASN  45  -7.753   7.130  -4.089
  328   2HD2  ASN  45          2HD2      ASN  45  -9.143   7.513  -4.985
  329    H    PHE  46           H        PHE  46  -6.415   5.782  -2.524
  330    HA   PHE  46           HA       PHE  46  -3.926   5.605  -3.855
  331   1HB   PHE  46          1HB       PHE  46  -4.847   3.772  -2.484
  332   2HB   PHE  46          2HB       PHE  46  -6.142   3.534  -3.680
  333    HD1  PHE  46           HD1      PHE  46  -5.708   1.368  -4.474
  334    HD2  PHE  46           HD2      PHE  46  -2.492   4.161  -4.281
  335    HE1  PHE  46           HE1      PHE  46  -4.279  -0.188  -5.715
  336    HE2  PHE  46           HE2      PHE  46  -1.071   2.602  -5.528
  337    HZ   PHE  46           HZ       PHE  46  -1.962   0.424  -6.247
  338    H    GLU  47           H        GLU  47  -7.250   5.320  -5.023
  339    HA   GLU  47           HA       GLU  47  -6.834   4.579  -7.643
  340   1HB   GLU  47          1HB       GLU  47  -9.011   4.812  -6.440
  341   2HB   GLU  47          2HB       GLU  47  -8.905   6.547  -6.658
  342   1HG   GLU  47          1HG       GLU  47  -8.925   6.224  -9.093
  343   2HG   GLU  47          2HG       GLU  47  -9.107   4.489  -8.840
  344    H    LYS  48           H        LYS  48  -7.026   7.877  -6.378
  345    HA   LYS  48           HA       LYS  48  -6.749   9.236  -8.775
  346   1HB   LYS  48          1HB       LYS  48  -7.530  10.293  -6.713
  347   2HB   LYS  48          2HB       LYS  48  -5.947  10.092  -5.986
  348   1HG   LYS  48          1HG       LYS  48  -6.054  12.342  -6.577
  349   2HG   LYS  48          2HG       LYS  48  -5.071  11.607  -7.844
  350   1HD   LYS  48          1HD       LYS  48  -6.702  13.196  -8.755
  351   2HD   LYS  48          2HD       LYS  48  -7.007  11.557  -9.330
  352   1HE   LYS  48          1HE       LYS  48  -8.759  11.312  -7.612
  353   2HE   LYS  48          2HE       LYS  48  -8.473  12.975  -7.102
  354   1HZ   LYS  48          1HZ       LYS  48 -10.353  12.894  -8.579
  355   2HZ   LYS  48          2HZ       LYS  48  -9.450  12.079  -9.768
  356   3HZ   LYS  48          3HZ       LYS  48  -9.077  13.688  -9.374
  357    H    ASP  49           H        ASP  49  -4.133   8.892  -6.343
  358    HA   ASP  49           HA       ASP  49  -2.182   9.761  -8.261
  359   1HB   ASP  49          1HB       ASP  49  -2.160   9.058  -5.371
  360   2HB   ASP  49          2HB       ASP  49  -0.628   9.013  -6.236
  361    H    GLY  50           H        GLY  50  -2.564   6.729  -6.432
  362   1HA   GLY  50          1HA       GLY  50  -2.328   4.580  -7.355
  363   2HA   GLY  50          2HA       GLY  50  -1.552   5.300  -8.754
  364    H    LYS  51           H        LYS  51  -0.291   6.492  -5.849
  365    HA   LYS  51           HA       LYS  51   2.186   5.091  -6.295
  366   1HB   LYS  51          1HB       LYS  51   1.308   7.213  -4.365
  367   2HB   LYS  51          2HB       LYS  51   2.820   6.364  -4.119
  368   1HG   LYS  51          1HG       LYS  51   3.495   8.230  -5.251
  369   2HG   LYS  51          2HG       LYS  51   3.291   7.074  -6.567
  370   1HD   LYS  51          1HD       LYS  51   1.203   8.032  -7.188
  371   2HD   LYS  51          2HD       LYS  51   1.158   9.028  -5.726
  372   1HE   LYS  51          1HE       LYS  51   3.146  10.244  -6.503
  373   2HE   LYS  51          2HE       LYS  51   3.173   9.260  -7.963
  374   1HZ   LYS  51          1HZ       LYS  51   1.421  10.374  -8.866
  375   2HZ   LYS  51          2HZ       LYS  51   2.068  11.623  -7.921
  376   3HZ   LYS  51          3HZ       LYS  51   0.716  10.756  -7.365
  377    H    TYR  52           H        TYR  52   2.631   3.144  -5.448
  378    HA   TYR  52           HA       TYR  52   1.672   2.480  -2.778
  379   1HB   TYR  52          1HB       TYR  52   0.619   0.449  -3.423
  380   2HB   TYR  52          2HB       TYR  52   0.001   1.658  -4.544
  381    HD1  TYR  52           HD1      TYR  52   1.424   1.893  -6.787
  382    HD2  TYR  52           HD2      TYR  52   1.371  -1.547  -4.283
  383    HE1  TYR  52           HE1      TYR  52   2.219   0.514  -8.664
  384    HE2  TYR  52           HE2      TYR  52   2.160  -2.935  -6.153
  385    HH   TYR  52           HH       TYR  52   1.968  -2.641  -8.881
  386    H    GLY  53           H        GLY  53   2.503   0.103  -2.361
  387   1HA   GLY  53          1HA       GLY  53   4.758  -0.890  -3.656
  388   2HA   GLY  53          2HA       GLY  53   5.296   0.140  -2.348
  389    H    PHE  54           H        PHE  54   6.125  -2.248  -1.894
  390    HA   PHE  54           HA       PHE  54   4.037  -3.675  -0.440
  391   1HB   PHE  54          1HB       PHE  54   6.802  -4.584  -1.224
  392   2HB   PHE  54          2HB       PHE  54   5.588  -5.584  -0.428
  393    HD1  PHE  54           HD1      PHE  54   3.149  -5.175  -1.726
  394    HD2  PHE  54           HD2      PHE  54   7.038  -5.137  -3.455
  395    HE1  PHE  54           HE1      PHE  54   2.175  -5.731  -3.916
  396    HE2  PHE  54           HE2      PHE  54   6.069  -5.698  -5.650
  397    HZ   PHE  54           HZ       PHE  54   3.637  -5.993  -5.880
  398    H    CYS  55           H        CYS  55   4.241  -4.251   1.700
  399    HA   CYS  55           HA       CYS  55   5.676  -2.306   3.263
  400   1HB   CYS  55          1HB       CYS  55   3.877  -4.494   4.272
  401   2HB   CYS  55          2HB       CYS  55   4.303  -2.990   5.079
  402    HA   PRO  56           HA       PRO  56   7.347  -6.482   5.382
  403   1HB   PRO  56          1HB       PRO  56   7.996  -8.242   3.327
  404   2HB   PRO  56          2HB       PRO  56   6.730  -8.453   4.530
  405   1HG   PRO  56          1HG       PRO  56   6.537  -7.460   1.733
  406   2HG   PRO  56          2HG       PRO  56   5.382  -8.426   2.670
  407   1HD   PRO  56          1HD       PRO  56   4.953  -5.830   2.223
  408   2HD   PRO  56          2HD       PRO  56   4.549  -6.567   3.791
  409    H    HIS  57           H        HIS  57   9.357  -6.118   5.890
  410    HA   HIS  57           HA       HIS  57  11.181  -4.640   4.340
  411   1HB   HIS  57          1HB       HIS  57  11.086  -5.046   6.893
  412   2HB   HIS  57          2HB       HIS  57  11.933  -6.545   6.561
  413    HD1  HIS  57           HD1      HIS  57  14.272  -5.995   5.007
  414    HD2  HIS  57           HD2      HIS  57  12.783  -3.115   7.616
  415    HE1  HIS  57           HE1      HIS  57  16.200  -4.460   5.497
  416    H    GLU  58           H        GLU  58  12.818  -5.297   2.925
  417    HA   GLU  58           HA       GLU  58  12.507  -7.844   1.753
  418   1HB   GLU  58          1HB       GLU  58  14.124  -7.259   0.189
  419   2HB   GLU  58          2HB       GLU  58  13.411  -5.721   0.633
  420   1HG   GLU  58          1HG       GLU  58  15.933  -6.711   1.913
  421   2HG   GLU  58          2HG       GLU  58  15.948  -5.860   0.371
  422    H    ALA  59           H        ALA  59  13.551  -9.709   1.949
  423    HA   ALA  59           HA       ALA  59  16.040 -10.139   3.198
  424   1HB   ALA  59          1HB       ALA  59  14.895  -9.623   5.274
  425   2HB   ALA  59          2HB       ALA  59  15.238 -11.351   5.209
  426   3HB   ALA  59          3HB       ALA  59  13.610 -10.762   4.883
  Start of MODEL   25
    1   1H    ARG   1          1H        ARG   1   5.001   2.525  12.923
    2   2H    ARG   1          2H        ARG   1   4.178   1.355  11.973
    3   3H    ARG   1          3H        ARG   1   3.512   2.927  12.166
    4    HA   ARG   1           HA       ARG   1   4.416   3.287  10.215
    5   1HB   ARG   1          1HB       ARG   1   5.693   4.658  11.850
    6   2HB   ARG   1          2HB       ARG   1   6.892   3.381  11.967
    7   1HG   ARG   1          1HG       ARG   1   6.310   4.615   9.308
    8   2HG   ARG   1          2HG       ARG   1   7.328   5.466  10.471
    9   1HD   ARG   1          1HD       ARG   1   8.814   3.532  10.596
   10   2HD   ARG   1          2HD       ARG   1   7.798   2.664   9.441
   11    HE   ARG   1           HE       ARG   1   8.648   5.151   8.373
   12   1HH1  ARG   1          1HH1      ARG   1   9.875   1.971   9.185
   13   2HH1  ARG   1          2HH1      ARG   1  11.066   1.968   7.917
   14   1HH2  ARG   1          1HH2      ARG   1  10.212   5.187   6.746
   15   2HH2  ARG   1          2HH2      ARG   1  11.248   3.811   6.503
   16    H    ILE   2           H        ILE   2   5.021   2.233   8.427
   17    HA   ILE   2           HA       ILE   2   7.021   0.133   8.620
   18    HB   ILE   2           HB       ILE   2   4.688  -0.887   8.864
   19   1HG1  ILE   2          1HG1      ILE   2   6.407  -1.814   6.557
   20   2HG1  ILE   2          2HG1      ILE   2   6.659  -2.215   8.256
   21   1HG2  ILE   2          1HG2      ILE   2   4.542  -0.156   5.945
   22   2HG2  ILE   2          2HG2      ILE   2   3.496   0.438   7.240
   23   3HG2  ILE   2          3HG2      ILE   2   3.446  -1.263   6.775
   24   1HD1  ILE   2          1HD1      ILE   2   5.089  -3.795   8.245
   25   2HD1  ILE   2          2HD1      ILE   2   5.315  -3.754   6.496
   26   3HD1  ILE   2          3HD1      ILE   2   3.990  -2.851   7.241
   27    HA   PRO   3           HA       PRO   3   8.370   2.185   4.963
   28   1HB   PRO   3          1HB       PRO   3  10.151   0.398   4.052
   29   2HB   PRO   3          2HB       PRO   3  10.430   1.341   5.523
   30   1HG   PRO   3          1HG       PRO   3   9.394  -1.459   5.240
   31   2HG   PRO   3          2HG       PRO   3  10.664  -0.850   6.319
   32   1HD   PRO   3          1HD       PRO   3   8.140  -1.260   7.179
   33   2HD   PRO   3          2HD       PRO   3   9.131   0.082   7.800
   34    H    VAL   4           H        VAL   4   8.759   1.879   2.657
   35    HA   VAL   4           HA       VAL   4   6.884  -0.034   1.406
   36    HB   VAL   4           HB       VAL   4   7.636   2.771   0.445
   37   1HG1  VAL   4          1HG1      VAL   4   6.989   2.177  -1.583
   38   2HG1  VAL   4          2HG1      VAL   4   5.446   1.598  -0.958
   39   3HG1  VAL   4          3HG1      VAL   4   6.830   0.510  -1.027
   40   1HG2  VAL   4          1HG2      VAL   4   5.879   3.491   1.605
   41   2HG2  VAL   4          2HG2      VAL   4   5.523   1.854   2.156
   42   3HG2  VAL   4          3HG2      VAL   4   4.838   2.443   0.642
   43    H    LYS   5           H        LYS   5   7.691  -1.234  -0.284
   44    HA   LYS   5           HA       LYS   5  10.545  -0.851  -0.866
   45   1HB   LYS   5          1HB       LYS   5   8.896  -3.211  -0.286
   46   2HB   LYS   5          2HB       LYS   5   9.991  -3.418  -1.643
   47   1HG   LYS   5          1HG       LYS   5  10.805  -2.575   1.136
   48   2HG   LYS   5          2HG       LYS   5  10.955  -4.207   0.459
   49   1HD   LYS   5          1HD       LYS   5  12.489  -3.393  -1.234
   50   2HD   LYS   5          2HD       LYS   5  12.309  -1.739  -0.646
   51   1HE   LYS   5          1HE       LYS   5  13.467  -4.064   0.895
   52   2HE   LYS   5          2HE       LYS   5  14.379  -2.741   0.169
   53   1HZ   LYS   5          1HZ       LYS   5  12.930  -1.256   1.666
   54   2HZ   LYS   5          2HZ       LYS   5  14.186  -2.143   2.386
   55   3HZ   LYS   5          3HZ       LYS   5  12.593  -2.687   2.522
   56    H    TYR   6           H        TYR   6   8.878  -3.173  -2.696
   57    HA   TYR   6           HA       TYR   6   9.534  -1.899  -5.153
   58   1HB   TYR   6          1HB       TYR   6   7.765  -4.321  -4.835
   59   2HB   TYR   6          2HB       TYR   6   8.781  -3.888  -6.208
   60    HD1  TYR   6           HD1      TYR   6   8.853  -5.090  -2.704
   61    HD2  TYR   6           HD2      TYR   6  11.099  -4.487  -6.272
   62    HE1  TYR   6           HE1      TYR   6  10.698  -6.388  -1.756
   63    HE2  TYR   6           HE2      TYR   6  12.946  -5.790  -5.327
   64    HH   TYR   6           HH       TYR   6  13.781  -6.725  -3.456
   65    H    GLY   7           H        GLY   7   7.994  -1.670  -6.963
   66   1HA   GLY   7          1HA       GLY   7   5.599  -1.425  -7.550
   67   2HA   GLY   7          2HA       GLY   7   5.411  -0.534  -6.053
   68    H    ASN   8           H        ASN   8   4.639   1.283  -7.277
   69    HA   ASN   8           HA       ASN   8   6.665   2.542  -8.986
   70   1HB   ASN   8          1HB       ASN   8   4.953   3.812 -10.024
   71   2HB   ASN   8          2HB       ASN   8   4.335   2.173  -9.876
   72   1HD2  ASN   8          1HD2      ASN   8   2.976   4.786 -10.147
   73   2HD2  ASN   8          2HD2      ASN   8   1.873   4.842  -8.822
   74    H    ALA   9           H        ALA   9   6.224   2.531  -5.913
   75    HA   ALA   9           HA       ALA   9   6.164   5.368  -5.326
   76   1HB   ALA   9          1HB       ALA   9   6.652   3.154  -3.377
   77   2HB   ALA   9          2HB       ALA   9   5.032   3.599  -3.911
   78   3HB   ALA   9          3HB       ALA   9   6.038   4.778  -3.068
   79    H    ASP  10           H        ASP  10   7.950   6.282  -3.970
   80    HA   ASP  10           HA       ASP  10  10.504   5.367  -5.058
   81   1HB   ASP  10          1HB       ASP  10   9.674   7.925  -3.694
   82   2HB   ASP  10          2HB       ASP  10  11.354   7.547  -4.051
   83    H    GLY  11           H        GLY  11   9.103   3.976  -2.866
   84   1HA   GLY  11          1HA       GLY  11   9.804   2.789  -1.016
   85   2HA   GLY  11          2HA       GLY  11  11.380   3.547  -1.197
   86    H    GLU  12           H        GLU  12   8.213   5.075  -0.712
   87    HA   GLU  12           HA       GLU  12   9.297   6.699   1.406
   88   1HB   GLU  12          1HB       GLU  12   6.483   6.481   0.326
   89   2HB   GLU  12          2HB       GLU  12   7.020   7.682   1.487
   90   1HG   GLU  12          1HG       GLU  12   7.171   8.924  -0.387
   91   2HG   GLU  12          2HG       GLU  12   8.769   8.193  -0.439
   92    H    TYR  13           H        TYR  13   6.607   6.747   2.717
   93    HA   TYR  13           HA       TYR  13   6.864   4.336   4.348
   94   1HB   TYR  13          1HB       TYR  13   7.153   5.658   6.121
   95   2HB   TYR  13          2HB       TYR  13   7.308   7.000   5.014
   96    HD1  TYR  13           HD1      TYR  13   5.313   5.461   7.575
   97    HD2  TYR  13           HD2      TYR  13   5.321   8.379   4.493
   98    HE1  TYR  13           HE1      TYR  13   3.354   6.536   8.604
   99    HE2  TYR  13           HE2      TYR  13   3.355   9.470   5.496
  100    HH   TYR  13           HH       TYR  13   2.234   9.637   7.648
  101    H    CYS  14           H        CYS  14   4.926   3.382   5.089
  102    HA   CYS  14           HA       CYS  14   2.734   3.617   3.317
  103   1HB   CYS  14          1HB       CYS  14   3.105   2.120   5.899
  104   2HB   CYS  14          2HB       CYS  14   1.591   2.075   5.001
  105    H    LYS  15           H        LYS  15   1.108   4.980   3.318
  106    HA   LYS  15           HA       LYS  15   0.659   6.745   5.574
  107   1HB   LYS  15          1HB       LYS  15   0.698   7.453   3.120
  108   2HB   LYS  15          2HB       LYS  15  -0.857   6.653   2.958
  109   1HG   LYS  15          1HG       LYS  15  -0.397   8.802   5.001
  110   2HG   LYS  15          2HG       LYS  15  -0.835   9.182   3.336
  111   1HD   LYS  15          1HD       LYS  15  -2.881   7.858   3.567
  112   2HD   LYS  15          2HD       LYS  15  -2.433   7.447   5.225
  113   1HE   LYS  15          1HE       LYS  15  -2.496   9.836   5.814
  114   2HE   LYS  15          2HE       LYS  15  -2.987  10.222   4.166
  115   1HZ   LYS  15          1HZ       LYS  15  -4.767   8.298   5.131
  116   2HZ   LYS  15          2HZ       LYS  15  -5.080   9.934   4.802
  117   3HZ   LYS  15          3HZ       LYS  15  -4.591   9.457   6.357
  118    H    PHE  16           H        PHE  16  -0.611   6.069   7.191
  119    HA   PHE  16           HA       PHE  16  -2.968   4.440   6.509
  120   1HB   PHE  16          1HB       PHE  16  -1.384   4.425   9.086
  121   2HB   PHE  16          2HB       PHE  16  -2.831   3.472   8.772
  122    HD1  PHE  16           HD1      PHE  16  -2.393   2.340   6.156
  123    HD2  PHE  16           HD2      PHE  16   0.379   3.018   9.308
  124    HE1  PHE  16           HE1      PHE  16  -1.002   0.501   5.320
  125    HE2  PHE  16           HE2      PHE  16   1.783   1.188   8.482
  126    HZ   PHE  16           HZ       PHE  16   1.113  -0.096   6.472
  127    HA   PRO  17           HA       PRO  17  -4.703   3.950   6.959
  128   1HB   PRO  17          1HB       PRO  17  -7.295   4.545   6.597
  129   2HB   PRO  17          2HB       PRO  17  -6.660   4.055   8.175
  130   1HG   PRO  17          1HG       PRO  17  -7.452   6.763   7.223
  131   2HG   PRO  17          2HG       PRO  17  -7.521   6.083   8.857
  132   1HD   PRO  17          1HD       PRO  17  -5.536   7.809   7.822
  133   2HD   PRO  17          2HD       PRO  17  -5.480   6.924   9.356
  134    H    PHE  18           H        PHE  18  -4.946   3.434   4.790
  135    HA   PHE  18           HA       PHE  18  -4.988   5.736   2.971
  136   1HB   PHE  18          1HB       PHE  18  -3.811   4.433   1.351
  137   2HB   PHE  18          2HB       PHE  18  -2.981   4.248   2.885
  138    HD1  PHE  18           HD1      PHE  18  -5.268   2.562   0.511
  139    HD2  PHE  18           HD2      PHE  18  -2.627   2.126   3.818
  140    HE1  PHE  18           HE1      PHE  18  -5.337   0.122   0.237
  141    HE2  PHE  18           HE2      PHE  18  -2.690  -0.313   3.556
  142    HZ   PHE  18           HZ       PHE  18  -4.043  -1.338   1.753
  143    H    LEU  19           H        LEU  19  -6.267   5.651   1.055
  144    HA   LEU  19           HA       LEU  19  -8.745   4.179   1.536
  145   1HB   LEU  19          1HB       LEU  19  -8.641   6.678   1.140
  146   2HB   LEU  19          2HB       LEU  19  -8.253   6.314  -0.527
  147    HG   LEU  19           HG       LEU  19 -10.404   5.066  -0.703
  148   1HD1  LEU  19          1HD1      LEU  19 -11.947   6.137   1.300
  149   2HD1  LEU  19          2HD1      LEU  19 -10.461   5.691   2.141
  150   3HD1  LEU  19          3HD1      LEU  19 -11.355   4.478   1.226
  151   1HD2  LEU  19          1HD2      LEU  19 -11.755   7.359  -0.261
  152   2HD2  LEU  19          2HD2      LEU  19 -10.751   7.061  -1.683
  153   3HD2  LEU  19          3HD2      LEU  19 -10.102   7.967  -0.312
  154    H    PHE  20           H        PHE  20  -9.294   2.450   0.457
  155    HA   PHE  20           HA       PHE  20  -8.218   1.983  -2.258
  156   1HB   PHE  20          1HB       PHE  20  -7.173   0.534  -0.393
  157   2HB   PHE  20          2HB       PHE  20  -8.777  -0.176  -0.250
  158    HD1  PHE  20           HD1      PHE  20  -7.565  -2.276  -0.633
  159    HD2  PHE  20           HD2      PHE  20  -7.945   0.729  -3.620
  160    HE1  PHE  20           HE1      PHE  20  -7.081  -3.960  -2.359
  161    HE2  PHE  20           HE2      PHE  20  -7.465  -0.957  -5.358
  162    HZ   PHE  20           HZ       PHE  20  -7.032  -3.297  -4.731
  163    H    ASN  21           H        ASN  21 -10.014   2.288  -3.487
  164    HA   ASN  21           HA       ASN  21 -12.134   2.115  -4.297
  165   1HB   ASN  21          1HB       ASN  21 -11.977  -0.533  -2.849
  166   2HB   ASN  21          2HB       ASN  21 -13.288  -0.084  -3.932
  167   1HD2  ASN  21          1HD2      ASN  21 -10.736  -1.951  -3.835
  168   2HD2  ASN  21          2HD2      ASN  21 -10.164  -1.844  -5.460
  169    H    GLY  22           H        GLY  22 -11.760   3.398  -1.672
  170   1HA   GLY  22          1HA       GLY  22 -13.390   4.603  -0.476
  171   2HA   GLY  22          2HA       GLY  22 -14.572   3.377  -0.887
  172    H    LYS  23           H        LYS  23 -11.797   1.847   0.188
  173    HA   LYS  23           HA       LYS  23 -12.897   1.664   2.918
  174   1HB   LYS  23          1HB       LYS  23 -13.037  -0.425   1.577
  175   2HB   LYS  23          2HB       LYS  23 -11.288  -0.395   1.389
  176   1HG   LYS  23          1HG       LYS  23 -10.998  -0.687   3.787
  177   2HG   LYS  23          2HG       LYS  23 -12.750  -0.651   4.019
  178   1HD   LYS  23          1HD       LYS  23 -11.253  -2.684   2.363
  179   2HD   LYS  23          2HD       LYS  23 -11.840  -2.947   4.010
  180   1HE   LYS  23          1HE       LYS  23 -14.132  -2.637   3.273
  181   2HE   LYS  23          2HE       LYS  23 -13.579  -2.243   1.646
  182   1HZ   LYS  23          1HZ       LYS  23 -12.601  -4.775   2.583
  183   2HZ   LYS  23          2HZ       LYS  23 -13.380  -4.378   1.124
  184   3HZ   LYS  23          3HZ       LYS  23 -14.297  -4.699   2.516
  185    H    GLU  24           H        GLU  24 -11.617   2.297   4.545
  186    HA   GLU  24           HA       GLU  24  -8.897   3.126   3.913
  187   1HB   GLU  24          1HB       GLU  24 -10.619   3.560   6.351
  188   2HB   GLU  24          2HB       GLU  24  -8.977   4.163   6.190
  189   1HG   GLU  24          1HG       GLU  24  -9.640   5.550   4.339
  190   2HG   GLU  24          2HG       GLU  24 -11.265   4.871   4.374
  191    H    TYR  25           H        TYR  25  -7.158   1.997   4.463
  192    HA   TYR  25           HA       TYR  25  -7.488  -0.251   6.332
  193   1HB   TYR  25          1HB       TYR  25  -5.467   0.203   4.155
  194   2HB   TYR  25          2HB       TYR  25  -5.397  -1.147   5.269
  195    HD1  TYR  25           HD1      TYR  25  -7.458   0.418   2.622
  196    HD2  TYR  25           HD2      TYR  25  -6.674  -3.082   4.906
  197    HE1  TYR  25           HE1      TYR  25  -8.965  -0.861   1.144
  198    HE2  TYR  25           HE2      TYR  25  -8.177  -4.378   3.428
  199    HH   TYR  25           HH       TYR  25  -9.159  -4.328   1.311
  200    H    ASN  26           H        ASN  26  -6.424  -0.276   8.187
  201    HA   ASN  26           HA       ASN  26  -4.738   2.010   8.826
  202   1HB   ASN  26          1HB       ASN  26  -5.822  -0.226  10.555
  203   2HB   ASN  26          2HB       ASN  26  -4.782   1.060  11.154
  204   1HD2  ASN  26          1HD2      ASN  26  -6.898   2.097   8.714
  205   2HD2  ASN  26          2HD2      ASN  26  -8.098   2.820   9.727
  206    H    SER  27           H        SER  27  -4.290  -0.924   7.473
  207    HA   SER  27           HA       SER  27  -1.464  -0.877   8.046
  208   1HB   SER  27          1HB       SER  27  -1.630  -3.477   8.450
  209   2HB   SER  27          2HB       SER  27  -1.871  -2.356   9.788
  210    HG   SER  27           HG       SER  27  -3.974  -3.469   8.208
  211    H    CYS  28           H        CYS  28  -0.563  -3.062   6.811
  212    HA   CYS  28           HA       CYS  28  -1.182  -2.543   4.064
  213   1HB   CYS  28          1HB       CYS  28   0.532  -4.708   5.296
  214   2HB   CYS  28          2HB       CYS  28   0.480  -4.300   3.587
  215    H    THR  29           H        THR  29  -2.284  -3.830   2.594
  216    HA   THR  29           HA       THR  29  -3.615  -6.193   3.694
  217    HB   THR  29           HB       THR  29  -5.185  -4.282   3.546
  218    HG1  THR  29           HG1      THR  29  -6.116  -6.265   3.311
  219   1HG2  THR  29          1HG2      THR  29  -4.402  -2.997   1.703
  220   2HG2  THR  29          2HG2      THR  29  -6.000  -3.604   1.274
  221   3HG2  THR  29          3HG2      THR  29  -4.556  -4.362   0.602
  222    H    ASP  30           H        ASP  30  -4.369  -7.732   2.008
  223    HA   ASP  30           HA       ASP  30  -2.424  -7.826  -0.156
  224   1HB   ASP  30          1HB       ASP  30  -3.968 -10.210   0.028
  225   2HB   ASP  30          2HB       ASP  30  -2.254 -10.041   0.131
  226    H    THR  31           H        THR  31  -5.406  -6.826   0.392
  227    HA   THR  31           HA       THR  31  -7.109  -7.929  -1.496
  228    HB   THR  31           HB       THR  31  -7.024  -5.043  -0.620
  229    HG1  THR  31           HG1      THR  31  -7.074  -6.242   1.229
  230   1HG2  THR  31          1HG2      THR  31  -9.632  -5.772  -0.687
  231   2HG2  THR  31          2HG2      THR  31  -8.977  -6.611  -2.092
  232   3HG2  THR  31          3HG2      THR  31  -8.795  -4.861  -1.944
  233    H    GLY  32           H        GLY  32  -7.394  -7.664  -3.675
  234   1HA   GLY  32          1HA       GLY  32  -7.183  -6.636  -5.760
  235   2HA   GLY  32          2HA       GLY  32  -6.065  -5.485  -5.052
  236    H    ARG  33           H        ARG  33  -4.327  -7.409  -3.848
  237    HA   ARG  33           HA       ARG  33  -2.740  -8.081  -6.164
  238   1HB   ARG  33          1HB       ARG  33  -2.288  -8.410  -3.197
  239   2HB   ARG  33          2HB       ARG  33  -1.135  -8.937  -4.408
  240   1HG   ARG  33          1HG       ARG  33  -2.100  -6.113  -4.017
  241   2HG   ARG  33          2HG       ARG  33  -0.560  -6.749  -3.453
  242   1HD   ARG  33          1HD       ARG  33  -1.470  -6.437  -6.312
  243   2HD   ARG  33          2HD       ARG  33  -0.223  -5.503  -5.493
  244    HE   ARG  33           HE       ARG  33   0.407  -8.283  -5.487
  245   1HH1  ARG  33          1HH1      ARG  33   0.416  -5.427  -7.513
  246   2HH1  ARG  33          2HH1      ARG  33   1.662  -6.034  -8.561
  247   1HH2  ARG  33          1HH2      ARG  33   1.993  -9.099  -6.895
  248   2HH2  ARG  33          2HH2      ARG  33   2.554  -8.112  -8.215
  249    H    SER  34           H        SER  34  -2.358 -10.064  -6.980
  250    HA   SER  34           HA       SER  34  -4.156 -12.177  -6.192
  251   1HB   SER  34          1HB       SER  34  -2.008 -12.210  -8.333
  252   2HB   SER  34          2HB       SER  34  -3.364 -13.330  -8.177
  253    HG   SER  34           HG       SER  34  -3.334 -10.652  -9.038
  254    H    ASP  35           H        ASP  35  -0.828 -11.341  -5.748
  255    HA   ASP  35           HA       ASP  35   0.014 -13.957  -5.016
  256   1HB   ASP  35          1HB       ASP  35   1.764 -11.853  -4.165
  257   2HB   ASP  35          2HB       ASP  35   2.085 -13.167  -5.251
  258    H    GLY  36           H        GLY  36  -1.836 -11.883  -3.404
  259   1HA   GLY  36          1HA       GLY  36  -2.441 -11.707  -1.191
  260   2HA   GLY  36          2HA       GLY  36  -1.488 -13.162  -0.914
  261    H    PHE  37           H        PHE  37  -0.051 -10.357  -2.357
  262    HA   PHE  37           HA       PHE  37   1.821 -10.167  -0.164
  263   1HB   PHE  37          1HB       PHE  37   1.692  -9.170  -2.937
  264   2HB   PHE  37          2HB       PHE  37   2.470  -8.081  -1.797
  265    HD1  PHE  37           HD1      PHE  37   2.505 -11.741  -2.602
  266    HD2  PHE  37           HD2      PHE  37   4.737  -8.250  -1.618
  267    HE1  PHE  37           HE1      PHE  37   4.592 -13.027  -2.778
  268    HE2  PHE  37           HE2      PHE  37   6.827  -9.536  -1.801
  269    HZ   PHE  37           HZ       PHE  37   6.757 -11.923  -2.378
  270    H    LEU  38           H        LEU  38   1.983  -8.579   1.308
  271    HA   LEU  38           HA       LEU  38  -0.299  -6.873   1.700
  272   1HB   LEU  38          1HB       LEU  38   2.276  -7.100   3.211
  273   2HB   LEU  38          2HB       LEU  38   0.910  -6.142   3.728
  274    HG   LEU  38           HG       LEU  38   0.940  -9.145   3.420
  275   1HD1  LEU  38          1HD1      LEU  38   1.244  -7.317   5.761
  276   2HD1  LEU  38          2HD1      LEU  38   2.151  -8.770   5.344
  277   3HD1  LEU  38          3HD1      LEU  38   0.506  -8.911   5.962
  278   1HD2  LEU  38          1HD2      LEU  38  -1.233  -7.286   3.500
  279   2HD2  LEU  38          2HD2      LEU  38  -1.240  -8.269   4.966
  280   3HD2  LEU  38          3HD2      LEU  38  -1.271  -9.045   3.381
  281    H    TRP  39           H        TRP  39  -0.521  -4.885   0.906
  282    HA   TRP  39           HA       TRP  39   1.918  -3.339   0.365
  283   1HB   TRP  39          1HB       TRP  39   0.965  -2.515  -1.736
  284   2HB   TRP  39          2HB       TRP  39   1.110  -4.264  -1.760
  285    HD1  TRP  39           HD1      TRP  39  -1.212  -5.688  -1.638
  286    HE1  TRP  39           HE1      TRP  39  -3.599  -5.049  -2.317
  287    HE3  TRP  39           HE3      TRP  39  -0.697  -0.598  -1.820
  288    HZ2  TRP  39           HZ2      TRP  39  -5.072  -2.701  -2.851
  289    HZ3  TRP  39           HZ3      TRP  39  -2.657   0.762  -2.420
  290    HH2  TRP  39           HH2      TRP  39  -4.793  -0.277  -2.925
  291    H    CYS  40           H        CYS  40   1.301  -1.006  -0.155
  292    HA   CYS  40           HA       CYS  40  -1.054   0.023   1.202
  293   1HB   CYS  40          1HB       CYS  40   0.153   1.335   2.805
  294   2HB   CYS  40          2HB       CYS  40   0.738  -0.319   2.970
  295    H    SER  41           H        SER  41  -0.947   2.539   0.976
  296    HA   SER  41           HA       SER  41   0.397   3.143  -1.565
  297   1HB   SER  41          1HB       SER  41  -1.354   4.879  -1.918
  298   2HB   SER  41          2HB       SER  41  -2.013   3.245  -1.838
  299    HG   SER  41           HG       SER  41  -2.299   5.381  -0.077
  300    H    THR  42           H        THR  42   1.447   5.191  -1.773
  301    HA   THR  42           HA       THR  42   2.550   6.157   0.707
  302    HB   THR  42           HB       THR  42   2.911   7.212  -2.113
  303    HG1  THR  42           HG1      THR  42   4.999   5.940  -1.698
  304   1HG2  THR  42          1HG2      THR  42   4.875   7.423   0.135
  305   2HG2  THR  42          2HG2      THR  42   3.678   8.675  -0.191
  306   3HG2  THR  42          3HG2      THR  42   4.876   8.258  -1.416
  307    H    THR  43           H        THR  43   0.089   7.057  -1.536
  308    HA   THR  43           HA       THR  43  -0.284   9.647  -0.235
  309    HB   THR  43           HB       THR  43  -1.757  10.135  -2.162
  310    HG1  THR  43           HG1      THR  43  -2.327   8.619  -3.511
  311   1HG2  THR  43          1HG2      THR  43   0.324  10.884  -2.725
  312   2HG2  THR  43          2HG2      THR  43   0.055   9.699  -4.002
  313   3HG2  THR  43          3HG2      THR  43   1.054   9.279  -2.610
  314    H    TYR  44           H        TYR  44  -2.646  10.287   0.036
  315    HA   TYR  44           HA       TYR  44  -3.889   8.383   1.729
  316   1HB   TYR  44          1HB       TYR  44  -5.707  10.248   1.684
  317   2HB   TYR  44          2HB       TYR  44  -4.180  10.548   2.492
  318    HD1  TYR  44           HD1      TYR  44  -5.745  10.942  -0.907
  319    HD2  TYR  44           HD2      TYR  44  -3.152  12.571   2.048
  320    HE1  TYR  44           HE1      TYR  44  -5.413  12.934  -2.301
  321    HE2  TYR  44           HE2      TYR  44  -2.817  14.568   0.656
  322    HH   TYR  44           HH       TYR  44  -4.169  14.785  -2.597
  323    H    ASN  45           H        ASN  45  -4.427   9.475  -1.551
  324    HA   ASN  45           HA       ASN  45  -6.750   7.686  -1.733
  325   1HB   ASN  45          1HB       ASN  45  -7.074  10.165  -2.215
  326   2HB   ASN  45          2HB       ASN  45  -6.065   9.938  -3.626
  327   1HD2  ASN  45          1HD2      ASN  45  -7.398   7.176  -3.903
  328   2HD2  ASN  45          2HD2      ASN  45  -8.872   7.630  -4.625
  329    H    PHE  46           H        PHE  46  -5.996   5.768  -2.473
  330    HA   PHE  46           HA       PHE  46  -3.719   5.526  -4.165
  331   1HB   PHE  46          1HB       PHE  46  -4.290   3.752  -2.605
  332   2HB   PHE  46          2HB       PHE  46  -5.863   3.517  -3.402
  333    HD1  PHE  46           HD1      PHE  46  -5.915   1.535  -4.603
  334    HD2  PHE  46           HD2      PHE  46  -2.292   3.776  -4.563
  335    HE1  PHE  46           HE1      PHE  46  -4.891  -0.100  -6.119
  336    HE2  PHE  46           HE2      PHE  46  -1.269   2.141  -6.078
  337    HZ   PHE  46           HZ       PHE  46  -2.561   0.205  -6.861
  338    H    GLU  47           H        GLU  47  -7.199   5.455  -4.729
  339    HA   GLU  47           HA       GLU  47  -7.108   4.533  -7.382
  340   1HB   GLU  47          1HB       GLU  47  -9.084   4.907  -5.618
  341   2HB   GLU  47          2HB       GLU  47  -9.291   6.377  -6.554
  342   1HG   GLU  47          1HG       GLU  47  -9.599   5.080  -8.575
  343   2HG   GLU  47          2HG       GLU  47  -9.285   3.591  -7.687
  344    H    LYS  48           H        LYS  48  -6.972   7.812  -6.066
  345    HA   LYS  48           HA       LYS  48  -7.077   8.946  -8.703
  346   1HB   LYS  48          1HB       LYS  48  -8.187  10.318  -7.216
  347   2HB   LYS  48          2HB       LYS  48  -7.027  10.057  -5.930
  348   1HG   LYS  48          1HG       LYS  48  -5.458  11.572  -6.962
  349   2HG   LYS  48          2HG       LYS  48  -6.504  11.759  -8.375
  350   1HD   LYS  48          1HD       LYS  48  -6.728  13.659  -6.861
  351   2HD   LYS  48          2HD       LYS  48  -8.236  12.749  -6.962
  352   1HE   LYS  48          1HE       LYS  48  -7.445  11.534  -4.862
  353   2HE   LYS  48          2HE       LYS  48  -6.230  12.803  -4.715
  354   1HZ   LYS  48          1HZ       LYS  48  -8.149  14.416  -4.797
  355   2HZ   LYS  48          2HZ       LYS  48  -8.075  13.440  -3.399
  356   3HZ   LYS  48          3HZ       LYS  48  -9.189  13.080  -4.625
  357    H    ASP  49           H        ASP  49  -4.592   8.613  -6.177
  358    HA   ASP  49           HA       ASP  49  -2.629   9.918  -7.838
  359   1HB   ASP  49          1HB       ASP  49  -2.408   8.535  -5.167
  360   2HB   ASP  49          2HB       ASP  49  -1.040   9.278  -5.991
  361    H    GLY  50           H        GLY  50  -2.923   6.617  -6.482
  362   1HA   GLY  50          1HA       GLY  50  -2.611   4.653  -7.748
  363   2HA   GLY  50          2HA       GLY  50  -1.790   5.607  -8.968
  364    H    LYS  51           H        LYS  51  -0.514   6.509  -6.045
  365    HA   LYS  51           HA       LYS  51   1.893   5.007  -6.551
  366   1HB   LYS  51          1HB       LYS  51   1.154   7.226  -4.715
  367   2HB   LYS  51          2HB       LYS  51   2.646   6.327  -4.458
  368   1HG   LYS  51          1HG       LYS  51   3.550   7.018  -6.468
  369   2HG   LYS  51          2HG       LYS  51   1.975   7.460  -7.135
  370   1HD   LYS  51          1HD       LYS  51   1.834   9.372  -5.804
  371   2HD   LYS  51          2HD       LYS  51   3.158   8.844  -4.760
  372   1HE   LYS  51          1HE       LYS  51   3.741  10.669  -6.396
  373   2HE   LYS  51          2HE       LYS  51   4.770   9.237  -6.459
  374   1HZ   LYS  51          1HZ       LYS  51   3.714  10.340  -8.623
  375   2HZ   LYS  51          2HZ       LYS  51   2.450   9.271  -8.244
  376   3HZ   LYS  51          3HZ       LYS  51   4.019   8.672  -8.506
  377    H    TYR  52           H        TYR  52   2.314   3.072  -5.705
  378    HA   TYR  52           HA       TYR  52   1.431   2.463  -2.992
  379   1HB   TYR  52          1HB       TYR  52   0.449   0.371  -3.599
  380   2HB   TYR  52          2HB       TYR  52  -0.272   1.576  -4.661
  381    HD1  TYR  52           HD1      TYR  52   1.886  -1.367  -4.464
  382    HD2  TYR  52           HD2      TYR  52   0.359   1.658  -7.042
  383    HE1  TYR  52           HE1      TYR  52   2.618  -2.671  -6.411
  384    HE2  TYR  52           HE2      TYR  52   1.081   0.355  -8.996
  385    HH   TYR  52           HH       TYR  52   1.876  -1.624  -9.712
  386    H    GLY  53           H        GLY  53   2.424   0.356  -2.284
  387   1HA   GLY  53          1HA       GLY  53   4.694  -0.624  -3.697
  388   2HA   GLY  53          2HA       GLY  53   5.155   0.408  -2.361
  389    H    PHE  54           H        PHE  54   5.870  -2.236  -2.460
  390    HA   PHE  54           HA       PHE  54   4.004  -3.704  -0.807
  391   1HB   PHE  54          1HB       PHE  54   6.686  -4.487  -1.931
  392   2HB   PHE  54          2HB       PHE  54   5.615  -5.569  -1.045
  393    HD1  PHE  54           HD1      PHE  54   6.635  -6.095  -3.812
  394    HD2  PHE  54           HD2      PHE  54   3.114  -4.130  -2.445
  395    HE1  PHE  54           HE1      PHE  54   5.494  -6.684  -5.905
  396    HE2  PHE  54           HE2      PHE  54   1.970  -4.719  -4.538
  397    HZ   PHE  54           HZ       PHE  54   3.160  -5.994  -6.274
  398    H    CYS  55           H        CYS  55   4.039  -3.649   1.306
  399    HA   CYS  55           HA       CYS  55   6.395  -2.584   2.650
  400   1HB   CYS  55          1HB       CYS  55   4.602  -2.883   4.642
  401   2HB   CYS  55          2HB       CYS  55   4.678  -1.451   3.619
  402    HA   PRO  56           HA       PRO  56   7.594  -6.747   3.665
  403   1HB   PRO  56          1HB       PRO  56   9.606  -6.104   5.348
  404   2HB   PRO  56          2HB       PRO  56   9.758  -6.028   3.590
  405   1HG   PRO  56          1HG       PRO  56   9.203  -3.818   5.544
  406   2HG   PRO  56          2HG       PRO  56  10.312  -3.831   4.155
  407   1HD   PRO  56          1HD       PRO  56   7.871  -2.678   4.042
  408   2HD   PRO  56          2HD       PRO  56   8.588  -3.497   2.638
  409    H    HIS  57           H        HIS  57   5.528  -7.006   4.811
  410    HA   HIS  57           HA       HIS  57   5.855  -6.798   7.730
  411   1HB   HIS  57          1HB       HIS  57   3.953  -5.495   6.516
  412   2HB   HIS  57          2HB       HIS  57   3.185  -7.072   6.371
  413    HD1  HIS  57           HD1      HIS  57   1.321  -5.816   7.913
  414    HD2  HIS  57           HD2      HIS  57   4.954  -6.743   9.730
  415    HE1  HIS  57           HE1      HIS  57   0.915  -5.623  10.388
  416    H    GLU  58           H        GLU  58   6.342  -8.725   8.563
  417    HA   GLU  58           HA       GLU  58   5.672 -11.147   7.181
  418   1HB   GLU  58          1HB       GLU  58   6.750 -12.285   9.128
  419   2HB   GLU  58          2HB       GLU  58   7.780 -11.137   8.297
  420   1HG   GLU  58          1HG       GLU  58   7.307  -9.491  10.092
  421   2HG   GLU  58          2HG       GLU  58   6.380 -10.733  10.934
  422    H    ALA  59           H        ALA  59   3.478 -11.312   7.089
  423    HA   ALA  59           HA       ALA  59   1.936 -11.206   9.552
  424   1HB   ALA  59          1HB       ALA  59   0.033 -11.027   8.255
  425   2HB   ALA  59          2HB       ALA  59   0.761 -11.869   6.883
  426   3HB   ALA  59          3HB       ALA  59   1.236 -10.211   7.266
  Start of MODEL   26
    1   1H    ARG   1          1H        ARG   1  10.945   4.155  10.394
    2   2H    ARG   1          2H        ARG   1  10.170   5.633  10.801
    3   3H    ARG   1          3H        ARG   1  11.204   5.552   9.432
    4    HA   ARG   1           HA       ARG   1   8.754   3.954   9.719
    5   1HB   ARG   1          1HB       ARG   1   8.449   6.494   9.812
    6   2HB   ARG   1          2HB       ARG   1   9.078   6.534   8.172
    7   1HG   ARG   1          1HG       ARG   1   7.213   5.450   7.293
    8   2HG   ARG   1          2HG       ARG   1   6.719   4.819   8.868
    9   1HD   ARG   1          1HD       ARG   1   6.224   7.138   9.587
   10   2HD   ARG   1          2HD       ARG   1   6.628   7.696   7.961
   11    HE   ARG   1           HE       ARG   1   4.644   5.674   7.816
   12   1HH1  ARG   1          1HH1      ARG   1   5.095   9.030   8.740
   13   2HH1  ARG   1          2HH1      ARG   1   3.437   9.458   8.467
   14   1HH2  ARG   1          1HH2      ARG   1   2.464   6.283   7.397
   15   2HH2  ARG   1          2HH2      ARG   1   1.970   7.919   7.688
   16    H    ILE   2           H        ILE   2   9.144   5.517   6.789
   17    HA   ILE   2           HA       ILE   2   9.382   4.658   4.674
   18    HB   ILE   2           HB       ILE   2  11.603   5.615   5.111
   19   1HG1  ILE   2          1HG1      ILE   2  11.700   3.062   3.495
   20   2HG1  ILE   2          2HG1      ILE   2  11.206   4.651   2.916
   21   1HG2  ILE   2          1HG2      ILE   2  11.951   3.299   6.731
   22   2HG2  ILE   2          2HG2      ILE   2  12.997   4.715   6.564
   23   3HG2  ILE   2          3HG2      ILE   2  13.209   3.329   5.493
   24   1HD1  ILE   2          1HD1      ILE   2  13.951   4.100   4.008
   25   2HD1  ILE   2          2HD1      ILE   2  13.404   5.502   3.086
   26   3HD1  ILE   2          3HD1      ILE   2  13.539   3.924   2.305
   27    HA   PRO   3           HA       PRO   3   9.043   0.110   5.607
   28   1HB   PRO   3          1HB       PRO   3   6.200   0.165   5.822
   29   2HB   PRO   3          2HB       PRO   3   7.375  -0.075   7.121
   30   1HG   PRO   3          1HG       PRO   3   5.717   2.126   6.924
   31   2HG   PRO   3          2HG       PRO   3   7.259   2.106   7.802
   32   1HD   PRO   3          1HD       PRO   3   6.701   3.062   4.993
   33   2HD   PRO   3          2HD       PRO   3   7.648   3.852   6.281
   34    H    VAL   4           H        VAL   4   9.077   1.625   3.102
   35    HA   VAL   4           HA       VAL   4   7.413  -0.191   1.478
   36    HB   VAL   4           HB       VAL   4   7.852   2.766   0.850
   37   1HG1  VAL   4          1HG1      VAL   4   6.496   0.535  -0.612
   38   2HG1  VAL   4          2HG1      VAL   4   7.601   1.770  -1.215
   39   3HG1  VAL   4          3HG1      VAL   4   5.939   2.193  -0.809
   40   1HG2  VAL   4          1HG2      VAL   4   5.975   3.303   1.912
   41   2HG2  VAL   4          2HG2      VAL   4   6.038   1.710   2.668
   42   3HG2  VAL   4          3HG2      VAL   4   5.091   1.951   1.200
   43    H    LYS   5           H        LYS   5   8.379  -0.867  -0.459
   44    HA   LYS   5           HA       LYS   5  11.043   0.188  -1.073
   45   1HB   LYS   5          1HB       LYS   5  10.988  -2.011   0.440
   46   2HB   LYS   5          2HB       LYS   5  10.759  -2.782  -1.124
   47   1HG   LYS   5          1HG       LYS   5  13.050  -0.991  -0.340
   48   2HG   LYS   5          2HG       LYS   5  13.104  -2.754  -0.499
   49   1HD   LYS   5          1HD       LYS   5  12.992  -2.681  -2.804
   50   2HD   LYS   5          2HD       LYS   5  12.241  -1.083  -2.828
   51   1HE   LYS   5          1HE       LYS   5  15.091  -1.675  -2.039
   52   2HE   LYS   5          2HE       LYS   5  14.580  -1.026  -3.596
   53   1HZ   LYS   5          1HZ       LYS   5  15.372   0.719  -2.112
   54   2HZ   LYS   5          2HZ       LYS   5  14.182   0.319  -0.964
   55   3HZ   LYS   5          3HZ       LYS   5  13.729   0.944  -2.475
   56    H    TYR   6           H        TYR   6   9.263  -2.688  -2.129
   57    HA   TYR   6           HA       TYR   6   9.815  -2.164  -4.850
   58   1HB   TYR   6          1HB       TYR   6   7.788  -4.092  -3.700
   59   2HB   TYR   6          2HB       TYR   6   8.463  -4.120  -5.331
   60    HD1  TYR   6           HD1      TYR   6   9.326  -4.574  -1.744
   61    HD2  TYR   6           HD2      TYR   6  10.579  -5.111  -5.775
   62    HE1  TYR   6           HE1      TYR   6  11.207  -5.936  -0.972
   63    HE2  TYR   6           HE2      TYR   6  12.452  -6.487  -5.009
   64    HH   TYR   6           HH       TYR   6  13.336  -7.587  -3.245
   65    H    GLY   7           H        GLY   7   8.612  -1.384  -6.448
   66   1HA   GLY   7          1HA       GLY   7   6.519  -0.695  -7.430
   67   2HA   GLY   7          2HA       GLY   7   5.968  -0.182  -5.844
   68    H    ASN   8           H        ASN   8   5.789   1.568  -7.805
   69    HA   ASN   8           HA       ASN   8   8.043   3.087  -8.294
   70   1HB   ASN   8          1HB       ASN   8   6.630   4.948  -9.032
   71   2HB   ASN   8          2HB       ASN   8   6.163   3.408  -9.733
   72   1HD2  ASN   8          1HD2      ASN   8   4.550   5.643  -9.704
   73   2HD2  ASN   8          2HD2      ASN   8   3.170   5.326  -8.720
   74    H    ALA   9           H        ALA   9   6.177   3.049  -5.465
   75    HA   ALA   9           HA       ALA   9   6.968   5.595  -4.390
   76   1HB   ALA   9          1HB       ALA   9   6.193   3.342  -2.633
   77   2HB   ALA   9          2HB       ALA   9   4.978   3.960  -3.773
   78   3HB   ALA   9          3HB       ALA   9   5.694   5.040  -2.573
   79    H    ASP  10           H        ASP  10   9.291   4.206  -5.262
   80    HA   ASP  10           HA       ASP  10  10.542   2.722  -3.210
   81   1HB   ASP  10          1HB       ASP  10  11.197   2.849  -5.686
   82   2HB   ASP  10          2HB       ASP  10  12.045   4.335  -5.261
   83    H    GLY  11           H        GLY  11  10.926   3.500  -1.247
   84   1HA   GLY  11          1HA       GLY  11  12.409   4.749   0.158
   85   2HA   GLY  11          2HA       GLY  11  12.391   6.035  -1.033
   86    H    GLU  12           H        GLU  12   9.263   5.098  -0.786
   87    HA   GLU  12           HA       GLU  12   8.667   7.334   0.972
   88   1HB   GLU  12          1HB       GLU  12   6.862   5.614  -0.730
   89   2HB   GLU  12          2HB       GLU  12   6.333   6.999   0.212
   90   1HG   GLU  12          1HG       GLU  12   8.249   7.042  -2.104
   91   2HG   GLU  12          2HG       GLU  12   6.587   7.611  -2.107
   92    H    TYR  13           H        TYR  13   6.366   6.798   2.131
   93    HA   TYR  13           HA       TYR  13   6.772   4.412   3.743
   94   1HB   TYR  13          1HB       TYR  13   5.885   5.798   5.629
   95   2HB   TYR  13          2HB       TYR  13   7.523   6.146   5.096
   96    HD1  TYR  13           HD1      TYR  13   7.933   8.139   3.683
   97    HD2  TYR  13           HD2      TYR  13   4.193   7.412   5.562
   98    HE1  TYR  13           HE1      TYR  13   7.332  10.505   3.388
   99    HE2  TYR  13           HE2      TYR  13   3.577   9.778   5.280
  100    HH   TYR  13           HH       TYR  13   4.594  11.916   4.928
  101    H    CYS  14           H        CYS  14   4.779   3.705   4.904
  102    HA   CYS  14           HA       CYS  14   2.582   3.633   3.078
  103   1HB   CYS  14          1HB       CYS  14   2.942   2.485   5.842
  104   2HB   CYS  14          2HB       CYS  14   1.517   2.213   4.850
  105    H    LYS  15           H        LYS  15   0.705   4.703   3.134
  106    HA   LYS  15           HA       LYS  15   0.391   6.823   5.104
  107   1HB   LYS  15          1HB       LYS  15   0.043   7.281   2.681
  108   2HB   LYS  15          2HB       LYS  15  -1.315   6.164   2.690
  109   1HG   LYS  15          1HG       LYS  15  -2.101   8.458   2.807
  110   2HG   LYS  15          2HG       LYS  15  -2.477   7.607   4.308
  111   1HD   LYS  15          1HD       LYS  15  -0.669   8.676   5.450
  112   2HD   LYS  15          2HD       LYS  15  -0.051   9.358   3.942
  113   1HE   LYS  15          1HE       LYS  15  -1.258  11.019   5.294
  114   2HE   LYS  15          2HE       LYS  15  -2.021  10.748   3.728
  115   1HZ   LYS  15          1HZ       LYS  15  -2.911   9.493   6.273
  116   2HZ   LYS  15          2HZ       LYS  15  -3.685   9.388   4.762
  117   3HZ   LYS  15          3HZ       LYS  15  -3.616  10.870   5.579
  118    H    PHE  16           H        PHE  16  -0.552   6.260   6.969
  119    HA   PHE  16           HA       PHE  16  -2.797   4.361   6.848
  120   1HB   PHE  16          1HB       PHE  16  -0.772   4.835   9.045
  121   2HB   PHE  16          2HB       PHE  16  -2.217   3.843   9.244
  122    HD1  PHE  16           HD1      PHE  16   0.519   2.827   9.723
  123    HD2  PHE  16           HD2      PHE  16  -1.829   2.907   6.175
  124    HE1  PHE  16           HE1      PHE  16   1.731   0.871   8.887
  125    HE2  PHE  16           HE2      PHE  16  -0.621   0.952   5.326
  126    HZ   PHE  16           HZ       PHE  16   1.176  -0.097   6.665
  127    HA   PRO  17           HA       PRO  17  -4.458   4.055   6.983
  128   1HB   PRO  17          1HB       PRO  17  -7.132   4.675   6.820
  129   2HB   PRO  17          2HB       PRO  17  -6.373   3.857   8.187
  130   1HG   PRO  17          1HG       PRO  17  -7.534   6.494   8.128
  131   2HG   PRO  17          2HG       PRO  17  -6.784   5.667   9.505
  132   1HD   PRO  17          1HD       PRO  17  -5.644   7.700   7.675
  133   2HD   PRO  17          2HD       PRO  17  -5.162   7.272   9.333
  134    H    PHE  18           H        PHE  18  -4.799   3.623   4.795
  135    HA   PHE  18           HA       PHE  18  -5.103   6.002   3.109
  136   1HB   PHE  18          1HB       PHE  18  -4.214   4.677   1.260
  137   2HB   PHE  18          2HB       PHE  18  -3.115   4.642   2.631
  138    HD1  PHE  18           HD1      PHE  18  -3.038   2.582   4.072
  139    HD2  PHE  18           HD2      PHE  18  -5.090   2.714   0.346
  140    HE1  PHE  18           HE1      PHE  18  -2.987   0.131   3.965
  141    HE2  PHE  18           HE2      PHE  18  -5.046   0.260   0.229
  142    HZ   PHE  18           HZ       PHE  18  -3.997  -1.053   2.035
  143    H    LEU  19           H        LEU  19  -6.441   5.803   1.151
  144    HA   LEU  19           HA       LEU  19  -8.908   4.370   1.817
  145   1HB   LEU  19          1HB       LEU  19  -8.891   6.855   1.382
  146   2HB   LEU  19          2HB       LEU  19  -8.480   6.495  -0.283
  147    HG   LEU  19           HG       LEU  19 -10.624   5.149  -0.397
  148   1HD1  LEU  19          1HD1      LEU  19 -12.130   6.458   1.533
  149   2HD1  LEU  19          2HD1      LEU  19 -10.672   5.931   2.375
  150   3HD1  LEU  19          3HD1      LEU  19 -11.666   4.755   1.518
  151   1HD2  LEU  19          1HD2      LEU  19 -12.009   7.117  -0.755
  152   2HD2  LEU  19          2HD2      LEU  19 -10.387   7.373  -1.392
  153   3HD2  LEU  19          3HD2      LEU  19 -10.857   8.107   0.140
  154    H    PHE  20           H        PHE  20  -9.304   2.518   0.857
  155    HA   PHE  20           HA       PHE  20  -8.366   2.083  -1.916
  156   1HB   PHE  20          1HB       PHE  20  -7.246   0.661  -0.042
  157   2HB   PHE  20          2HB       PHE  20  -8.822  -0.114   0.072
  158    HD1  PHE  20           HD1      PHE  20  -7.719  -2.200  -0.393
  159    HD2  PHE  20           HD2      PHE  20  -7.827   0.954  -3.248
  160    HE1  PHE  20           HE1      PHE  20  -7.159  -3.808  -2.158
  161    HE2  PHE  20           HE2      PHE  20  -7.263  -0.660  -5.024
  162    HZ   PHE  20           HZ       PHE  20  -6.934  -3.030  -4.490
  163    H    ASN  21           H        ASN  21 -10.192   2.338  -3.090
  164    HA   ASN  21           HA       ASN  21 -12.317   2.079  -3.873
  165   1HB   ASN  21          1HB       ASN  21 -12.107  -0.516  -2.338
  166   2HB   ASN  21          2HB       ASN  21 -13.391  -0.135  -3.481
  167   1HD2  ASN  21          1HD2      ASN  21 -10.724  -1.873  -3.188
  168   2HD2  ASN  21          2HD2      ASN  21 -10.122  -1.835  -4.806
  169    H    GLY  22           H        GLY  22 -11.915   3.375  -1.224
  170   1HA   GLY  22          1HA       GLY  22 -13.561   4.570  -0.023
  171   2HA   GLY  22          2HA       GLY  22 -14.721   3.318  -0.429
  172    H    LYS  23           H        LYS  23 -11.727   2.109   0.739
  173    HA   LYS  23           HA       LYS  23 -12.852   1.880   3.452
  174   1HB   LYS  23          1HB       LYS  23 -13.116  -0.228   2.167
  175   2HB   LYS  23          2HB       LYS  23 -11.382  -0.280   1.921
  176   1HG   LYS  23          1HG       LYS  23 -11.002  -0.574   4.279
  177   2HG   LYS  23          2HG       LYS  23 -12.721  -0.369   4.622
  178   1HD   LYS  23          1HD       LYS  23 -11.534  -2.584   2.945
  179   2HD   LYS  23          2HD       LYS  23 -12.013  -2.731   4.643
  180   1HE   LYS  23          1HE       LYS  23 -14.307  -2.267   4.090
  181   2HE   LYS  23          2HE       LYS  23 -13.883  -1.913   2.418
  182   1HZ   LYS  23          1HZ       LYS  23 -13.055  -4.289   2.325
  183   2HZ   LYS  23          2HZ       LYS  23 -14.742  -4.070   2.401
  184   3HZ   LYS  23          3HZ       LYS  23 -13.878  -4.534   3.793
  185    H    GLU  24           H        GLU  24 -11.473   2.367   5.062
  186    HA   GLU  24           HA       GLU  24  -8.770   3.177   4.309
  187   1HB   GLU  24          1HB       GLU  24 -10.369   3.634   6.829
  188   2HB   GLU  24          2HB       GLU  24  -8.719   4.183   6.602
  189   1HG   GLU  24          1HG       GLU  24  -9.513   5.488   4.639
  190   2HG   GLU  24          2HG       GLU  24 -11.160   5.044   5.087
  191    H    TYR  25           H        TYR  25  -7.025   2.011   4.757
  192    HA   TYR  25           HA       TYR  25  -7.304  -0.207   6.671
  193   1HB   TYR  25          1HB       TYR  25  -5.365   0.113   4.389
  194   2HB   TYR  25          2HB       TYR  25  -5.336  -1.227   5.516
  195    HD1  TYR  25           HD1      TYR  25  -7.412   0.444   2.954
  196    HD2  TYR  25           HD2      TYR  25  -6.694  -3.131   5.146
  197    HE1  TYR  25           HE1      TYR  25  -9.002  -0.751   1.499
  198    HE2  TYR  25           HE2      TYR  25  -8.285  -4.341   3.688
  199    HH   TYR  25           HH       TYR  25 -10.020  -4.014   2.163
  200    H    ASN  26           H        ASN  26  -6.172  -0.163   8.484
  201    HA   ASN  26           HA       ASN  26  -4.397   2.084   8.983
  202   1HB   ASN  26          1HB       ASN  26  -5.434  -0.115  10.775
  203   2HB   ASN  26          2HB       ASN  26  -4.309   1.123  11.316
  204   1HD2  ASN  26          1HD2      ASN  26  -6.268   2.511   9.058
  205   2HD2  ASN  26          2HD2      ASN  26  -7.452   3.198  10.112
  206    H    SER  27           H        SER  27  -4.045  -0.823   7.624
  207    HA   SER  27           HA       SER  27  -1.199  -0.911   8.189
  208   1HB   SER  27          1HB       SER  27  -1.343  -3.427   8.488
  209   2HB   SER  27          2HB       SER  27  -2.010  -2.480   9.827
  210    HG   SER  27           HG       SER  27  -3.230  -4.348   8.436
  211    H    CYS  28           H        CYS  28  -0.474  -3.096   6.791
  212    HA   CYS  28           HA       CYS  28  -1.173  -2.342   4.082
  213   1HB   CYS  28          1HB       CYS  28   0.681  -4.509   5.098
  214   2HB   CYS  28          2HB       CYS  28   0.550  -3.969   3.428
  215    H    THR  29           H        THR  29  -2.121  -3.783   2.546
  216    HA   THR  29           HA       THR  29  -3.395  -6.148   3.681
  217    HB   THR  29           HB       THR  29  -5.004  -4.262   3.663
  218    HG1  THR  29           HG1      THR  29  -5.730  -6.418   3.350
  219   1HG2  THR  29          1HG2      THR  29  -3.955  -3.525   1.248
  220   2HG2  THR  29          2HG2      THR  29  -5.487  -2.961   1.920
  221   3HG2  THR  29          3HG2      THR  29  -5.462  -4.307   0.781
  222    H    ASP  30           H        ASP  30  -4.209  -7.661   1.974
  223    HA   ASP  30           HA       ASP  30  -2.380  -7.592  -0.305
  224   1HB   ASP  30          1HB       ASP  30  -3.799 -10.065  -0.011
  225   2HB   ASP  30          2HB       ASP  30  -2.092  -9.795  -0.171
  226    H    THR  31           H        THR  31  -5.302  -6.651   0.414
  227    HA   THR  31           HA       THR  31  -7.071  -7.797  -1.423
  228    HB   THR  31           HB       THR  31  -7.056  -4.956  -0.399
  229    HG1  THR  31           HG1      THR  31  -7.124  -5.991   1.460
  230   1HG2  THR  31          1HG2      THR  31  -8.896  -6.185  -2.082
  231   2HG2  THR  31          2HG2      THR  31  -9.100  -4.686  -1.175
  232   3HG2  THR  31          3HG2      THR  31  -9.631  -6.215  -0.479
  233    H    GLY  32           H        GLY  32  -7.630  -7.263  -3.521
  234   1HA   GLY  32          1HA       GLY  32  -7.514  -6.124  -5.553
  235   2HA   GLY  32          2HA       GLY  32  -6.256  -5.101  -4.877
  236    H    ARG  33           H        ARG  33  -4.521  -7.067  -3.933
  237    HA   ARG  33           HA       ARG  33  -3.161  -7.803  -6.350
  238   1HB   ARG  33          1HB       ARG  33  -2.602  -8.443  -3.439
  239   2HB   ARG  33          2HB       ARG  33  -1.537  -8.880  -4.758
  240   1HG   ARG  33          1HG       ARG  33  -2.305  -6.060  -4.060
  241   2HG   ARG  33          2HG       ARG  33  -0.835  -6.865  -3.511
  242   1HD   ARG  33          1HD       ARG  33  -1.600  -6.331  -6.385
  243   2HD   ARG  33          2HD       ARG  33  -0.418  -5.419  -5.446
  244    HE   ARG  33           HE       ARG  33   0.186  -8.214  -5.570
  245   1HH1  ARG  33          1HH1      ARG  33   0.477  -5.169  -7.264
  246   2HH1  ARG  33          2HH1      ARG  33   1.828  -5.693  -8.229
  247   1HH2  ARG  33          1HH2      ARG  33   1.944  -8.911  -6.831
  248   2HH2  ARG  33          2HH2      ARG  33   2.670  -7.815  -7.967
  249    H    SER  34           H        SER  34  -3.331  -9.686  -7.421
  250    HA   SER  34           HA       SER  34  -5.185 -11.679  -6.493
  251   1HB   SER  34          1HB       SER  34  -3.356 -11.814  -8.904
  252   2HB   SER  34          2HB       SER  34  -4.849 -12.714  -8.643
  253    HG   SER  34           HG       SER  34  -4.485  -9.986  -9.262
  254    H    ASP  35           H        ASP  35  -1.829 -11.142  -6.195
  255    HA   ASP  35           HA       ASP  35  -1.193 -13.913  -5.738
  256   1HB   ASP  35          1HB       ASP  35   0.873 -11.955  -5.216
  257   2HB   ASP  35          2HB       ASP  35   0.929 -13.387  -6.210
  258    H    GLY  36           H        GLY  36  -2.555 -11.647  -3.948
  259   1HA   GLY  36          1HA       GLY  36  -2.834 -11.308  -1.700
  260   2HA   GLY  36          2HA       GLY  36  -2.179 -12.925  -1.498
  261    H    PHE  37           H        PHE  37  -0.564 -10.031  -2.804
  262    HA   PHE  37           HA       PHE  37   1.530 -10.470  -0.816
  263   1HB   PHE  37          1HB       PHE  37   1.918 -10.067  -3.381
  264   2HB   PHE  37          2HB       PHE  37   1.725  -8.369  -2.941
  265    HD1  PHE  37           HD1      PHE  37   3.453 -11.299  -1.379
  266    HD2  PHE  37           HD2      PHE  37   3.748  -7.291  -2.790
  267    HE1  PHE  37           HE1      PHE  37   5.788 -11.221  -0.641
  268    HE2  PHE  37           HE2      PHE  37   6.104  -7.220  -2.057
  269    HZ   PHE  37           HZ       PHE  37   7.119  -9.171  -0.983
  270    H    LEU  38           H        LEU  38   2.215  -8.885   0.592
  271    HA   LEU  38           HA       LEU  38   0.133  -7.161   1.543
  272   1HB   LEU  38          1HB       LEU  38   1.861  -8.521   2.885
  273   2HB   LEU  38          2HB       LEU  38   2.973  -7.211   2.528
  274    HG   LEU  38           HG       LEU  38   1.309  -5.658   3.614
  275   1HD1  LEU  38          1HD1      LEU  38  -0.521  -7.500   3.409
  276   2HD1  LEU  38          2HD1      LEU  38  -0.501  -6.427   4.806
  277   3HD1  LEU  38          3HD1      LEU  38   0.147  -8.059   4.946
  278   1HD2  LEU  38          1HD2      LEU  38   1.918  -6.438   5.940
  279   2HD2  LEU  38          2HD2      LEU  38   3.260  -6.194   4.821
  280   3HD2  LEU  38          3HD2      LEU  38   2.690  -7.826   5.168
  281    H    TRP  39           H        TRP  39  -0.237  -5.159   0.821
  282    HA   TRP  39           HA       TRP  39   2.070  -3.466   0.182
  283   1HB   TRP  39          1HB       TRP  39   1.024  -2.549  -1.798
  284   2HB   TRP  39          2HB       TRP  39   1.133  -4.297  -1.965
  285    HD1  TRP  39           HD1      TRP  39  -1.226  -5.677  -1.722
  286    HE1  TRP  39           HE1      TRP  39  -3.635  -4.954  -2.222
  287    HE3  TRP  39           HE3      TRP  39  -0.574  -0.609  -1.768
  288    HZ2  TRP  39           HZ2      TRP  39  -5.067  -2.550  -2.609
  289    HZ3  TRP  39           HZ3      TRP  39  -2.517   0.827  -2.238
  290    HH2  TRP  39           HH2      TRP  39  -4.717  -0.135  -2.638
  291    H    CYS  40           H        CYS  40   1.435  -1.144  -0.034
  292    HA   CYS  40           HA       CYS  40  -0.928  -0.365   1.489
  293   1HB   CYS  40          1HB       CYS  40   0.323   1.002   3.052
  294   2HB   CYS  40          2HB       CYS  40   0.945  -0.645   3.143
  295    H    SER  41           H        SER  41  -1.454   1.899   1.119
  296    HA   SER  41           HA       SER  41  -0.431   2.802  -1.436
  297   1HB   SER  41          1HB       SER  41  -2.868   2.949  -0.907
  298   2HB   SER  41          2HB       SER  41  -2.490   4.127   0.349
  299    HG   SER  41           HG       SER  41  -2.578   5.562  -1.168
  300    H    THR  42           H        THR  42   0.315   5.010  -1.716
  301    HA   THR  42           HA       THR  42   1.961   5.865   0.567
  302    HB   THR  42           HB       THR  42   2.268   6.739  -2.306
  303    HG1  THR  42           HG1      THR  42   3.310   4.433  -1.045
  304   1HG2  THR  42          1HG2      THR  42   4.738   6.702  -1.478
  305   2HG2  THR  42          2HG2      THR  42   3.997   6.849   0.113
  306   3HG2  THR  42          3HG2      THR  42   3.697   8.077  -1.116
  307    H    THR  43           H        THR  43  -0.632   6.699  -1.493
  308    HA   THR  43           HA       THR  43  -0.653   9.458  -0.490
  309    HB   THR  43           HB       THR  43  -2.239   9.797  -2.457
  310    HG1  THR  43           HG1      THR  43  -2.626   8.168  -3.717
  311   1HG2  THR  43          1HG2      THR  43   0.500   8.881  -3.281
  312   2HG2  THR  43          2HG2      THR  43   0.193  10.421  -2.478
  313   3HG2  THR  43          3HG2      THR  43  -0.529  10.090  -4.052
  314    H    TYR  44           H        TYR  44  -3.265  10.086  -1.068
  315    HA   TYR  44           HA       TYR  44  -4.628   8.922   1.172
  316   1HB   TYR  44          1HB       TYR  44  -4.682  11.368   0.259
  317   2HB   TYR  44          2HB       TYR  44  -5.928  10.749  -0.824
  318    HD1  TYR  44           HD1      TYR  44  -7.788   9.270   0.527
  319    HD2  TYR  44           HD2      TYR  44  -5.392  12.367   2.192
  320    HE1  TYR  44           HE1      TYR  44  -9.445   9.579   2.315
  321    HE2  TYR  44           HE2      TYR  44  -7.045  12.687   3.982
  322    HH   TYR  44           HH       TYR  44  -9.496  12.268   4.329
  323    H    ASN  45           H        ASN  45  -5.757   9.390  -2.186
  324    HA   ASN  45           HA       ASN  45  -7.305   6.907  -1.921
  325   1HB   ASN  45          1HB       ASN  45  -8.474   9.066  -2.542
  326   2HB   ASN  45          2HB       ASN  45  -7.579   9.045  -4.044
  327   1HD2  ASN  45          1HD2      ASN  45  -7.944   5.974  -3.965
  328   2HD2  ASN  45          2HD2      ASN  45  -9.533   5.857  -4.551
  329    H    PHE  46           H        PHE  46  -6.075   5.243  -2.563
  330    HA   PHE  46           HA       PHE  46  -3.923   5.290  -4.301
  331   1HB   PHE  46          1HB       PHE  46  -4.244   3.456  -2.786
  332   2HB   PHE  46          2HB       PHE  46  -5.767   3.002  -3.582
  333    HD1  PHE  46           HD1      PHE  46  -2.219   3.691  -4.656
  334    HD2  PHE  46           HD2      PHE  46  -5.592   1.095  -4.876
  335    HE1  PHE  46           HE1      PHE  46  -0.999   2.236  -6.200
  336    HE2  PHE  46           HE2      PHE  46  -4.360  -0.365  -6.422
  337    HZ   PHE  46           HZ       PHE  46  -2.064   0.202  -7.085
  338    H    GLU  47           H        GLU  47  -7.321   4.691  -5.100
  339    HA   GLU  47           HA       GLU  47  -7.030   3.699  -7.663
  340   1HB   GLU  47          1HB       GLU  47  -9.167   3.822  -6.396
  341   2HB   GLU  47          2HB       GLU  47  -9.234   5.543  -6.730
  342   1HG   GLU  47          1HG       GLU  47  -9.303   5.075  -9.122
  343   2HG   GLU  47          2HG       GLU  47  -9.255   3.346  -8.780
  344    H    LYS  48           H        LYS  48  -7.590   7.117  -6.798
  345    HA   LYS  48           HA       LYS  48  -7.132   7.902  -9.510
  346   1HB   LYS  48          1HB       LYS  48  -7.610  10.173  -8.773
  347   2HB   LYS  48          2HB       LYS  48  -8.822   9.040  -8.206
  348   1HG   LYS  48          1HG       LYS  48  -8.539  10.271  -6.325
  349   2HG   LYS  48          2HG       LYS  48  -7.307   9.039  -6.042
  350   1HD   LYS  48          1HD       LYS  48  -5.574  10.501  -6.816
  351   2HD   LYS  48          2HD       LYS  48  -6.759  11.698  -7.350
  352   1HE   LYS  48          1HE       LYS  48  -6.268  10.839  -4.499
  353   2HE   LYS  48          2HE       LYS  48  -5.694  12.335  -5.236
  354   1HZ   LYS  48          1HZ       LYS  48  -8.581  11.733  -5.268
  355   2HZ   LYS  48          2HZ       LYS  48  -7.788  13.236  -5.278
  356   3HZ   LYS  48          3HZ       LYS  48  -7.866  12.326  -3.843
  357    H    ASP  49           H        ASP  49  -5.089   7.751  -6.682
  358    HA   ASP  49           HA       ASP  49  -3.136   9.558  -7.832
  359   1HB   ASP  49          1HB       ASP  49  -3.103   7.866  -5.336
  360   2HB   ASP  49          2HB       ASP  49  -1.721   8.818  -5.867
  361    H    GLY  50           H        GLY  50  -3.085   6.095  -6.940
  362   1HA   GLY  50          1HA       GLY  50  -2.325   4.385  -8.360
  363   2HA   GLY  50          2HA       GLY  50  -1.503   5.587  -9.325
  364    H    LYS  51           H        LYS  51  -0.564   6.468  -6.350
  365    HA   LYS  51           HA       LYS  51   1.981   5.175  -6.641
  366   1HB   LYS  51          1HB       LYS  51   0.901   7.045  -4.570
  367   2HB   LYS  51          2HB       LYS  51   2.570   6.487  -4.627
  368   1HG   LYS  51          1HG       LYS  51   2.890   7.522  -6.763
  369   2HG   LYS  51          2HG       LYS  51   1.180   7.959  -6.847
  370   1HD   LYS  51          1HD       LYS  51   1.416   9.363  -4.919
  371   2HD   LYS  51          2HD       LYS  51   3.111   8.895  -4.758
  372   1HE   LYS  51          1HE       LYS  51   2.890  11.097  -5.815
  373   2HE   LYS  51          2HE       LYS  51   3.616   9.921  -6.913
  374   1HZ   LYS  51          1HZ       LYS  51   1.887  11.375  -7.922
  375   2HZ   LYS  51          2HZ       LYS  51   0.729  10.631  -6.929
  376   3HZ   LYS  51          3HZ       LYS  51   1.575   9.711  -8.092
  377    H    TYR  52           H        TYR  52   2.511   3.247  -5.826
  378    HA   TYR  52           HA       TYR  52   1.366   2.421  -3.264
  379   1HB   TYR  52          1HB       TYR  52   0.755   0.239  -4.091
  380   2HB   TYR  52          2HB       TYR  52   0.007   1.432  -5.147
  381    HD1  TYR  52           HD1      TYR  52   2.618  -1.140  -4.884
  382    HD2  TYR  52           HD2      TYR  52   0.729   1.685  -7.450
  383    HE1  TYR  52           HE1      TYR  52   3.719  -2.178  -6.818
  384    HE2  TYR  52           HE2      TYR  52   1.816   0.648  -9.395
  385    HH   TYR  52           HH       TYR  52   2.813  -1.911  -9.816
  386    H    GLY  53           H        GLY  53   2.435   0.413  -2.495
  387   1HA   GLY  53          1HA       GLY  53   4.936  -0.404  -3.512
  388   2HA   GLY  53          2HA       GLY  53   5.152   0.701  -2.156
  389    H    PHE  54           H        PHE  54   5.975  -1.972  -2.098
  390    HA   PHE  54           HA       PHE  54   3.937  -3.319  -0.503
  391   1HB   PHE  54          1HB       PHE  54   6.573  -4.348  -1.526
  392   2HB   PHE  54          2HB       PHE  54   5.341  -5.306  -0.712
  393    HD1  PHE  54           HD1      PHE  54   2.878  -4.684  -1.876
  394    HD2  PHE  54           HD2      PHE  54   6.675  -4.841  -3.786
  395    HE1  PHE  54           HE1      PHE  54   1.775  -5.117  -4.031
  396    HE2  PHE  54           HE2      PHE  54   5.579  -5.273  -5.938
  397    HZ   PHE  54           HZ       PHE  54   3.128  -5.412  -6.066
  398    H    CYS  55           H        CYS  55   4.414  -4.123   1.611
  399    HA   CYS  55           HA       CYS  55   6.566  -2.608   2.940
  400   1HB   CYS  55          1HB       CYS  55   4.620  -3.373   4.847
  401   2HB   CYS  55          2HB       CYS  55   4.991  -1.753   4.264
  402    HA   PRO  56           HA       PRO  56   7.291  -7.008   4.225
  403   1HB   PRO  56          1HB       PRO  56   8.673  -8.079   2.208
  404   2HB   PRO  56          2HB       PRO  56   6.918  -7.913   2.112
  405   1HG   PRO  56          1HG       PRO  56   8.993  -6.474   0.619
  406   2HG   PRO  56          2HG       PRO  56   7.254  -6.584   0.298
  407   1HD   PRO  56          1HD       PRO  56   8.754  -4.488   1.717
  408   2HD   PRO  56          2HD       PRO  56   7.103  -4.436   1.054
  409    H    HIS  57           H        HIS  57   9.586  -8.283   4.132
  410    HA   HIS  57           HA       HIS  57  11.589  -6.310   4.979
  411   1HB   HIS  57          1HB       HIS  57  11.000  -8.252   6.483
  412   2HB   HIS  57          2HB       HIS  57  11.688  -9.327   5.271
  413    HD1  HIS  57           HD1      HIS  57  14.349  -8.788   4.736
  414    HD2  HIS  57           HD2      HIS  57  12.774  -7.408   8.332
  415    HE1  HIS  57           HE1      HIS  57  16.336  -8.314   6.209
  416    H    GLU  58           H        GLU  58  11.192  -9.167   2.947
  417    HA   GLU  58           HA       GLU  58  13.277  -8.144   1.164
  418   1HB   GLU  58          1HB       GLU  58  13.648 -10.601   0.562
  419   2HB   GLU  58          2HB       GLU  58  14.311 -10.046   2.088
  420   1HG   GLU  58          1HG       GLU  58  11.619 -11.343   2.000
  421   2HG   GLU  58          2HG       GLU  58  13.078 -12.327   1.944
  422    H    ALA  59           H        ALA  59  12.576 -10.505  -0.635
  423    HA   ALA  59           HA       ALA  59  10.075  -9.348  -1.661
  424   1HB   ALA  59          1HB       ALA  59  12.290  -9.273  -3.029
  425   2HB   ALA  59          2HB       ALA  59  10.774  -9.682  -3.831
  426   3HB   ALA  59          3HB       ALA  59  11.908 -10.954  -3.382
  Start of MODEL   27
    1   1H    ARG   1          1H        ARG   1   9.414   3.210  11.514
    2   2H    ARG   1          2H        ARG   1  10.291   4.584  10.974
    3   3H    ARG   1          3H        ARG   1  10.750   3.007  10.456
    4    HA   ARG   1           HA       ARG   1   8.165   3.155   9.750
    5   1HB   ARG   1          1HB       ARG   1   8.465   5.659  10.326
    6   2HB   ARG   1          2HB       ARG   1   9.490   5.738   8.899
    7   1HG   ARG   1          1HG       ARG   1   7.280   6.474   8.330
    8   2HG   ARG   1          2HG       ARG   1   7.592   4.929   7.533
    9   1HD   ARG   1          1HD       ARG   1   6.273   3.747   9.151
   10   2HD   ARG   1          2HD       ARG   1   6.122   5.190  10.158
   11    HE   ARG   1           HE       ARG   1   4.498   4.471   7.926
   12   1HH1  ARG   1          1HH1      ARG   1   5.822   7.173   9.693
   13   2HH1  ARG   1          2HH1      ARG   1   4.612   8.294   9.153
   14   1HH2  ARG   1          1HH2      ARG   1   2.858   5.914   7.258
   15   2HH2  ARG   1          2HH2      ARG   1   2.910   7.571   7.786
   16    H    ILE   2           H        ILE   2   8.425   1.712   8.162
   17    HA   ILE   2           HA       ILE   2  10.849   1.339   6.789
   18    HB   ILE   2           HB       ILE   2   9.400  -0.120   5.220
   19   1HG1  ILE   2          1HG1      ILE   2   7.133  -0.656   6.417
   20   2HG1  ILE   2          2HG1      ILE   2   7.311   0.959   7.080
   21   1HG2  ILE   2          1HG2      ILE   2  10.297  -1.586   6.769
   22   2HG2  ILE   2          2HG2      ILE   2   8.651  -1.606   7.391
   23   3HG2  ILE   2          3HG2      ILE   2   9.854  -0.553   8.124
   24   1HD1  ILE   2          1HD1      ILE   2   7.524   0.544   4.139
   25   2HD1  ILE   2          2HD1      ILE   2   7.031   1.972   5.041
   26   3HD1  ILE   2          3HD1      ILE   2   5.936   0.593   4.913
   27    HA   PRO   3           HA       PRO   3  10.507   4.197   3.470
   28   1HB   PRO   3          1HB       PRO   3  12.533   3.367   1.985
   29   2HB   PRO   3          2HB       PRO   3  12.810   4.009   3.609
   30   1HG   PRO   3          1HG       PRO   3  12.756   1.175   2.673
   31   2HG   PRO   3          2HG       PRO   3  13.841   1.951   3.841
   32   1HD   PRO   3          1HD       PRO   3  11.601   0.427   4.489
   33   2HD   PRO   3          2HD       PRO   3  12.400   1.581   5.575
   34    H    VAL   4           H        VAL   4   9.227   1.228   3.237
   35    HA   VAL   4           HA       VAL   4   7.881   0.185   1.685
   36    HB   VAL   4           HB       VAL   4   8.533   2.554  -0.131
   37   1HG1  VAL   4          1HG1      VAL   4   7.169   0.115  -0.670
   38   2HG1  VAL   4          2HG1      VAL   4   7.410   1.506  -1.723
   39   3HG1  VAL   4          3HG1      VAL   4   5.991   1.426  -0.681
   40   1HG2  VAL   4          1HG2      VAL   4   6.018   2.138   1.481
   41   2HG2  VAL   4          2HG2      VAL   4   6.517   3.571   0.579
   42   3HG2  VAL   4          3HG2      VAL   4   7.385   3.106   2.041
   43    H    LYS   5           H        LYS   5   8.155  -1.304   0.012
   44    HA   LYS   5           HA       LYS   5  10.952  -1.742  -0.624
   45   1HB   LYS   5          1HB       LYS   5   8.498  -3.423  -0.580
   46   2HB   LYS   5          2HB       LYS   5   9.796  -3.910  -1.649
   47   1HG   LYS   5          1HG       LYS   5   9.966  -3.598   1.339
   48   2HG   LYS   5          2HG       LYS   5   9.904  -5.108   0.432
   49   1HD   LYS   5          1HD       LYS   5  12.045  -4.696  -0.554
   50   2HD   LYS   5          2HD       LYS   5  12.116  -3.075   0.145
   51   1HE   LYS   5          1HE       LYS   5  12.118  -4.079   2.400
   52   2HE   LYS   5          2HE       LYS   5  12.091  -5.683   1.675
   53   1HZ   LYS   5          1HZ       LYS   5  14.230  -5.024   0.545
   54   2HZ   LYS   5          2HZ       LYS   5  14.310  -5.240   2.232
   55   3HZ   LYS   5          3HZ       LYS   5  14.268  -3.670   1.581
   56    H    TYR   6           H        TYR   6   8.959  -3.293  -2.809
   57    HA   TYR   6           HA       TYR   6  10.012  -1.692  -4.976
   58   1HB   TYR   6          1HB       TYR   6   8.260  -4.111  -5.333
   59   2HB   TYR   6          2HB       TYR   6   9.556  -3.514  -6.369
   60    HD1  TYR   6           HD1      TYR   6   8.728  -5.620  -3.537
   61    HD2  TYR   6           HD2      TYR   6  11.949  -3.812  -5.660
   62    HE1  TYR   6           HE1      TYR   6  10.305  -7.132  -2.423
   63    HE2  TYR   6           HE2      TYR   6  13.531  -5.328  -4.555
   64    HH   TYR   6           HH       TYR   6  13.735  -7.179  -3.303
   65    H    GLY   7           H        GLY   7   8.504  -1.388  -6.923
   66   1HA   GLY   7          1HA       GLY   7   6.164  -1.045  -7.571
   67   2HA   GLY   7          2HA       GLY   7   5.888  -0.325  -5.996
   68    H    ASN   8           H        ASN   8   5.111   1.551  -7.081
   69    HA   ASN   8           HA       ASN   8   7.244   3.145  -8.350
   70   1HB   ASN   8          1HB       ASN   8   5.555   4.270  -9.647
   71   2HB   ASN   8          2HB       ASN   8   5.333   2.534  -9.824
   72   1HD2  ASN   8          1HD2      ASN   8   3.439   4.723 -10.217
   73   2HD2  ASN   8          2HD2      ASN   8   2.115   4.389  -9.156
   74    H    ALA   9           H        ALA   9   6.439   2.933  -5.447
   75    HA   ALA   9           HA       ALA   9   5.553   5.663  -4.924
   76   1HB   ALA   9          1HB       ALA   9   6.013   3.624  -2.798
   77   2HB   ALA   9          2HB       ALA   9   4.555   3.583  -3.793
   78   3HB   ALA   9          3HB       ALA   9   4.915   5.004  -2.810
   79    H    ASP  10           H        ASP  10   8.345   4.591  -5.719
   80    HA   ASP  10           HA       ASP  10  10.516   5.079  -5.336
   81   1HB   ASP  10          1HB       ASP  10   9.224   7.443  -3.978
   82   2HB   ASP  10          2HB       ASP  10  10.973   7.269  -4.105
   83    H    GLY  11           H        GLY  11  10.432   6.714  -2.393
   84   1HA   GLY  11          1HA       GLY  11  10.698   4.269  -0.820
   85   2HA   GLY  11          2HA       GLY  11  12.092   5.330  -0.912
   86    H    GLU  12           H        GLU  12   8.596   5.900  -0.477
   87    HA   GLU  12           HA       GLU  12   9.229   7.766   1.658
   88   1HB   GLU  12          1HB       GLU  12   6.594   7.083   0.355
   89   2HB   GLU  12          2HB       GLU  12   6.836   8.339   1.560
   90   1HG   GLU  12          1HG       GLU  12   8.128   8.258  -1.153
   91   2HG   GLU  12          2HG       GLU  12   6.745   9.253  -0.696
   92    H    TYR  13           H        TYR  13   6.174   6.641   2.256
   93    HA   TYR  13           HA       TYR  13   6.927   4.446   3.963
   94   1HB   TYR  13          1HB       TYR  13   5.674   5.650   5.832
   95   2HB   TYR  13          2HB       TYR  13   7.350   6.085   5.533
   96    HD1  TYR  13           HD1      TYR  13   3.904   7.060   4.462
   97    HD2  TYR  13           HD2      TYR  13   7.856   8.287   5.412
   98    HE1  TYR  13           HE1      TYR  13   3.233   9.417   4.173
   99    HE2  TYR  13           HE2      TYR  13   7.206  10.648   5.132
  100    HH   TYR  13           HH       TYR  13   4.881  11.737   3.541
  101    H    CYS  14           H        CYS  14   4.899   3.578   5.114
  102    HA   CYS  14           HA       CYS  14   2.782   3.389   3.173
  103   1HB   CYS  14          1HB       CYS  14   3.188   2.136   5.890
  104   2HB   CYS  14          2HB       CYS  14   1.723   1.895   4.949
  105    H    LYS  15           H        LYS  15   1.033   4.669   3.128
  106    HA   LYS  15           HA       LYS  15   0.657   6.565   5.291
  107   1HB   LYS  15          1HB       LYS  15   0.527   7.170   2.822
  108   2HB   LYS  15          2HB       LYS  15  -1.013   6.319   2.783
  109   1HG   LYS  15          1HG       LYS  15  -1.398   8.672   3.041
  110   2HG   LYS  15          2HG       LYS  15  -1.859   7.841   4.530
  111   1HD   LYS  15          1HD       LYS  15   0.391   8.425   5.461
  112   2HD   LYS  15          2HD       LYS  15   0.673   9.403   4.021
  113   1HE   LYS  15          1HE       LYS  15  -0.082  10.821   5.808
  114   2HE   LYS  15          2HE       LYS  15  -1.335  10.728   4.572
  115   1HZ   LYS  15          1HZ       LYS  15  -1.366   8.986   6.974
  116   2HZ   LYS  15          2HZ       LYS  15  -2.642   9.315   5.908
  117   3HZ   LYS  15          3HZ       LYS  15  -2.083  10.523   6.968
  118    H    PHE  16           H        PHE  16  -0.676   6.261   6.909
  119    HA   PHE  16           HA       PHE  16  -2.968   4.446   6.540
  120   1HB   PHE  16          1HB       PHE  16  -1.253   4.741   9.022
  121   2HB   PHE  16          2HB       PHE  16  -2.699   3.741   8.891
  122    HD1  PHE  16           HD1      PHE  16  -2.516   2.231   6.563
  123    HD2  PHE  16           HD2      PHE  16   0.661   3.506   9.083
  124    HE1  PHE  16           HE1      PHE  16  -1.161   0.336   5.801
  125    HE2  PHE  16           HE2      PHE  16   2.032   1.622   8.329
  126    HZ   PHE  16           HZ       PHE  16   1.130  -0.001   6.672
  127    HA   PRO  17           HA       PRO  17  -4.669   4.119   6.822
  128   1HB   PRO  17          1HB       PRO  17  -7.321   4.801   6.614
  129   2HB   PRO  17          2HB       PRO  17  -6.586   4.096   8.054
  130   1HG   PRO  17          1HG       PRO  17  -7.643   6.764   7.715
  131   2HG   PRO  17          2HG       PRO  17  -7.004   6.012   9.184
  132   1HD   PRO  17          1HD       PRO  17  -5.690   7.865   7.309
  133   2HD   PRO  17          2HD       PRO  17  -5.266   7.465   8.984
  134    H    PHE  18           H        PHE  18  -4.604   3.696   4.635
  135    HA   PHE  18           HA       PHE  18  -5.023   5.950   2.836
  136   1HB   PHE  18          1HB       PHE  18  -4.052   4.585   1.078
  137   2HB   PHE  18          2HB       PHE  18  -3.012   4.553   2.494
  138    HD1  PHE  18           HD1      PHE  18  -3.116   2.500   4.001
  139    HD2  PHE  18           HD2      PHE  18  -4.828   2.633   0.110
  140    HE1  PHE  18           HE1      PHE  18  -3.114   0.043   3.920
  141    HE2  PHE  18           HE2      PHE  18  -4.833   0.181   0.014
  142    HZ   PHE  18           HZ       PHE  18  -3.970  -1.138   1.918
  143    H    LEU  19           H        LEU  19  -6.331   5.648   0.857
  144    HA   LEU  19           HA       LEU  19  -8.808   4.251   1.569
  145   1HB   LEU  19          1HB       LEU  19  -8.835   6.690   1.060
  146   2HB   LEU  19          2HB       LEU  19  -8.338   6.316  -0.577
  147    HG   LEU  19           HG       LEU  19 -10.463   4.916  -0.745
  148   1HD1  LEU  19          1HD1      LEU  19 -11.554   6.611   1.432
  149   2HD1  LEU  19          2HD1      LEU  19 -10.704   5.127   1.865
  150   3HD1  LEU  19          3HD1      LEU  19 -12.124   5.065   0.817
  151   1HD2  LEU  19          1HD2      LEU  19 -10.761   6.745  -2.012
  152   2HD2  LEU  19          2HD2      LEU  19 -10.160   7.831  -0.760
  153   3HD2  LEU  19          3HD2      LEU  19 -11.826   7.252  -0.696
  154    H    PHE  20           H        PHE  20  -9.410   2.452   0.592
  155    HA   PHE  20           HA       PHE  20  -8.496   1.917  -2.159
  156   1HB   PHE  20          1HB       PHE  20  -7.247   0.569  -0.294
  157   2HB   PHE  20          2HB       PHE  20  -8.791  -0.254  -0.122
  158    HD1  PHE  20           HD1      PHE  20  -7.652  -2.312  -0.581
  159    HD2  PHE  20           HD2      PHE  20  -7.925   0.784  -3.483
  160    HE1  PHE  20           HE1      PHE  20  -7.111  -3.944  -2.338
  161    HE2  PHE  20           HE2      PHE  20  -7.383  -0.843  -5.252
  162    HZ   PHE  20           HZ       PHE  20  -6.980  -3.203  -4.691
  163    H    ASN  21           H        ASN  21 -10.383   2.026  -3.274
  164    HA   ASN  21           HA       ASN  21 -12.541   1.685  -3.920
  165   1HB   ASN  21          1HB       ASN  21 -12.274  -0.821  -2.262
  166   2HB   ASN  21          2HB       ASN  21 -13.496  -0.522  -3.490
  167   1HD2  ASN  21          1HD2      ASN  21 -10.773  -2.134  -2.912
  168   2HD2  ASN  21          2HD2      ASN  21 -10.108  -2.224  -4.505
  169    H    GLY  22           H        GLY  22 -12.154   3.210  -1.465
  170   1HA   GLY  22          1HA       GLY  22 -13.753   4.329  -0.172
  171   2HA   GLY  22          2HA       GLY  22 -14.892   3.034  -0.493
  172    H    LYS  23           H        LYS  23 -12.116   1.548   0.429
  173    HA   LYS  23           HA       LYS  23 -12.994   1.469   3.237
  174   1HB   LYS  23          1HB       LYS  23 -13.141  -0.686   1.985
  175   2HB   LYS  23          2HB       LYS  23 -11.409  -0.602   1.706
  176   1HG   LYS  23          1HG       LYS  23 -11.015  -0.713   4.116
  177   2HG   LYS  23          2HG       LYS  23 -12.755  -0.812   4.394
  178   1HD   LYS  23          1HD       LYS  23 -12.862  -2.910   3.188
  179   2HD   LYS  23          2HD       LYS  23 -11.150  -2.786   2.775
  180   1HE   LYS  23          1HE       LYS  23 -10.595  -2.874   5.181
  181   2HE   LYS  23          2HE       LYS  23 -12.309  -3.071   5.546
  182   1HZ   LYS  23          1HZ       LYS  23 -10.586  -4.958   4.023
  183   2HZ   LYS  23          2HZ       LYS  23 -12.269  -5.122   4.183
  184   3HZ   LYS  23          3HZ       LYS  23 -11.272  -5.205   5.558
  185    H    GLU  24           H        GLU  24 -11.653   2.287   4.705
  186    HA   GLU  24           HA       GLU  24  -8.972   3.070   3.877
  187   1HB   GLU  24          1HB       GLU  24 -10.448   3.659   6.447
  188   2HB   GLU  24          2HB       GLU  24  -8.945   4.402   5.923
  189   1HG   GLU  24          1HG       GLU  24 -10.083   5.458   4.072
  190   2HG   GLU  24          2HG       GLU  24 -11.585   4.642   4.503
  191    H    TYR  25           H        TYR  25  -7.180   2.043   4.498
  192    HA   TYR  25           HA       TYR  25  -7.478  -0.135   6.446
  193   1HB   TYR  25          1HB       TYR  25  -5.470   0.287   4.259
  194   2HB   TYR  25          2HB       TYR  25  -5.374  -1.033   5.404
  195    HD1  TYR  25           HD1      TYR  25  -7.445   0.453   2.742
  196    HD2  TYR  25           HD2      TYR  25  -6.630  -3.012   5.070
  197    HE1  TYR  25           HE1      TYR  25  -8.930  -0.858   1.279
  198    HE2  TYR  25           HE2      TYR  25  -8.113  -4.339   3.605
  199    HH   TYR  25           HH       TYR  25  -9.560  -4.290   1.897
  200    H    ASN  26           H        ASN  26  -6.477  -0.053   8.317
  201    HA   ASN  26           HA       ASN  26  -4.727   2.205   8.905
  202   1HB   ASN  26          1HB       ASN  26  -5.932   0.061  10.675
  203   2HB   ASN  26          2HB       ASN  26  -4.815   1.282  11.266
  204   1HD2  ASN  26          1HD2      ASN  26  -6.783   2.496   8.814
  205   2HD2  ASN  26          2HD2      ASN  26  -7.952   3.286   9.812
  206    H    SER  27           H        SER  27  -4.439  -0.858   7.748
  207    HA   SER  27           HA       SER  27  -1.593  -0.930   8.335
  208   1HB   SER  27          1HB       SER  27  -1.742  -3.397   8.831
  209   2HB   SER  27          2HB       SER  27  -2.430  -2.359  10.081
  210    HG   SER  27           HG       SER  27  -3.699  -4.273   9.353
  211    H    CYS  28           H        CYS  28  -0.644  -2.911   7.010
  212    HA   CYS  28           HA       CYS  28  -1.380  -2.397   4.286
  213   1HB   CYS  28          1HB       CYS  28   0.569  -4.438   5.378
  214   2HB   CYS  28          2HB       CYS  28   0.463  -3.885   3.710
  215    H    THR  29           H        THR  29  -2.271  -3.806   2.769
  216    HA   THR  29           HA       THR  29  -3.438  -6.273   3.823
  217    HB   THR  29           HB       THR  29  -5.139  -4.496   3.799
  218    HG1  THR  29           HG1      THR  29  -5.761  -6.662   3.295
  219   1HG2  THR  29          1HG2      THR  29  -4.038  -3.844   1.238
  220   2HG2  THR  29          2HG2      THR  29  -5.224  -2.967   2.203
  221   3HG2  THR  29          3HG2      THR  29  -5.753  -4.216   1.079
  222    H    ASP  30           H        ASP  30  -4.294  -7.681   1.990
  223    HA   ASP  30           HA       ASP  30  -2.364  -7.620  -0.198
  224   1HB   ASP  30          1HB       ASP  30  -3.787 -10.089   0.002
  225   2HB   ASP  30          2HB       ASP  30  -2.072  -9.830  -0.032
  226    H    THR  31           H        THR  31  -5.336  -6.729   0.455
  227    HA   THR  31           HA       THR  31  -7.064  -7.873  -1.390
  228    HB   THR  31           HB       THR  31  -7.051  -4.997  -0.500
  229    HG1  THR  31           HG1      THR  31  -6.952  -6.174   1.355
  230   1HG2  THR  31          1HG2      THR  31  -9.563  -6.504  -0.707
  231   2HG2  THR  31          2HG2      THR  31  -8.798  -6.044  -2.227
  232   3HG2  THR  31          3HG2      THR  31  -9.223  -4.808  -1.041
  233    H    GLY  32           H        GLY  32  -7.579  -7.467  -3.519
  234   1HA   GLY  32          1HA       GLY  32  -7.464  -6.424  -5.598
  235   2HA   GLY  32          2HA       GLY  32  -6.273  -5.311  -4.945
  236    H    ARG  33           H        ARG  33  -4.675  -7.475  -3.820
  237    HA   ARG  33           HA       ARG  33  -3.175  -8.143  -6.218
  238   1HB   ARG  33          1HB       ARG  33  -2.561  -8.580  -3.287
  239   2HB   ARG  33          2HB       ARG  33  -1.455  -8.906  -4.607
  240   1HG   ARG  33          1HG       ARG  33  -2.589  -6.184  -4.026
  241   2HG   ARG  33          2HG       ARG  33  -1.059  -6.764  -3.376
  242   1HD   ARG  33          1HD       ARG  33  -1.746  -6.477  -6.294
  243   2HD   ARG  33          2HD       ARG  33  -0.738  -5.370  -5.365
  244    HE   ARG  33           HE       ARG  33   0.234  -8.058  -5.266
  245   1HH1  ARG  33          1HH1      ARG  33   0.167  -5.154  -7.201
  246   2HH1  ARG  33          2HH1      ARG  33   1.620  -5.551  -8.076
  247   1HH2  ARG  33          1HH2      ARG  33   2.137  -8.593  -6.395
  248   2HH2  ARG  33          2HH2      ARG  33   2.745  -7.514  -7.612
  249    H    SER  34           H        SER  34  -3.478 -10.042  -7.208
  250    HA   SER  34           HA       SER  34  -5.022 -12.113  -5.945
  251   1HB   SER  34          1HB       SER  34  -3.571 -12.157  -8.605
  252   2HB   SER  34          2HB       SER  34  -4.828 -13.279  -8.077
  253    HG   SER  34           HG       SER  34  -5.639 -11.601  -9.437
  254    H    ASP  35           H        ASP  35  -1.793 -11.248  -5.938
  255    HA   ASP  35           HA       ASP  35  -0.735 -13.897  -5.730
  256   1HB   ASP  35          1HB       ASP  35   1.037 -11.781  -4.946
  257   2HB   ASP  35          2HB       ASP  35   1.257 -12.986  -6.175
  258    H    GLY  36           H        GLY  36  -2.190 -11.792  -3.682
  259   1HA   GLY  36          1HA       GLY  36  -2.498 -11.827  -1.399
  260   2HA   GLY  36          2HA       GLY  36  -1.603 -13.338  -1.371
  261    H    PHE  37           H        PHE  37  -0.457 -10.196  -2.540
  262    HA   PHE  37           HA       PHE  37   1.742 -10.374  -0.604
  263   1HB   PHE  37          1HB       PHE  37   1.429  -8.847  -3.183
  264   2HB   PHE  37          2HB       PHE  37   2.735  -8.517  -2.060
  265    HD1  PHE  37           HD1      PHE  37   3.795  -9.064  -4.470
  266    HD2  PHE  37           HD2      PHE  37   2.129 -11.913  -1.783
  267    HE1  PHE  37           HE1      PHE  37   5.143 -10.831  -5.518
  268    HE2  PHE  37           HE2      PHE  37   3.477 -13.687  -2.828
  269    HZ   PHE  37           HZ       PHE  37   4.988 -13.147  -4.694
  270    H    LEU  38           H        LEU  38   2.222  -8.755   0.803
  271    HA   LEU  38           HA       LEU  38   0.037  -7.063   1.601
  272   1HB   LEU  38          1HB       LEU  38   2.842  -7.217   2.634
  273   2HB   LEU  38          2HB       LEU  38   1.504  -6.436   3.440
  274    HG   LEU  38           HG       LEU  38   1.472  -9.376   2.826
  275   1HD1  LEU  38          1HD1      LEU  38   3.069  -9.726   4.328
  276   2HD1  LEU  38          2HD1      LEU  38   2.031  -8.990   5.547
  277   3HD1  LEU  38          3HD1      LEU  38   3.191  -8.001   4.663
  278   1HD2  LEU  38          1HD2      LEU  38  -0.641  -8.884   3.475
  279   2HD2  LEU  38          2HD2      LEU  38  -0.145  -7.454   4.384
  280   3HD2  LEU  38          3HD2      LEU  38   0.082  -9.061   5.076
  281    H    TRP  39           H        TRP  39  -0.305  -5.019   0.953
  282    HA   TRP  39           HA       TRP  39   2.025  -3.424   0.178
  283   1HB   TRP  39          1HB       TRP  39   0.955  -2.535  -1.796
  284   2HB   TRP  39          2HB       TRP  39   1.011  -4.285  -1.913
  285    HD1  TRP  39           HD1      TRP  39  -1.365  -5.595  -1.648
  286    HE1  TRP  39           HE1      TRP  39  -3.766  -4.819  -2.126
  287    HE3  TRP  39           HE3      TRP  39  -0.596  -0.547  -1.729
  288    HZ2  TRP  39           HZ2      TRP  39  -5.145  -2.387  -2.496
  289    HZ3  TRP  39           HZ3      TRP  39  -2.514   0.943  -2.167
  290    HH2  TRP  39           HH2      TRP  39  -4.740   0.021  -2.539
  291    H    CYS  40           H        CYS  40   1.411  -1.107  -0.118
  292    HA   CYS  40           HA       CYS  40  -0.858  -0.142   1.418
  293   1HB   CYS  40          1HB       CYS  40   0.526   1.180   2.948
  294   2HB   CYS  40          2HB       CYS  40   0.920  -0.526   3.136
  295    H    SER  41           H        SER  41  -1.033   2.251   1.088
  296    HA   SER  41           HA       SER  41   0.296   3.001  -1.417
  297   1HB   SER  41          1HB       SER  41  -2.154   4.248  -0.140
  298   2HB   SER  41          2HB       SER  41  -1.517   4.590  -1.750
  299    HG   SER  41           HG       SER  41  -2.327   2.760  -2.477
  300    H    THR  42           H        THR  42   1.344   5.075  -1.577
  301    HA   THR  42           HA       THR  42   2.454   6.000   0.911
  302    HB   THR  42           HB       THR  42   3.307   7.655  -1.113
  303    HG1  THR  42           HG1      THR  42   3.100   6.716  -2.945
  304   1HG2  THR  42          1HG2      THR  42   4.864   5.233  -1.090
  305   2HG2  THR  42          2HG2      THR  42   4.459   5.776   0.539
  306   3HG2  THR  42          3HG2      THR  42   5.300   6.861  -0.568
  307    H    THR  43           H        THR  43  -0.013   6.882  -1.313
  308    HA   THR  43           HA       THR  43  -0.283   9.555  -0.146
  309    HB   THR  43           HB       THR  43  -1.757   9.986  -2.089
  310    HG1  THR  43           HG1      THR  43  -2.376   8.433  -3.379
  311   1HG2  THR  43          1HG2      THR  43   0.414   8.783  -3.588
  312   2HG2  THR  43          2HG2      THR  43   0.981   9.725  -2.210
  313   3HG2  THR  43          3HG2      THR  43  -0.051  10.479  -3.426
  314    H    TYR  44           H        TYR  44  -2.845  10.136  -0.341
  315    HA   TYR  44           HA       TYR  44  -4.112   8.390   1.598
  316   1HB   TYR  44          1HB       TYR  44  -5.315  10.837   0.355
  317   2HB   TYR  44          2HB       TYR  44  -5.754  10.093   1.880
  318    HD1  TYR  44           HD1      TYR  44  -2.903  11.862   0.199
  319    HD2  TYR  44           HD2      TYR  44  -4.880  10.961   3.862
  320    HE1  TYR  44           HE1      TYR  44  -1.429  13.432   1.377
  321    HE2  TYR  44           HE2      TYR  44  -3.409  12.532   5.044
  322    HH   TYR  44           HH       TYR  44  -1.775  14.873   3.691
  323    H    ASN  45           H        ASN  45  -4.845   9.765  -1.576
  324    HA   ASN  45           HA       ASN  45  -6.964   7.803  -1.966
  325   1HB   ASN  45          1HB       ASN  45  -7.213  10.272  -2.567
  326   2HB   ASN  45          2HB       ASN  45  -6.087   9.987  -3.871
  327   1HD2  ASN  45          1HD2      ASN  45  -7.465   7.223  -4.155
  328   2HD2  ASN  45          2HD2      ASN  45  -8.842   7.682  -5.034
  329    H    PHE  46           H        PHE  46  -6.179   5.840  -2.600
  330    HA   PHE  46           HA       PHE  46  -3.744   5.562  -4.057
  331   1HB   PHE  46          1HB       PHE  46  -4.417   3.824  -2.531
  332   2HB   PHE  46          2HB       PHE  46  -5.929   3.562  -3.432
  333    HD1  PHE  46           HD1      PHE  46  -2.256   3.769  -4.299
  334    HD2  PHE  46           HD2      PHE  46  -5.911   1.601  -4.646
  335    HE1  PHE  46           HE1      PHE  46  -1.134   2.091  -5.702
  336    HE2  PHE  46           HE2      PHE  46  -4.790  -0.076  -6.037
  337    HZ   PHE  46           HZ       PHE  46  -2.393   0.166  -6.570
  338    H    GLU  47           H        GLU  47  -7.150   5.432  -4.938
  339    HA   GLU  47           HA       GLU  47  -6.909   4.454  -7.540
  340   1HB   GLU  47          1HB       GLU  47  -9.025   4.731  -6.258
  341   2HB   GLU  47          2HB       GLU  47  -8.922   6.463  -6.524
  342   1HG   GLU  47          1HG       GLU  47  -9.003   6.024  -8.971
  343   2HG   GLU  47          2HG       GLU  47  -9.305   4.326  -8.605
  344    H    LYS  48           H        LYS  48  -7.112   7.842  -6.475
  345    HA   LYS  48           HA       LYS  48  -6.763   8.858  -9.086
  346   1HB   LYS  48          1HB       LYS  48  -7.975  10.189  -7.552
  347   2HB   LYS  48          2HB       LYS  48  -6.719  10.093  -6.335
  348   1HG   LYS  48          1HG       LYS  48  -5.311  11.602  -7.636
  349   2HG   LYS  48          2HG       LYS  48  -6.526  11.677  -8.918
  350   1HD   LYS  48          1HD       LYS  48  -7.064  12.490  -6.062
  351   2HD   LYS  48          2HD       LYS  48  -6.513  13.611  -7.301
  352   1HE   LYS  48          1HE       LYS  48  -8.833  13.885  -7.266
  353   2HE   LYS  48          2HE       LYS  48  -8.540  12.842  -8.658
  354   1HZ   LYS  48          1HZ       LYS  48  -9.298  11.806  -5.976
  355   2HZ   LYS  48          2HZ       LYS  48  -9.271  10.953  -7.442
  356   3HZ   LYS  48          3HZ       LYS  48 -10.429  12.161  -7.189
  357    H    ASP  49           H        ASP  49  -4.456   8.245  -6.463
  358    HA   ASP  49           HA       ASP  49  -2.364   9.624  -7.923
  359   1HB   ASP  49          1HB       ASP  49  -2.456   8.237  -5.267
  360   2HB   ASP  49          2HB       ASP  49  -0.912   8.673  -5.995
  361    H    GLY  50           H        GLY  50  -2.895   6.277  -6.840
  362   1HA   GLY  50          1HA       GLY  50  -2.469   4.339  -8.040
  363   2HA   GLY  50          2HA       GLY  50  -1.754   5.321  -9.304
  364    H    LYS  51           H        LYS  51  -0.566   5.909  -6.139
  365    HA   LYS  51           HA       LYS  51   1.933   4.575  -6.867
  366   1HB   LYS  51          1HB       LYS  51   1.284   6.720  -4.845
  367   2HB   LYS  51          2HB       LYS  51   2.833   5.898  -4.880
  368   1HG   LYS  51          1HG       LYS  51   3.071   7.973  -5.991
  369   2HG   LYS  51          2HG       LYS  51   3.128   6.705  -7.212
  370   1HD   LYS  51          1HD       LYS  51   0.977   7.237  -8.004
  371   2HD   LYS  51          2HD       LYS  51   0.590   8.172  -6.563
  372   1HE   LYS  51          1HE       LYS  51   1.013   9.602  -8.504
  373   2HE   LYS  51          2HE       LYS  51   2.174   9.882  -7.211
  374   1HZ   LYS  51          1HZ       LYS  51   3.716   9.649  -8.776
  375   2HZ   LYS  51          2HZ       LYS  51   2.621   9.005  -9.900
  376   3HZ   LYS  51          3HZ       LYS  51   3.370   7.984  -8.771
  377    H    TYR  52           H        TYR  52   2.439   2.696  -5.961
  378    HA   TYR  52           HA       TYR  52   1.397   2.073  -3.290
  379   1HB   TYR  52          1HB       TYR  52   0.706  -0.137  -3.939
  380   2HB   TYR  52          2HB       TYR  52  -0.054   0.999  -5.048
  381    HD1  TYR  52           HD1      TYR  52   1.264   1.425  -7.289
  382    HD2  TYR  52           HD2      TYR  52   1.805  -1.988  -4.807
  383    HE1  TYR  52           HE1      TYR  52   2.243   0.212  -9.185
  384    HE2  TYR  52           HE2      TYR  52   2.788  -3.215  -6.695
  385    HH   TYR  52           HH       TYR  52   4.040  -1.972  -9.258
  386    H    GLY  53           H        GLY  53   2.502   0.270  -2.290
  387   1HA   GLY  53          1HA       GLY  53   5.032  -0.570  -3.391
  388   2HA   GLY  53          2HA       GLY  53   5.139   0.454  -1.968
  389    H    PHE  54           H        PHE  54   6.038  -2.236  -2.040
  390    HA   PHE  54           HA       PHE  54   3.969  -3.789  -0.770
  391   1HB   PHE  54          1HB       PHE  54   6.838  -4.422  -1.404
  392   2HB   PHE  54          2HB       PHE  54   5.729  -5.561  -0.641
  393    HD1  PHE  54           HD1      PHE  54   3.355  -5.682  -1.930
  394    HD2  PHE  54           HD2      PHE  54   7.090  -4.634  -3.689
  395    HE1  PHE  54           HE1      PHE  54   2.484  -6.307  -4.143
  396    HE2  PHE  54           HE2      PHE  54   6.219  -5.258  -5.904
  397    HZ   PHE  54           HZ       PHE  54   3.924  -6.096  -6.133
  398    H    CYS  55           H        CYS  55   3.983  -4.568   1.298
  399    HA   CYS  55           HA       CYS  55   5.107  -2.727   3.230
  400   1HB   CYS  55          1HB       CYS  55   2.704  -3.752   3.097
  401   2HB   CYS  55          2HB       CYS  55   3.450  -5.118   3.921
  402    HA   PRO  56           HA       PRO  56   8.240  -5.851   4.160
  403   1HB   PRO  56          1HB       PRO  56  10.210  -4.132   4.726
  404   2HB   PRO  56          2HB       PRO  56   9.727  -4.471   3.063
  405   1HG   PRO  56          1HG       PRO  56   9.277  -2.058   4.703
  406   2HG   PRO  56          2HG       PRO  56   9.325  -2.225   2.941
  407   1HD   PRO  56          1HD       PRO  56   7.017  -2.100   4.652
  408   2HD   PRO  56          2HD       PRO  56   7.059  -2.273   2.885
  409    H    HIS  57           H        HIS  57   6.197  -5.120   6.071
  410    HA   HIS  57           HA       HIS  57   7.585  -4.346   8.491
  411   1HB   HIS  57          1HB       HIS  57   5.394  -4.563   9.588
  412   2HB   HIS  57          2HB       HIS  57   5.317  -3.529   8.170
  413    HD1  HIS  57           HD1      HIS  57   2.686  -4.458   9.010
  414    HD2  HIS  57           HD2      HIS  57   5.101  -6.847   6.602
  415    HE1  HIS  57           HE1      HIS  57   1.127  -6.068   7.864
  416    H    GLU  58           H        GLU  58   7.734  -7.055   6.868
  417    HA   GLU  58           HA       GLU  58   7.098  -9.021   8.842
  418   1HB   GLU  58          1HB       GLU  58   8.196 -10.604   7.323
  419   2HB   GLU  58          2HB       GLU  58   7.063  -9.578   6.458
  420   1HG   GLU  58          1HG       GLU  58   8.912  -8.205   5.648
  421   2HG   GLU  58          2HG       GLU  58  10.054  -9.220   6.529
  422    H    ALA  59           H        ALA  59   9.074 -10.705   9.176
  423    HA   ALA  59           HA       ALA  59  11.340  -9.145  10.208
  424   1HB   ALA  59          1HB       ALA  59  11.019  -9.909  12.276
  425   2HB   ALA  59          2HB       ALA  59  10.906 -11.571  11.703
  426   3HB   ALA  59          3HB       ALA  59   9.468 -10.553  11.729
  Start of MODEL   28
    1   1H    ARG   1          1H        ARG   1  12.595   5.030   8.772
    2   2H    ARG   1          2H        ARG   1  11.708   6.315   9.496
    3   3H    ARG   1          3H        ARG   1  12.103   6.374   7.821
    4    HA   ARG   1           HA       ARG   1  10.355   4.396   9.131
    5   1HB   ARG   1          1HB       ARG   1   9.542   6.801   8.999
    6   2HB   ARG   1          2HB       ARG   1   9.648   6.676   7.252
    7   1HG   ARG   1          1HG       ARG   1   7.857   5.176   7.131
    8   2HG   ARG   1          2HG       ARG   1   7.970   4.766   8.844
    9   1HD   ARG   1          1HD       ARG   1   7.234   7.025   9.436
   10   2HD   ARG   1          2HD       ARG   1   7.126   7.440   7.725
   11    HE   ARG   1           HE       ARG   1   5.524   5.191   8.131
   12   1HH1  ARG   1          1HH1      ARG   1   5.677   8.530   9.175
   13   2HH1  ARG   1          2HH1      ARG   1   3.955   8.685   9.365
   14   1HH2  ARG   1          1HH2      ARG   1   3.250   5.404   8.385
   15   2HH2  ARG   1          2HH2      ARG   1   2.584   6.916   8.910
   16    H    ILE   2           H        ILE   2   9.868   5.636   5.954
   17    HA   ILE   2           HA       ILE   2   9.590   4.484   3.976
   18    HB   ILE   2           HB       ILE   2  11.809   5.509   3.750
   19   1HG1  ILE   2          1HG1      ILE   2  11.597   2.749   2.529
   20   2HG1  ILE   2          2HG1      ILE   2  11.001   4.261   1.848
   21   1HG2  ILE   2          1HG2      ILE   2  12.574   3.417   5.537
   22   2HG2  ILE   2          2HG2      ILE   2  13.500   4.832   5.009
   23   3HG2  ILE   2          3HG2      ILE   2  13.558   3.337   4.073
   24   1HD1  ILE   2          1HD1      ILE   2  13.906   3.868   2.449
   25   2HD1  ILE   2          2HD1      ILE   2  13.152   5.012   1.338
   26   3HD1  ILE   2          3HD1      ILE   2  13.190   3.294   0.946
   27    HA   PRO   3           HA       PRO   3   9.686   0.071   5.538
   28   1HB   PRO   3          1HB       PRO   3   6.874   0.140   6.137
   29   2HB   PRO   3          2HB       PRO   3   8.217  -0.040   7.266
   30   1HG   PRO   3          1HG       PRO   3   6.582   2.153   7.216
   31   2HG   PRO   3          2HG       PRO   3   8.270   2.201   7.762
   32   1HD   PRO   3          1HD       PRO   3   7.150   2.912   5.054
   33   2HD   PRO   3          2HD       PRO   3   8.306   3.823   6.063
   34    H    VAL   4           H        VAL   4   9.458   1.198   2.968
   35    HA   VAL   4           HA       VAL   4   7.566  -0.646   1.664
   36    HB   VAL   4           HB       VAL   4   8.131   2.240   0.834
   37   1HG1  VAL   4          1HG1      VAL   4   6.458   0.074  -0.405
   38   2HG1  VAL   4          2HG1      VAL   4   7.748   1.034  -1.136
   39   3HG1  VAL   4          3HG1      VAL   4   6.199   1.785  -0.746
   40   1HG2  VAL   4          1HG2      VAL   4   6.469   1.496   2.846
   41   2HG2  VAL   4          2HG2      VAL   4   5.368   1.433   1.468
   42   3HG2  VAL   4          3HG2      VAL   4   6.239   2.924   1.836
   43    H    LYS   5           H        LYS   5   8.304  -1.294  -0.528
   44    HA   LYS   5           HA       LYS   5  11.088  -0.580  -1.113
   45   1HB   LYS   5          1HB       LYS   5  10.727  -2.872   0.193
   46   2HB   LYS   5          2HB       LYS   5  10.361  -3.464  -1.421
   47   1HG   LYS   5          1HG       LYS   5  12.927  -2.152  -0.530
   48   2HG   LYS   5          2HG       LYS   5  12.685  -3.869  -0.899
   49   1HD   LYS   5          1HD       LYS   5  12.725  -3.531  -3.142
   50   2HD   LYS   5          2HD       LYS   5  11.985  -1.930  -3.035
   51   1HE   LYS   5          1HE       LYS   5  14.818  -2.551  -2.203
   52   2HE   LYS   5          2HE       LYS   5  14.372  -1.932  -3.795
   53   1HZ   LYS   5          1HZ       LYS   5  13.454   0.047  -2.749
   54   2HZ   LYS   5          2HZ       LYS   5  15.079  -0.151  -2.308
   55   3HZ   LYS   5          3HZ       LYS   5  13.850  -0.550  -1.203
   56    H    TYR   6           H        TYR   6   9.079  -3.134  -2.492
   57    HA   TYR   6           HA       TYR   6   9.628  -2.245  -5.130
   58   1HB   TYR   6          1HB       TYR   6   7.743  -4.377  -4.095
   59   2HB   TYR   6          2HB       TYR   6   8.100  -4.109  -5.800
   60    HD1  TYR   6           HD1      TYR   6   9.924  -4.692  -2.578
   61    HD2  TYR   6           HD2      TYR   6   9.806  -5.346  -6.782
   62    HE1  TYR   6           HE1      TYR   6  11.922  -6.088  -2.406
   63    HE2  TYR   6           HE2      TYR   6  11.799  -6.759  -6.613
   64    HH   TYR   6           HH       TYR   6  13.004  -7.898  -3.658
   65    H    GLY   7           H        GLY   7   8.230  -1.538  -6.709
   66   1HA   GLY   7          1HA       GLY   7   5.985  -0.842  -7.381
   67   2HA   GLY   7          2HA       GLY   7   5.768  -0.180  -5.770
   68    H    ASN   8           H        ASN   8   5.386   1.912  -6.592
   69    HA   ASN   8           HA       ASN   8   7.804   3.117  -7.747
   70   1HB   ASN   8          1HB       ASN   8   6.441   4.740  -8.928
   71   2HB   ASN   8          2HB       ASN   8   5.963   3.105  -9.365
   72   1HD2  ASN   8          1HD2      ASN   8   4.545   5.678  -9.500
   73   2HD2  ASN   8          2HD2      ASN   8   3.072   5.429  -8.633
   74    H    ALA   9           H        ALA   9   6.718   2.845  -4.913
   75    HA   ALA   9           HA       ALA   9   6.652   5.658  -4.113
   76   1HB   ALA   9          1HB       ALA   9   6.338   3.483  -2.125
   77   2HB   ALA   9          2HB       ALA   9   5.032   3.709  -3.295
   78   3HB   ALA   9          3HB       ALA   9   5.506   5.041  -2.237
   79    H    ASP  10           H        ASP  10   9.082   4.961  -5.050
   80    HA   ASP  10           HA       ASP  10  10.864   3.798  -3.213
   81   1HB   ASP  10          1HB       ASP  10  11.424   5.800  -5.411
   82   2HB   ASP  10          2HB       ASP  10  12.650   4.873  -4.555
   83    H    GLY  11           H        GLY  11  11.107   4.557  -1.206
   84   1HA   GLY  11          1HA       GLY  11  12.228   6.085   0.239
   85   2HA   GLY  11          2HA       GLY  11  11.879   7.369  -0.905
   86    H    GLU  12           H        GLU  12   9.051   6.103  -0.998
   87    HA   GLU  12           HA       GLU  12   7.980   7.839   1.031
   88   1HB   GLU  12          1HB       GLU  12   6.853   6.288  -1.258
   89   2HB   GLU  12          2HB       GLU  12   5.765   6.793   0.028
   90   1HG   GLU  12          1HG       GLU  12   6.295   9.091  -0.330
   91   2HG   GLU  12          2HG       GLU  12   7.570   8.675  -1.460
   92    H    TYR  13           H        TYR  13   6.224   7.101   2.471
   93    HA   TYR  13           HA       TYR  13   6.830   4.486   3.601
   94   1HB   TYR  13          1HB       TYR  13   6.262   5.466   5.735
   95   2HB   TYR  13          2HB       TYR  13   7.560   6.351   4.944
   96    HD1  TYR  13           HD1      TYR  13   3.871   6.403   5.455
   97    HD2  TYR  13           HD2      TYR  13   7.412   8.626   4.696
   98    HE1  TYR  13           HE1      TYR  13   2.600   8.498   5.720
   99    HE2  TYR  13           HE2      TYR  13   6.158  10.733   4.960
  100    HH   TYR  13           HH       TYR  13   4.019  11.618   4.986
  101    H    CYS  14           H        CYS  14   4.975   3.486   4.848
  102    HA   CYS  14           HA       CYS  14   2.626   3.519   3.213
  103   1HB   CYS  14          1HB       CYS  14   3.266   2.101   5.799
  104   2HB   CYS  14          2HB       CYS  14   1.743   1.912   4.942
  105    H    LYS  15           H        LYS  15   1.086   4.980   3.385
  106    HA   LYS  15           HA       LYS  15   0.890   6.607   5.785
  107   1HB   LYS  15          1HB       LYS  15   0.808   7.622   3.491
  108   2HB   LYS  15          2HB       LYS  15  -0.712   6.778   3.223
  109   1HG   LYS  15          1HG       LYS  15  -1.802   8.040   4.917
  110   2HG   LYS  15          2HG       LYS  15  -0.281   8.759   5.444
  111   1HD   LYS  15          1HD       LYS  15  -1.494   9.141   2.710
  112   2HD   LYS  15          2HD       LYS  15  -1.689  10.272   4.052
  113   1HE   LYS  15          1HE       LYS  15   0.703  10.650   4.119
  114   2HE   LYS  15          2HE       LYS  15   0.963   9.441   2.860
  115   1HZ   LYS  15          1HZ       LYS  15   0.240  10.842   1.236
  116   2HZ   LYS  15          2HZ       LYS  15   0.818  12.006   2.324
  117   3HZ   LYS  15          3HZ       LYS  15  -0.847  11.663   2.251
  118    H    PHE  16           H        PHE  16  -0.295   5.898   7.410
  119    HA   PHE  16           HA       PHE  16  -2.714   4.344   6.787
  120   1HB   PHE  16          1HB       PHE  16  -0.979   4.234   9.257
  121   2HB   PHE  16          2HB       PHE  16  -2.464   3.320   9.026
  122    HD1  PHE  16           HD1      PHE  16  -2.288   2.206   6.404
  123    HD2  PHE  16           HD2      PHE  16   0.816   2.843   9.238
  124    HE1  PHE  16           HE1      PHE  16  -0.995   0.382   5.394
  125    HE2  PHE  16           HE2      PHE  16   2.122   1.031   8.237
  126    HZ   PHE  16           HZ       PHE  16   1.226  -0.235   6.304
  127    HA   PRO  17           HA       PRO  17  -4.401   3.944   7.089
  128   1HB   PRO  17          1HB       PRO  17  -7.043   4.745   6.903
  129   2HB   PRO  17          2HB       PRO  17  -6.369   3.751   8.196
  130   1HG   PRO  17          1HG       PRO  17  -7.371   6.432   8.389
  131   2HG   PRO  17          2HG       PRO  17  -6.675   5.438   9.676
  132   1HD   PRO  17          1HD       PRO  17  -5.427   7.584   8.071
  133   2HD   PRO  17          2HD       PRO  17  -4.978   6.957   9.675
  134    H    PHE  18           H        PHE  18  -4.897   3.625   4.906
  135    HA   PHE  18           HA       PHE  18  -5.083   6.097   3.323
  136   1HB   PHE  18          1HB       PHE  18  -4.067   4.956   1.456
  137   2HB   PHE  18          2HB       PHE  18  -3.032   4.783   2.864
  138    HD1  PHE  18           HD1      PHE  18  -3.157   2.559   4.136
  139    HD2  PHE  18           HD2      PHE  18  -4.728   3.109   0.220
  140    HE1  PHE  18           HE1      PHE  18  -3.085   0.129   3.763
  141    HE2  PHE  18           HE2      PHE  18  -4.660   0.686  -0.159
  142    HZ   PHE  18           HZ       PHE  18  -3.829  -0.823   1.611
  143    H    LEU  19           H        LEU  19  -6.285   5.774   1.187
  144    HA   LEU  19           HA       LEU  19  -8.747   4.303   1.828
  145   1HB   LEU  19          1HB       LEU  19  -8.819   6.786   1.511
  146   2HB   LEU  19          2HB       LEU  19  -8.381   6.527  -0.167
  147    HG   LEU  19           HG       LEU  19 -10.450   5.126  -0.408
  148   1HD1  LEU  19          1HD1      LEU  19 -12.136   5.974   1.499
  149   2HD1  LEU  19          2HD1      LEU  19 -10.642   5.875   2.436
  150   3HD1  LEU  19          3HD1      LEU  19 -11.252   4.451   1.587
  151   1HD2  LEU  19          1HD2      LEU  19 -10.112   7.888  -0.469
  152   2HD2  LEU  19          2HD2      LEU  19 -11.626   7.632   0.393
  153   3HD2  LEU  19          3HD2      LEU  19 -11.414   6.956  -1.218
  154    H    PHE  20           H        PHE  20  -9.302   2.578   0.698
  155    HA   PHE  20           HA       PHE  20  -8.228   2.248  -2.034
  156   1HB   PHE  20          1HB       PHE  20  -7.175   0.725  -0.252
  157   2HB   PHE  20          2HB       PHE  20  -8.770  -0.010  -0.129
  158    HD1  PHE  20           HD1      PHE  20  -7.961  -2.128  -0.710
  159    HD2  PHE  20           HD2      PHE  20  -7.566   1.147  -3.390
  160    HE1  PHE  20           HE1      PHE  20  -7.482  -3.713  -2.525
  161    HE2  PHE  20           HE2      PHE  20  -7.081  -0.433  -5.225
  162    HZ   PHE  20           HZ       PHE  20  -7.045  -2.858  -4.802
  163    H    ASN  21           H        ASN  21 -10.032   2.752  -3.147
  164    HA   ASN  21           HA       ASN  21 -12.131   2.659  -3.999
  165   1HB   ASN  21          1HB       ASN  21 -11.769  -0.192  -3.109
  166   2HB   ASN  21          2HB       ASN  21 -13.203   0.346  -3.975
  167   1HD2  ASN  21          1HD2      ASN  21 -13.141   0.123  -6.080
  168   2HD2  ASN  21          2HD2      ASN  21 -11.717   0.053  -7.058
  169    H    GLY  22           H        GLY  22 -11.922   3.550  -1.237
  170   1HA   GLY  22          1HA       GLY  22 -13.744   4.473  -0.025
  171   2HA   GLY  22          2HA       GLY  22 -14.728   3.111  -0.523
  172    H    LYS  23           H        LYS  23 -11.858   1.811   0.445
  173    HA   LYS  23           HA       LYS  23 -12.868   1.492   3.196
  174   1HB   LYS  23          1HB       LYS  23 -12.851  -0.555   1.645
  175   2HB   LYS  23          2HB       LYS  23 -11.099  -0.491   1.770
  176   1HG   LYS  23          1HG       LYS  23 -11.342  -0.683   4.252
  177   2HG   LYS  23          2HG       LYS  23 -13.070  -0.944   4.008
  178   1HD   LYS  23          1HD       LYS  23 -10.818  -2.660   2.963
  179   2HD   LYS  23          2HD       LYS  23 -11.929  -3.059   4.276
  180   1HE   LYS  23          1HE       LYS  23 -13.795  -3.080   2.728
  181   2HE   LYS  23          2HE       LYS  23 -12.741  -2.570   1.409
  182   1HZ   LYS  23          1HZ       LYS  23 -11.504  -4.794   2.321
  183   2HZ   LYS  23          2HZ       LYS  23 -12.561  -4.745   0.996
  184   3HZ   LYS  23          3HZ       LYS  23 -13.137  -5.201   2.531
  185    H    GLU  24           H        GLU  24 -11.557   1.998   4.841
  186    HA   GLU  24           HA       GLU  24  -8.909   3.039   4.175
  187   1HB   GLU  24          1HB       GLU  24 -10.511   3.245   6.731
  188   2HB   GLU  24          2HB       GLU  24  -8.989   4.058   6.415
  189   1HG   GLU  24          1HG       GLU  24  -9.984   5.415   4.731
  190   2HG   GLU  24          2HG       GLU  24 -11.476   4.484   4.786
  191    H    TYR  25           H        TYR  25  -7.047   2.127   4.810
  192    HA   TYR  25           HA       TYR  25  -7.232  -0.270   6.516
  193   1HB   TYR  25          1HB       TYR  25  -5.354   0.319   4.249
  194   2HB   TYR  25          2HB       TYR  25  -5.192  -1.069   5.306
  195    HD1  TYR  25           HD1      TYR  25  -7.518  -2.442   5.517
  196    HD2  TYR  25           HD2      TYR  25  -6.314  -0.031   2.232
  197    HE1  TYR  25           HE1      TYR  25  -9.033  -3.707   4.035
  198    HE2  TYR  25           HE2      TYR  25  -7.815  -1.290   0.740
  199    HH   TYR  25           HH       TYR  25  -9.311  -4.214   1.706
  200    H    ASN  26           H        ASN  26  -6.005  -0.383   8.285
  201    HA   ASN  26           HA       ASN  26  -4.209   1.866   8.861
  202   1HB   ASN  26          1HB       ASN  26  -5.345  -0.284  10.676
  203   2HB   ASN  26          2HB       ASN  26  -4.190   0.930  11.204
  204   1HD2  ASN  26          1HD2      ASN  26  -6.487   1.989   8.894
  205   2HD2  ASN  26          2HD2      ASN  26  -7.516   2.842   9.987
  206    H    SER  27           H        SER  27  -4.154  -1.163   7.613
  207    HA   SER  27           HA       SER  27  -1.290  -1.472   8.129
  208   1HB   SER  27          1HB       SER  27  -1.781  -4.000   8.254
  209   2HB   SER  27          2HB       SER  27  -2.196  -3.029   9.676
  210    HG   SER  27           HG       SER  27  -3.832  -4.426   7.951
  211    H    CYS  28           H        CYS  28  -0.420  -3.251   6.573
  212    HA   CYS  28           HA       CYS  28  -1.228  -2.500   3.921
  213   1HB   CYS  28          1HB       CYS  28   0.749  -4.604   4.837
  214   2HB   CYS  28          2HB       CYS  28   0.574  -4.011   3.185
  215    H    THR  29           H        THR  29  -2.466  -3.638   2.499
  216    HA   THR  29           HA       THR  29  -3.585  -6.158   3.491
  217    HB   THR  29           HB       THR  29  -5.183  -4.282   3.499
  218    HG1  THR  29           HG1      THR  29  -6.162  -6.211   3.153
  219   1HG2  THR  29          1HG2      THR  29  -4.839  -4.235   0.510
  220   2HG2  THR  29          2HG2      THR  29  -4.301  -2.981   1.626
  221   3HG2  THR  29          3HG2      THR  29  -6.023  -3.318   1.443
  222    H    ASP  30           H        ASP  30  -4.419  -7.625   1.787
  223    HA   ASP  30           HA       ASP  30  -2.597  -7.630  -0.495
  224   1HB   ASP  30          1HB       ASP  30  -4.182 -10.005  -0.188
  225   2HB   ASP  30          2HB       ASP  30  -2.460  -9.857  -0.377
  226    H    THR  31           H        THR  31  -5.505  -6.559   0.219
  227    HA   THR  31           HA       THR  31  -7.291  -7.597  -1.671
  228    HB   THR  31           HB       THR  31  -7.165  -4.769  -0.636
  229    HG1  THR  31           HG1      THR  31  -7.203  -5.953   1.172
  230   1HG2  THR  31          1HG2      THR  31  -9.147  -4.409  -1.517
  231   2HG2  THR  31          2HG2      THR  31  -9.795  -5.865  -0.764
  232   3HG2  THR  31          3HG2      THR  31  -9.023  -5.960  -2.346
  233    H    GLY  32           H        GLY  32  -7.733  -7.062  -3.791
  234   1HA   GLY  32          1HA       GLY  32  -7.516  -5.843  -5.789
  235   2HA   GLY  32          2HA       GLY  32  -6.185  -4.947  -5.064
  236    H    ARG  33           H        ARG  33  -4.764  -7.162  -4.074
  237    HA   ARG  33           HA       ARG  33  -3.435  -8.085  -6.483
  238   1HB   ARG  33          1HB       ARG  33  -2.832  -8.582  -3.554
  239   2HB   ARG  33          2HB       ARG  33  -1.787  -8.999  -4.897
  240   1HG   ARG  33          1HG       ARG  33  -2.627  -6.175  -4.324
  241   2HG   ARG  33          2HG       ARG  33  -1.200  -6.908  -3.593
  242   1HD   ARG  33          1HD       ARG  33  -1.728  -6.566  -6.546
  243   2HD   ARG  33          2HD       ARG  33  -0.616  -5.603  -5.576
  244    HE   ARG  33           HE       ARG  33   0.019  -8.376  -5.417
  245   1HH1  ARG  33          1HH1      ARG  33   0.347  -5.533  -7.399
  246   2HH1  ARG  33          2HH1      ARG  33   1.713  -6.144  -8.290
  247   1HH2  ARG  33          1HH2      ARG  33   1.804  -9.206  -6.565
  248   2HH2  ARG  33          2HH2      ARG  33   2.543  -8.251  -7.811
  249    H    SER  34           H        SER  34  -2.762 -10.513  -6.414
  250    HA   SER  34           HA       SER  34  -5.001 -12.123  -5.372
  251   1HB   SER  34          1HB       SER  34  -3.710 -12.496  -8.085
  252   2HB   SER  34          2HB       SER  34  -5.052 -13.430  -7.416
  253    HG   SER  34           HG       SER  34  -6.392 -11.774  -7.710
  254    H    ASP  35           H        ASP  35  -1.691 -11.648  -5.498
  255    HA   ASP  35           HA       ASP  35  -1.004 -14.423  -5.178
  256   1HB   ASP  35          1HB       ASP  35   1.152 -12.575  -4.804
  257   2HB   ASP  35          2HB       ASP  35   1.012 -13.876  -5.949
  258    H    GLY  36           H        GLY  36  -2.288 -12.395  -3.169
  259   1HA   GLY  36          1HA       GLY  36  -2.415 -12.321  -0.870
  260   2HA   GLY  36          2HA       GLY  36  -1.281 -13.662  -0.832
  261    H    PHE  37           H        PHE  37  -0.495 -10.709  -2.484
  262    HA   PHE  37           HA       PHE  37   1.688 -10.257  -0.606
  263   1HB   PHE  37          1HB       PHE  37   1.109  -9.358  -3.403
  264   2HB   PHE  37          2HB       PHE  37   2.233  -8.432  -2.415
  265    HD1  PHE  37           HD1      PHE  37   3.963 -10.057  -1.109
  266    HD2  PHE  37           HD2      PHE  37   2.058 -10.877  -4.824
  267    HE1  PHE  37           HE1      PHE  37   5.780 -11.606  -1.695
  268    HE2  PHE  37           HE2      PHE  37   3.872 -12.428  -5.415
  269    HZ   PHE  37           HZ       PHE  37   5.735 -12.792  -3.852
  270    H    LEU  38           H        LEU  38   1.662  -8.716   0.883
  271    HA   LEU  38           HA       LEU  38  -0.613  -6.944   1.042
  272   1HB   LEU  38          1HB       LEU  38   1.768  -7.166   2.849
  273   2HB   LEU  38          2HB       LEU  38   0.336  -6.223   3.174
  274    HG   LEU  38           HG       LEU  38  -0.932  -8.478   3.032
  275   1HD1  LEU  38          1HD1      LEU  38   0.286 -10.260   2.532
  276   2HD1  LEU  38          2HD1      LEU  38   1.054 -10.092   4.112
  277   3HD1  LEU  38          3HD1      LEU  38   1.795  -9.360   2.686
  278   1HD2  LEU  38          1HD2      LEU  38  -0.470  -7.089   5.075
  279   2HD2  LEU  38          2HD2      LEU  38   0.946  -8.107   5.356
  280   3HD2  LEU  38          3HD2      LEU  38  -0.671  -8.812   5.360
  281    H    TRP  39           H        TRP  39  -0.655  -4.838   0.557
  282    HA   TRP  39           HA       TRP  39   1.882  -3.454   0.023
  283   1HB   TRP  39          1HB       TRP  39   0.924  -2.425  -2.003
  284   2HB   TRP  39          2HB       TRP  39   0.969  -4.175  -2.155
  285    HD1  TRP  39           HD1      TRP  39  -1.447  -5.473  -1.965
  286    HE1  TRP  39           HE1      TRP  39  -3.821  -4.653  -2.468
  287    HE3  TRP  39           HE3      TRP  39  -0.601  -0.422  -1.982
  288    HZ2  TRP  39           HZ2      TRP  39  -5.162  -2.200  -2.838
  289    HZ3  TRP  39           HZ3      TRP  39  -2.496   1.082  -2.432
  290    HH2  TRP  39           HH2      TRP  39  -4.725   0.203  -2.843
  291    H    CYS  40           H        CYS  40   1.381  -1.021  -0.312
  292    HA   CYS  40           HA       CYS  40  -0.893  -0.074   1.229
  293   1HB   CYS  40          1HB       CYS  40   0.404   1.071   2.882
  294   2HB   CYS  40          2HB       CYS  40   1.011  -0.581   2.834
  295    H    SER  41           H        SER  41  -0.856   2.415   1.207
  296    HA   SER  41           HA       SER  41   0.447   3.329  -1.269
  297   1HB   SER  41          1HB       SER  41  -2.031   3.116  -1.525
  298   2HB   SER  41          2HB       SER  41  -2.228   4.300  -0.235
  299    HG   SER  41           HG       SER  41  -0.987   4.694  -2.767
  300    H    THR  42           H        THR  42   0.823   5.670  -1.329
  301    HA   THR  42           HA       THR  42   1.360   6.765   1.351
  302    HB   THR  42           HB       THR  42   3.037   7.139  -1.142
  303    HG1  THR  42           HG1      THR  42   3.846   5.627   1.082
  304   1HG2  THR  42          1HG2      THR  42   4.609   8.248   0.092
  305   2HG2  THR  42          2HG2      THR  42   4.049   7.576   1.623
  306   3HG2  THR  42          3HG2      THR  42   3.121   8.846   0.827
  307    H    THR  43           H        THR  43  -0.153   7.136  -1.633
  308    HA   THR  43           HA       THR  43  -0.270  10.037  -1.427
  309    HB   THR  43           HB       THR  43   0.361   9.037  -3.558
  310    HG1  THR  43           HG1      THR  43  -2.119  10.401  -3.501
  311   1HG2  THR  43          1HG2      THR  43  -2.099   7.511  -3.148
  312   2HG2  THR  43          2HG2      THR  43  -0.634   7.109  -4.046
  313   3HG2  THR  43          3HG2      THR  43  -1.858   8.152  -4.775
  314    H    TYR  44           H        TYR  44  -1.751   7.935   0.207
  315    HA   TYR  44           HA       TYR  44  -3.716   7.797   1.313
  316   1HB   TYR  44          1HB       TYR  44  -3.653  10.241   1.408
  317   2HB   TYR  44          2HB       TYR  44  -4.423  10.338  -0.173
  318    HD1  TYR  44           HD1      TYR  44  -6.837   9.535  -0.391
  319    HD2  TYR  44           HD2      TYR  44  -4.927   9.995   3.390
  320    HE1  TYR  44           HE1      TYR  44  -9.032   9.555   0.712
  321    HE2  TYR  44           HE2      TYR  44  -7.123  10.021   4.493
  322    HH   TYR  44           HH       TYR  44  -9.438   9.179   4.024
  323    H    ASN  45           H        ASN  45  -5.049   9.215  -1.662
  324    HA   ASN  45           HA       ASN  45  -6.828   6.948  -1.867
  325   1HB   ASN  45          1HB       ASN  45  -7.446   9.420  -2.231
  326   2HB   ASN  45          2HB       ASN  45  -6.669   9.264  -3.783
  327   1HD2  ASN  45          1HD2      ASN  45  -7.807   6.367  -3.798
  328   2HD2  ASN  45          2HD2      ASN  45  -9.395   6.701  -4.299
  329    H    PHE  46           H        PHE  46  -6.126   5.175  -2.854
  330    HA   PHE  46           HA       PHE  46  -3.952   5.160  -4.726
  331   1HB   PHE  46          1HB       PHE  46  -4.331   3.347  -3.090
  332   2HB   PHE  46          2HB       PHE  46  -5.861   2.947  -3.899
  333    HD1  PHE  46           HD1      PHE  46  -2.216   3.392  -4.760
  334    HD2  PHE  46           HD2      PHE  46  -5.797   1.162  -5.366
  335    HE1  PHE  46           HE1      PHE  46  -1.019   1.861  -6.251
  336    HE2  PHE  46           HE2      PHE  46  -4.593  -0.371  -6.853
  337    HZ   PHE  46           HZ       PHE  46  -2.198  -0.023  -7.300
  338    H    GLU  47           H        GLU  47  -7.361   5.343  -4.982
  339    HA   GLU  47           HA       GLU  47  -7.816   4.177  -7.481
  340   1HB   GLU  47          1HB       GLU  47  -9.553   4.741  -5.826
  341   2HB   GLU  47          2HB       GLU  47  -9.304   6.443  -6.144
  342   1HG   GLU  47          1HG       GLU  47 -10.056   6.119  -8.445
  343   2HG   GLU  47          2HG       GLU  47 -10.323   4.408  -8.108
  344    H    LYS  48           H        LYS  48  -7.540   7.673  -6.749
  345    HA   LYS  48           HA       LYS  48  -7.444   8.272  -9.544
  346   1HB   LYS  48          1HB       LYS  48  -7.154  10.652  -8.743
  347   2HB   LYS  48          2HB       LYS  48  -8.642   9.837  -8.302
  348   1HG   LYS  48          1HG       LYS  48  -7.684   9.383  -6.056
  349   2HG   LYS  48          2HG       LYS  48  -6.258  10.321  -6.521
  350   1HD   LYS  48          1HD       LYS  48  -7.651  12.292  -6.868
  351   2HD   LYS  48          2HD       LYS  48  -9.097  11.361  -6.464
  352   1HE   LYS  48          1HE       LYS  48  -8.150  10.947  -4.218
  353   2HE   LYS  48          2HE       LYS  48  -6.775  11.968  -4.630
  354   1HZ   LYS  48          1HZ       LYS  48  -9.565  12.727  -4.066
  355   2HZ   LYS  48          2HZ       LYS  48  -8.675  13.682  -5.156
  356   3HZ   LYS  48          3HZ       LYS  48  -8.110  13.464  -3.562
  357    H    ASP  49           H        ASP  49  -4.995   8.336  -6.951
  358    HA   ASP  49           HA       ASP  49  -3.064   9.410  -8.825
  359   1HB   ASP  49          1HB       ASP  49  -2.828   8.608  -5.925
  360   2HB   ASP  49          2HB       ASP  49  -1.458   9.165  -6.883
  361    H    GLY  50           H        GLY  50  -3.117   6.462  -6.797
  362   1HA   GLY  50          1HA       GLY  50  -2.798   4.295  -7.636
  363   2HA   GLY  50          2HA       GLY  50  -2.128   4.992  -9.095
  364    H    LYS  51           H        LYS  51  -0.640   6.389  -6.352
  365    HA   LYS  51           HA       LYS  51   1.723   4.825  -6.951
  366   1HB   LYS  51          1HB       LYS  51   1.385   7.076  -4.964
  367   2HB   LYS  51          2HB       LYS  51   2.900   6.283  -5.336
  368   1HG   LYS  51          1HG       LYS  51   3.189   7.866  -6.848
  369   2HG   LYS  51          2HG       LYS  51   1.961   7.027  -7.802
  370   1HD   LYS  51          1HD       LYS  51   1.218   9.245  -7.742
  371   2HD   LYS  51          2HD       LYS  51   0.267   8.443  -6.489
  372   1HE   LYS  51          1HE       LYS  51   1.840   9.277  -4.789
  373   2HE   LYS  51          2HE       LYS  51   2.756  10.097  -6.054
  374   1HZ   LYS  51          1HZ       LYS  51   1.360  11.710  -5.107
  375   2HZ   LYS  51          2HZ       LYS  51   0.004  10.689  -5.119
  376   3HZ   LYS  51          3HZ       LYS  51   0.619  11.302  -6.581
  377    H    TYR  52           H        TYR  52   2.692   3.317  -5.648
  378    HA   TYR  52           HA       TYR  52   1.625   2.731  -3.013
  379   1HB   TYR  52          1HB       TYR  52   0.829   0.495  -3.620
  380   2HB   TYR  52          2HB       TYR  52   0.009   1.701  -4.608
  381    HD1  TYR  52           HD1      TYR  52   2.558  -0.953  -4.624
  382    HD2  TYR  52           HD2      TYR  52   0.393   1.851  -6.979
  383    HE1  TYR  52           HE1      TYR  52   3.378  -2.042  -6.663
  384    HE2  TYR  52           HE2      TYR  52   1.194   0.761  -9.018
  385    HH   TYR  52           HH       TYR  52   3.635  -0.924  -9.365
  386    H    GLY  53           H        GLY  53   2.549   0.487  -2.322
  387   1HA   GLY  53          1HA       GLY  53   4.970  -0.398  -3.514
  388   2HA   GLY  53          2HA       GLY  53   5.274   0.576  -2.084
  389    H    PHE  54           H        PHE  54   5.958  -2.160  -2.307
  390    HA   PHE  54           HA       PHE  54   3.918  -3.582  -0.803
  391   1HB   PHE  54          1HB       PHE  54   6.560  -4.529  -1.895
  392   2HB   PHE  54          2HB       PHE  54   5.390  -5.553  -1.072
  393    HD1  PHE  54           HD1      PHE  54   5.601  -3.186  -3.947
  394    HD2  PHE  54           HD2      PHE  54   3.866  -6.717  -2.331
  395    HE1  PHE  54           HE1      PHE  54   4.449  -3.585  -6.075
  396    HE2  PHE  54           HE2      PHE  54   2.714  -7.125  -4.461
  397    HZ   PHE  54           HZ       PHE  54   2.998  -5.554  -6.336
  398    H    CYS  55           H        CYS  55   4.198  -4.397   1.277
  399    HA   CYS  55           HA       CYS  55   6.263  -2.975   2.797
  400   1HB   CYS  55          1HB       CYS  55   4.055  -4.401   4.191
  401   2HB   CYS  55          2HB       CYS  55   4.842  -2.879   4.583
  402    HA   PRO  56           HA       PRO  56   6.941  -7.284   4.546
  403   1HB   PRO  56          1HB       PRO  56   5.360  -9.371   4.002
  404   2HB   PRO  56          2HB       PRO  56   4.950  -8.155   5.214
  405   1HG   PRO  56          1HG       PRO  56   3.857  -8.553   2.489
  406   2HG   PRO  56          2HG       PRO  56   3.068  -7.908   3.935
  407   1HD   PRO  56          1HD       PRO  56   4.127  -6.413   1.794
  408   2HD   PRO  56          2HD       PRO  56   3.594  -5.791   3.367
  409    H    HIS  57           H        HIS  57   8.725  -7.187   3.193
  410    HA   HIS  57           HA       HIS  57   8.873  -9.382   1.277
  411   1HB   HIS  57          1HB       HIS  57   9.364  -6.555   0.741
  412   2HB   HIS  57          2HB       HIS  57  10.592  -7.646   0.128
  413    HD1  HIS  57           HD1      HIS  57   6.805  -8.052   0.173
  414    HD2  HIS  57           HD2      HIS  57   9.975  -7.879  -2.515
  415    HE1  HIS  57           HE1      HIS  57   5.800  -8.489  -2.093
  416    H    GLU  58           H        GLU  58  10.854  -6.836   2.745
  417    HA   GLU  58           HA       GLU  58  12.654  -8.909   3.789
  418   1HB   GLU  58          1HB       GLU  58  14.495  -7.270   3.610
  419   2HB   GLU  58          2HB       GLU  58  13.845  -7.710   2.045
  420   1HG   GLU  58          1HG       GLU  58  12.643  -5.612   1.929
  421   2HG   GLU  58          2HG       GLU  58  13.183  -5.192   3.554
  422    H    ALA  59           H        ALA  59  10.304  -6.912   4.566
  423    HA   ALA  59           HA       ALA  59  11.483  -6.051   7.110
  424   1HB   ALA  59          1HB       ALA  59   8.891  -4.917   6.297
  425   2HB   ALA  59          2HB       ALA  59  10.276  -4.458   5.307
  426   3HB   ALA  59          3HB       ALA  59  10.285  -4.137   7.043
  Start of MODEL   29
    1   1H    ARG   1          1H        ARG   1   4.461   4.350  10.882
    2   2H    ARG   1          2H        ARG   1   3.960   5.968  10.576
    3   3H    ARG   1          3H        ARG   1   5.479   5.661  11.329
    4    HA   ARG   1           HA       ARG   1   4.658   5.298   8.556
    5   1HB   ARG   1          1HB       ARG   1   5.944   7.265   9.835
    6   2HB   ARG   1          2HB       ARG   1   7.321   6.220   9.522
    7   1HG   ARG   1          1HG       ARG   1   7.252   7.762   7.753
    8   2HG   ARG   1          2HG       ARG   1   6.634   6.248   7.093
    9   1HD   ARG   1          1HD       ARG   1   4.344   7.058   7.331
   10   2HD   ARG   1          2HD       ARG   1   4.932   8.551   8.064
   11    HE   ARG   1           HE       ARG   1   6.104   8.214   5.505
   12   1HH1  ARG   1          1HH1      ARG   1   3.117   9.086   7.077
   13   2HH1  ARG   1          2HH1      ARG   1   2.524  10.025   5.738
   14   1HH2  ARG   1          1HH2      ARG   1   5.378   9.472   3.755
   15   2HH2  ARG   1          2HH2      ARG   1   3.815  10.234   3.820
   16    H    ILE   2           H        ILE   2   5.278   3.476   7.496
   17    HA   ILE   2           HA       ILE   2   7.486   1.915   8.624
   18    HB   ILE   2           HB       ILE   2   5.263   0.861   9.190
   19   1HG1  ILE   2          1HG1      ILE   2   7.156  -0.747   7.466
   20   2HG1  ILE   2          2HG1      ILE   2   7.294  -0.472   9.201
   21   1HG2  ILE   2          1HG2      ILE   2   5.138   0.495   6.206
   22   2HG2  ILE   2          2HG2      ILE   2   3.941   1.239   7.271
   23   3HG2  ILE   2          3HG2      ILE   2   4.224  -0.501   7.343
   24   1HD1  ILE   2          1HD1      ILE   2   6.419  -2.699   8.606
   25   2HD1  ILE   2          2HD1      ILE   2   5.012  -1.918   7.883
   26   3HD1  ILE   2          3HD1      ILE   2   5.318  -1.762   9.613
   27    HA   PRO   3           HA       PRO   3   9.520   2.237   4.756
   28   1HB   PRO   3          1HB       PRO   3  10.552  -0.379   4.737
   29   2HB   PRO   3          2HB       PRO   3  11.334   1.063   5.382
   30   1HG   PRO   3          1HG       PRO   3   9.778  -1.043   6.790
   31   2HG   PRO   3          2HG       PRO   3  11.193  -0.120   7.337
   32   1HD   PRO   3          1HD       PRO   3   8.763   0.467   8.264
   33   2HD   PRO   3          2HD       PRO   3   9.914   1.766   7.880
   34    H    VAL   4           H        VAL   4   9.547   1.584   2.653
   35    HA   VAL   4           HA       VAL   4   7.487  -0.370   1.815
   36    HB   VAL   4           HB       VAL   4   8.239   2.281   0.503
   37   1HG1  VAL   4          1HG1      VAL   4   7.181  -0.108  -0.660
   38   2HG1  VAL   4          2HG1      VAL   4   7.542   1.440  -1.422
   39   3HG1  VAL   4          3HG1      VAL   4   5.959   1.159  -0.700
   40   1HG2  VAL   4          1HG2      VAL   4   5.431   1.757   1.075
   41   2HG2  VAL   4          2HG2      VAL   4   6.416   3.173   1.437
   42   3HG2  VAL   4          3HG2      VAL   4   6.433   1.786   2.526
   43    H    LYS   5           H        LYS   5   8.007  -1.626  -0.030
   44    HA   LYS   5           HA       LYS   5  10.891  -1.714  -0.563
   45   1HB   LYS   5          1HB       LYS   5   8.830  -3.774  -0.167
   46   2HB   LYS   5          2HB       LYS   5   9.950  -4.107  -1.480
   47   1HG   LYS   5          1HG       LYS   5  10.658  -3.608   1.407
   48   2HG   LYS   5          2HG       LYS   5  10.678  -5.163   0.558
   49   1HD   LYS   5          1HD       LYS   5  12.491  -4.457  -0.841
   50   2HD   LYS   5          2HD       LYS   5  12.397  -2.804  -0.224
   51   1HE   LYS   5          1HE       LYS   5  13.163  -5.271   1.335
   52   2HE   LYS   5          2HE       LYS   5  14.248  -3.987   0.807
   53   1HZ   LYS   5          1HZ       LYS   5  12.003  -3.676   2.739
   54   2HZ   LYS   5          2HZ       LYS   5  13.040  -2.434   2.235
   55   3HZ   LYS   5          3HZ       LYS   5  13.655  -3.741   3.133
   56    H    TYR   6           H        TYR   6   8.656  -3.516  -2.438
   57    HA   TYR   6           HA       TYR   6   9.630  -2.251  -4.855
   58   1HB   TYR   6          1HB       TYR   6   7.854  -4.688  -4.561
   59   2HB   TYR   6          2HB       TYR   6   8.774  -4.206  -5.986
   60    HD1  TYR   6           HD1      TYR   6   8.923  -6.905  -4.493
   61    HD2  TYR   6           HD2      TYR   6  11.278  -3.364  -4.242
   62    HE1  TYR   6           HE1      TYR   6  10.823  -8.226  -3.702
   63    HE2  TYR   6           HE2      TYR   6  13.181  -4.682  -3.445
   64    HH   TYR   6           HH       TYR   6  13.790  -6.695  -2.583
   65    H    GLY   7           H        GLY   7   8.044  -2.032  -6.695
   66   1HA   GLY   7          1HA       GLY   7   5.648  -1.691  -7.231
   67   2HA   GLY   7          2HA       GLY   7   5.536  -0.790  -5.732
   68    H    ASN   8           H        ASN   8   4.868   1.106  -6.783
   69    HA   ASN   8           HA       ASN   8   6.894   2.275  -8.561
   70   1HB   ASN   8          1HB       ASN   8   5.224   3.554  -9.626
   71   2HB   ASN   8          2HB       ASN   8   4.553   1.938  -9.450
   72   1HD2  ASN   8          1HD2      ASN   8   3.319   4.616  -9.760
   73   2HD2  ASN   8          2HD2      ASN   8   2.216   4.733  -8.433
   74    H    ALA   9           H        ALA   9   6.568   2.264  -5.511
   75    HA   ALA   9           HA       ALA   9   6.487   5.112  -4.946
   76   1HB   ALA   9          1HB       ALA   9   7.198   3.278  -2.773
   77   2HB   ALA   9          2HB       ALA   9   5.622   2.987  -3.510
   78   3HB   ALA   9          3HB       ALA   9   5.993   4.571  -2.828
   79    H    ASP  10           H        ASP  10   8.269   6.304  -4.688
   80    HA   ASP  10           HA       ASP  10  10.768   5.224  -5.475
   81   1HB   ASP  10          1HB       ASP  10  10.214   7.960  -4.324
   82   2HB   ASP  10          2HB       ASP  10  11.617   7.476  -5.273
   83    H    GLY  11           H        GLY  11   9.805   6.796  -2.401
   84   1HA   GLY  11          1HA       GLY  11  11.393   4.902  -0.932
   85   2HA   GLY  11          2HA       GLY  11  12.118   6.499  -1.000
   86    H    GLU  12           H        GLU  12   8.741   6.592  -1.073
   87    HA   GLU  12           HA       GLU  12   8.647   7.790   1.530
   88   1HB   GLU  12          1HB       GLU  12   6.651   7.295  -0.655
   89   2HB   GLU  12          2HB       GLU  12   6.087   7.740   0.947
   90   1HG   GLU  12          1HG       GLU  12   6.264   9.671  -0.537
   91   2HG   GLU  12          2HG       GLU  12   7.335   9.803   0.855
   92    H    TYR  13           H        TYR  13   6.941   7.088   3.126
   93    HA   TYR  13           HA       TYR  13   7.032   4.163   3.329
   94   1HB   TYR  13          1HB       TYR  13   6.588   6.086   5.606
   95   2HB   TYR  13          2HB       TYR  13   6.877   4.346   5.712
   96    HD1  TYR  13           HD1      TYR  13   8.520   7.475   4.483
   97    HD2  TYR  13           HD2      TYR  13   9.014   3.589   6.133
   98    HE1  TYR  13           HE1      TYR  13  10.930   7.882   4.699
   99    HE2  TYR  13           HE2      TYR  13  11.425   3.981   6.354
  100    HH   TYR  13           HH       TYR  13  13.078   6.235   4.789
  101    H    CYS  14           H        CYS  14   5.133   3.289   4.764
  102    HA   CYS  14           HA       CYS  14   2.774   3.762   3.292
  103   1HB   CYS  14          1HB       CYS  14   3.156   2.331   5.925
  104   2HB   CYS  14          2HB       CYS  14   1.693   2.274   4.950
  105    H    LYS  15           H        LYS  15   0.949   4.897   3.719
  106    HA   LYS  15           HA       LYS  15   1.002   6.659   6.083
  107   1HB   LYS  15          1HB       LYS  15   1.108   7.648   3.682
  108   2HB   LYS  15          2HB       LYS  15  -0.582   7.193   3.570
  109   1HG   LYS  15          1HG       LYS  15   0.491   8.974   5.742
  110   2HG   LYS  15          2HG       LYS  15  -0.101   9.582   4.198
  111   1HD   LYS  15          1HD       LYS  15  -1.802   7.824   5.948
  112   2HD   LYS  15          2HD       LYS  15  -1.704   9.564   6.211
  113   1HE   LYS  15          1HE       LYS  15  -3.604   9.214   4.849
  114   2HE   LYS  15          2HE       LYS  15  -2.352   9.861   3.790
  115   1HZ   LYS  15          1HZ       LYS  15  -2.419   6.973   3.930
  116   2HZ   LYS  15          2HZ       LYS  15  -2.321   8.000   2.577
  117   3HZ   LYS  15          3HZ       LYS  15  -3.824   7.672   3.282
  118    H    PHE  16           H        PHE  16  -0.156   5.448   7.520
  119    HA   PHE  16           HA       PHE  16  -2.693   4.275   6.649
  120   1HB   PHE  16          1HB       PHE  16  -1.280   4.024   9.309
  121   2HB   PHE  16          2HB       PHE  16  -2.690   3.111   8.795
  122    HD1  PHE  16           HD1      PHE  16  -2.108   2.110   6.209
  123    HD2  PHE  16           HD2      PHE  16   0.545   2.699   9.476
  124    HE1  PHE  16           HE1      PHE  16  -0.643   0.350   5.330
  125    HE2  PHE  16           HE2      PHE  16   2.020   0.942   8.614
  126    HZ   PHE  16           HZ       PHE  16   1.440  -0.269   6.536
  127    HA   PRO  17           HA       PRO  17  -4.447   3.873   6.965
  128   1HB   PRO  17          1HB       PRO  17  -7.047   4.569   6.718
  129   2HB   PRO  17          2HB       PRO  17  -6.382   3.821   8.175
  130   1HG   PRO  17          1HG       PRO  17  -7.306   6.580   7.771
  131   2HG   PRO  17          2HG       PRO  17  -7.022   5.703   9.282
  132   1HD   PRO  17          1HD       PRO  17  -5.302   7.614   7.946
  133   2HD   PRO  17          2HD       PRO  17  -5.089   6.843   9.529
  134    H    PHE  18           H        PHE  18  -5.122   3.534   4.796
  135    HA   PHE  18           HA       PHE  18  -5.091   5.979   3.163
  136   1HB   PHE  18          1HB       PHE  18  -4.089   4.716   1.326
  137   2HB   PHE  18          2HB       PHE  18  -3.063   4.668   2.750
  138    HD1  PHE  18           HD1      PHE  18  -3.204   2.559   4.212
  139    HD2  PHE  18           HD2      PHE  18  -4.697   2.776   0.237
  140    HE1  PHE  18           HE1      PHE  18  -3.115   0.110   4.041
  141    HE2  PHE  18           HE2      PHE  18  -4.617   0.335   0.058
  142    HZ   PHE  18           HZ       PHE  18  -3.821  -1.024   1.969
  143    H    LEU  19           H        LEU  19  -6.399   5.941   1.219
  144    HA   LEU  19           HA       LEU  19  -8.854   4.453   1.700
  145   1HB   LEU  19          1HB       LEU  19  -8.787   6.957   1.362
  146   2HB   LEU  19          2HB       LEU  19  -8.367   6.634  -0.310
  147    HG   LEU  19           HG       LEU  19 -10.499   5.365  -0.543
  148   1HD1  LEU  19          1HD1      LEU  19 -10.552   5.492   2.224
  149   2HD1  LEU  19          2HD1      LEU  19 -11.840   4.926   1.163
  150   3HD1  LEU  19          3HD1      LEU  19 -11.824   6.603   1.703
  151   1HD2  LEU  19          1HD2      LEU  19 -11.954   7.445  -0.427
  152   2HD2  LEU  19          2HD2      LEU  19 -10.509   7.522  -1.436
  153   3HD2  LEU  19          3HD2      LEU  19 -10.517   8.283   0.158
  154    H    PHE  20           H        PHE  20  -9.079   2.574   0.747
  155    HA   PHE  20           HA       PHE  20  -8.096   2.221  -2.014
  156   1HB   PHE  20          1HB       PHE  20  -7.085   0.705  -0.176
  157   2HB   PHE  20          2HB       PHE  20  -8.687   0.003  -0.081
  158    HD1  PHE  20           HD1      PHE  20  -7.441  -2.085  -0.525
  159    HD2  PHE  20           HD2      PHE  20  -7.851   1.011  -3.409
  160    HE1  PHE  20           HE1      PHE  20  -6.933  -3.705  -2.312
  161    HE2  PHE  20           HE2      PHE  20  -7.348  -0.600  -5.203
  162    HZ   PHE  20           HZ       PHE  20  -6.889  -2.958  -4.659
  163    H    ASN  21           H        ASN  21  -9.855   2.597  -3.248
  164    HA   ASN  21           HA       ASN  21 -11.927   2.455  -4.148
  165   1HB   ASN  21          1HB       ASN  21 -11.550  -0.285  -2.978
  166   2HB   ASN  21          2HB       ASN  21 -13.065   0.146  -3.764
  167   1HD2  ASN  21          1HD2      ASN  21 -13.096  -0.689  -5.713
  168   2HD2  ASN  21          2HD2      ASN  21 -11.795  -0.664  -6.856
  169    H    GLY  22           H        GLY  22 -11.702   3.472  -1.325
  170   1HA   GLY  22          1HA       GLY  22 -13.538   4.600  -0.292
  171   2HA   GLY  22          2HA       GLY  22 -14.576   3.267  -0.752
  172    H    LYS  23           H        LYS  23 -11.793   1.917   0.421
  173    HA   LYS  23           HA       LYS  23 -12.898   1.834   3.152
  174   1HB   LYS  23          1HB       LYS  23 -13.078  -0.322   1.820
  175   2HB   LYS  23          2HB       LYS  23 -11.323  -0.384   1.830
  176   1HG   LYS  23          1HG       LYS  23 -11.339  -0.485   4.272
  177   2HG   LYS  23          2HG       LYS  23 -13.102  -0.422   4.265
  178   1HD   LYS  23          1HD       LYS  23 -13.069  -2.503   2.866
  179   2HD   LYS  23          2HD       LYS  23 -11.332  -2.602   3.171
  180   1HE   LYS  23          1HE       LYS  23 -13.546  -2.667   5.225
  181   2HE   LYS  23          2HE       LYS  23 -12.514  -4.012   4.739
  182   1HZ   LYS  23          1HZ       LYS  23 -10.864  -3.329   6.062
  183   2HZ   LYS  23          2HZ       LYS  23 -12.059  -2.417   6.860
  184   3HZ   LYS  23          3HZ       LYS  23 -11.075  -1.691   5.683
  185    H    GLU  24           H        GLU  24 -11.525   2.222   4.823
  186    HA   GLU  24           HA       GLU  24  -8.829   3.110   4.117
  187   1HB   GLU  24          1HB       GLU  24 -10.197   3.359   6.794
  188   2HB   GLU  24          2HB       GLU  24  -8.818   4.270   6.201
  189   1HG   GLU  24          1HG       GLU  24 -10.217   5.405   4.604
  190   2HG   GLU  24          2HG       GLU  24 -11.602   4.423   5.081
  191    H    TYR  25           H        TYR  25  -7.017   2.073   4.701
  192    HA   TYR  25           HA       TYR  25  -7.291  -0.230   6.526
  193   1HB   TYR  25          1HB       TYR  25  -5.389   0.080   4.213
  194   2HB   TYR  25          2HB       TYR  25  -5.372  -1.266   5.336
  195    HD1  TYR  25           HD1      TYR  25  -7.495   0.478   2.863
  196    HD2  TYR  25           HD2      TYR  25  -6.695  -3.161   4.909
  197    HE1  TYR  25           HE1      TYR  25  -9.108  -0.679   1.401
  198    HE2  TYR  25           HE2      TYR  25  -8.305  -4.335   3.444
  199    HH   TYR  25           HH       TYR  25  -9.775  -4.148   1.803
  200    H    ASN  26           H        ASN  26  -6.000  -0.328   8.256
  201    HA   ASN  26           HA       ASN  26  -4.033   1.829   8.574
  202   1HB   ASN  26          1HB       ASN  26  -5.533   0.126  10.555
  203   2HB   ASN  26          2HB       ASN  26  -4.130   1.076  11.030
  204   1HD2  ASN  26          1HD2      ASN  26  -7.447   1.073  10.472
  205   2HD2  ASN  26          2HD2      ASN  26  -7.722   2.773  10.637
  206    H    SER  27           H        SER  27  -3.910  -0.987   7.280
  207    HA   SER  27           HA       SER  27  -1.199  -1.519   8.114
  208   1HB   SER  27          1HB       SER  27  -1.623  -3.934   8.538
  209   2HB   SER  27          2HB       SER  27  -2.434  -2.906   9.721
  210    HG   SER  27           HG       SER  27  -4.356  -3.380   8.849
  211    H    CYS  28           H        CYS  28  -0.254  -3.283   6.699
  212    HA   CYS  28           HA       CYS  28  -0.854  -2.701   3.978
  213   1HB   CYS  28          1HB       CYS  28   0.809  -4.992   5.050
  214   2HB   CYS  28          2HB       CYS  28   0.884  -4.285   3.438
  215    H    THR  29           H        THR  29  -2.187  -3.736   2.576
  216    HA   THR  29           HA       THR  29  -3.425  -6.229   3.506
  217    HB   THR  29           HB       THR  29  -5.001  -4.329   3.551
  218    HG1  THR  29           HG1      THR  29  -6.213  -6.006   3.137
  219   1HG2  THR  29          1HG2      THR  29  -5.120  -4.175   0.593
  220   2HG2  THR  29          2HG2      THR  29  -3.850  -3.265   1.410
  221   3HG2  THR  29          3HG2      THR  29  -5.542  -2.974   1.814
  222    H    ASP  30           H        ASP  30  -4.204  -7.674   1.759
  223    HA   ASP  30           HA       ASP  30  -2.413  -7.524  -0.547
  224   1HB   ASP  30          1HB       ASP  30  -3.794 -10.026  -0.248
  225   2HB   ASP  30          2HB       ASP  30  -2.099  -9.735  -0.499
  226    H    THR  31           H        THR  31  -5.258  -6.504   0.187
  227    HA   THR  31           HA       THR  31  -7.080  -7.683  -1.589
  228    HB   THR  31           HB       THR  31  -6.995  -4.842  -0.574
  229    HG1  THR  31           HG1      THR  31  -7.088  -6.047   1.217
  230   1HG2  THR  31          1HG2      THR  31  -8.834  -6.060  -2.331
  231   2HG2  THR  31          2HG2      THR  31  -8.899  -4.454  -1.601
  232   3HG2  THR  31          3HG2      THR  31  -9.637  -5.832  -0.777
  233    H    GLY  32           H        GLY  32  -7.464  -7.387  -3.733
  234   1HA   GLY  32          1HA       GLY  32  -7.352  -6.346  -5.826
  235   2HA   GLY  32          2HA       GLY  32  -6.234  -5.174  -5.143
  236    H    ARG  33           H        ARG  33  -4.790  -7.572  -3.932
  237    HA   ARG  33           HA       ARG  33  -3.113  -8.111  -6.267
  238   1HB   ARG  33          1HB       ARG  33  -2.564  -8.506  -3.321
  239   2HB   ARG  33          2HB       ARG  33  -1.418  -8.822  -4.613
  240   1HG   ARG  33          1HG       ARG  33  -2.582  -6.136  -3.896
  241   2HG   ARG  33          2HG       ARG  33  -0.965  -6.707  -3.488
  242   1HD   ARG  33          1HD       ARG  33  -2.054  -6.243  -6.264
  243   2HD   ARG  33          2HD       ARG  33  -0.914  -5.207  -5.407
  244    HE   ARG  33           HE       ARG  33  -0.041  -7.953  -5.785
  245   1HH1  ARG  33          1HH1      ARG  33   0.006  -4.666  -6.938
  246   2HH1  ARG  33          2HH1      ARG  33   1.343  -4.922  -8.021
  247   1HH2  ARG  33          1HH2      ARG  33   1.743  -8.300  -7.172
  248   2HH2  ARG  33          2HH2      ARG  33   2.345  -6.984  -8.135
  249    H    SER  34           H        SER  34  -3.441  -9.987  -7.253
  250    HA   SER  34           HA       SER  34  -4.921 -12.096  -5.964
  251   1HB   SER  34          1HB       SER  34  -3.529 -12.154  -8.655
  252   2HB   SER  34          2HB       SER  34  -4.825 -13.217  -8.103
  253    HG   SER  34           HG       SER  34  -4.936 -10.608  -9.058
  254    H    ASP  35           H        ASP  35  -1.716 -11.168  -6.072
  255    HA   ASP  35           HA       ASP  35  -0.568 -13.779  -5.923
  256   1HB   ASP  35          1HB       ASP  35   1.125 -11.613  -5.084
  257   2HB   ASP  35          2HB       ASP  35   1.381 -12.774  -6.358
  258    H    GLY  36           H        GLY  36  -2.060 -11.765  -3.805
  259   1HA   GLY  36          1HA       GLY  36  -2.390 -11.919  -1.528
  260   2HA   GLY  36          2HA       GLY  36  -1.382 -13.360  -1.542
  261    H    PHE  37           H        PHE  37  -0.476 -10.148  -2.666
  262    HA   PHE  37           HA       PHE  37   1.711 -10.158  -0.709
  263   1HB   PHE  37          1HB       PHE  37   1.339  -8.776  -3.361
  264   2HB   PHE  37          2HB       PHE  37   2.601  -8.291  -2.233
  265    HD1  PHE  37           HD1      PHE  37   3.606  -8.957  -4.709
  266    HD2  PHE  37           HD2      PHE  37   2.383 -11.649  -1.643
  267    HE1  PHE  37           HE1      PHE  37   5.118 -10.667  -5.616
  268    HE2  PHE  37           HE2      PHE  37   3.896 -13.368  -2.545
  269    HZ   PHE  37           HZ       PHE  37   5.267 -12.881  -4.536
  270    H    LEU  38           H        LEU  38   1.846  -8.659   0.860
  271    HA   LEU  38           HA       LEU  38  -0.365  -6.874   1.247
  272   1HB   LEU  38          1HB       LEU  38   1.372  -6.240   3.225
  273   2HB   LEU  38          2HB       LEU  38   0.179  -7.516   3.324
  274    HG   LEU  38           HG       LEU  38   2.001  -9.091   2.495
  275   1HD1  LEU  38          1HD1      LEU  38   3.424  -6.974   1.849
  276   2HD1  LEU  38          2HD1      LEU  38   4.187  -8.468   2.390
  277   3HD1  LEU  38          3HD1      LEU  38   3.982  -7.130   3.519
  278   1HD2  LEU  38          1HD2      LEU  38   1.299  -9.180   4.762
  279   2HD2  LEU  38          2HD2      LEU  38   2.199  -7.716   5.166
  280   3HD2  LEU  38          3HD2      LEU  38   3.060  -9.200   4.756
  281    H    TRP  39           H        TRP  39  -0.476  -4.800   0.757
  282    HA   TRP  39           HA       TRP  39   1.998  -3.302   0.257
  283   1HB   TRP  39          1HB       TRP  39   1.055  -2.324  -1.781
  284   2HB   TRP  39          2HB       TRP  39   1.130  -4.072  -1.922
  285    HD1  TRP  39           HD1      TRP  39  -1.200  -5.425  -1.824
  286    HE1  TRP  39           HE1      TRP  39  -3.596  -4.705  -2.379
  287    HE3  TRP  39           HE3      TRP  39  -0.598  -0.355  -1.700
  288    HZ2  TRP  39           HZ2      TRP  39  -5.028  -2.324  -2.738
  289    HZ3  TRP  39           HZ3      TRP  39  -2.539   1.064  -2.168
  290    HH2  TRP  39           HH2      TRP  39  -4.714   0.090  -2.673
  291    H    CYS  40           H        CYS  40   1.349  -0.880  -0.094
  292    HA   CYS  40           HA       CYS  40  -0.970  -0.048   1.463
  293   1HB   CYS  40          1HB       CYS  40   0.312   1.190   3.081
  294   2HB   CYS  40          2HB       CYS  40   0.927  -0.460   3.074
  295    H    SER  41           H        SER  41  -1.089   2.422   1.419
  296    HA   SER  41           HA       SER  41   0.165   3.413  -1.053
  297   1HB   SER  41          1HB       SER  41  -2.351   3.160  -1.140
  298   2HB   SER  41          2HB       SER  41  -2.452   4.400   0.109
  299    HG   SER  41           HG       SER  41  -1.214   4.729  -2.434
  300    H    THR  42           H        THR  42   0.516   5.783  -1.064
  301    HA   THR  42           HA       THR  42   1.280   6.695   1.626
  302    HB   THR  42           HB       THR  42   2.602   7.493  -0.970
  303    HG1  THR  42           HG1      THR  42   3.919   5.794   0.769
  304   1HG2  THR  42          1HG2      THR  42   4.038   7.506   1.611
  305   2HG2  THR  42          2HG2      THR  42   2.846   8.779   1.344
  306   3HG2  THR  42          3HG2      THR  42   4.187   8.578   0.218
  307    H    THR  43           H        THR  43  -0.726   7.295  -0.995
  308    HA   THR  43           HA       THR  43  -0.916  10.157  -0.392
  309    HB   THR  43           HB       THR  43  -2.178  10.297  -2.514
  310    HG1  THR  43           HG1      THR  43  -2.782   8.568  -3.563
  311   1HG2  THR  43          1HG2      THR  43   0.499  10.006  -2.301
  312   2HG2  THR  43          2HG2      THR  43  -0.354  10.367  -3.802
  313   3HG2  THR  43          3HG2      THR  43   0.100   8.705  -3.425
  314    H    TYR  44           H        TYR  44  -3.533  10.565  -1.268
  315    HA   TYR  44           HA       TYR  44  -4.984   9.619   1.047
  316   1HB   TYR  44          1HB       TYR  44  -5.122  11.993   0.303
  317   2HB   TYR  44          2HB       TYR  44  -5.903  11.460  -1.183
  318    HD1  TYR  44           HD1      TYR  44  -8.187  10.249  -0.940
  319    HD2  TYR  44           HD2      TYR  44  -6.380  12.444   2.238
  320    HE1  TYR  44           HE1      TYR  44 -10.365  10.412   0.183
  321    HE2  TYR  44           HE2      TYR  44  -8.560  12.602   3.359
  322    HH   TYR  44           HH       TYR  44 -11.137  10.718   2.657
  323    H    ASN  45           H        ASN  45  -5.925   9.844  -2.396
  324    HA   ASN  45           HA       ASN  45  -7.464   7.370  -2.033
  325   1HB   ASN  45          1HB       ASN  45  -8.596   9.462  -2.920
  326   2HB   ASN  45          2HB       ASN  45  -7.608   9.308  -4.352
  327   1HD2  ASN  45          1HD2      ASN  45  -8.006   6.246  -3.972
  328   2HD2  ASN  45          2HD2      ASN  45  -9.545   6.076  -4.669
  329    H    PHE  46           H        PHE  46  -6.333   5.607  -2.576
  330    HA   PHE  46           HA       PHE  46  -4.016   5.555  -4.137
  331   1HB   PHE  46          1HB       PHE  46  -4.362   3.801  -2.577
  332   2HB   PHE  46          2HB       PHE  46  -5.927   3.372  -3.299
  333    HD1  PHE  46           HD1      PHE  46  -6.020   1.801  -5.075
  334    HD2  PHE  46           HD2      PHE  46  -2.241   3.390  -3.904
  335    HE1  PHE  46           HE1      PHE  46  -4.891   0.163  -6.516
  336    HE2  PHE  46           HE2      PHE  46  -1.116   1.749  -5.341
  337    HZ   PHE  46           HZ       PHE  46  -2.434   0.137  -6.651
  338    H    GLU  47           H        GLU  47  -7.367   5.107  -5.093
  339    HA   GLU  47           HA       GLU  47  -7.009   3.899  -7.562
  340   1HB   GLU  47          1HB       GLU  47  -9.186   4.328  -6.370
  341   2HB   GLU  47          2HB       GLU  47  -9.104   5.979  -6.961
  342   1HG   GLU  47          1HG       GLU  47  -9.117   5.178  -9.255
  343   2HG   GLU  47          2HG       GLU  47  -9.182   3.510  -8.683
  344    H    LYS  48           H        LYS  48  -7.193   7.387  -6.859
  345    HA   LYS  48           HA       LYS  48  -6.726   8.085  -9.583
  346   1HB   LYS  48          1HB       LYS  48  -6.606  10.409  -8.760
  347   2HB   LYS  48          2HB       LYS  48  -8.051   9.562  -8.235
  348   1HG   LYS  48          1HG       LYS  48  -7.197   9.296  -6.031
  349   2HG   LYS  48          2HG       LYS  48  -5.602   9.879  -6.519
  350   1HD   LYS  48          1HD       LYS  48  -8.130  11.530  -6.614
  351   2HD   LYS  48          2HD       LYS  48  -6.972  11.551  -5.279
  352   1HE   LYS  48          1HE       LYS  48  -5.211  12.233  -6.896
  353   2HE   LYS  48          2HE       LYS  48  -6.450  12.344  -8.146
  354   1HZ   LYS  48          1HZ       LYS  48  -5.833  14.479  -6.974
  355   2HZ   LYS  48          2HZ       LYS  48  -6.633  13.863  -5.608
  356   3HZ   LYS  48          3HZ       LYS  48  -7.494  14.118  -7.050
  357    H    ASP  49           H        ASP  49  -4.667   8.132  -6.677
  358    HA   ASP  49           HA       ASP  49  -2.463   9.277  -8.106
  359   1HB   ASP  49          1HB       ASP  49  -2.650   7.982  -5.384
  360   2HB   ASP  49          2HB       ASP  49  -1.184   8.725  -6.015
  361    H    GLY  50           H        GLY  50  -3.048   6.050  -6.731
  362   1HA   GLY  50          1HA       GLY  50  -2.427   4.006  -7.636
  363   2HA   GLY  50          2HA       GLY  50  -1.620   4.867  -8.933
  364    H    LYS  51           H        LYS  51  -0.702   6.045  -5.892
  365    HA   LYS  51           HA       LYS  51   1.911   4.836  -6.218
  366   1HB   LYS  51          1HB       LYS  51   0.982   6.738  -4.078
  367   2HB   LYS  51          2HB       LYS  51   2.644   6.325  -4.468
  368   1HG   LYS  51          1HG       LYS  51   0.756   7.658  -6.366
  369   2HG   LYS  51          2HG       LYS  51   1.886   8.515  -5.323
  370   1HD   LYS  51          1HD       LYS  51   2.610   6.537  -7.481
  371   2HD   LYS  51          2HD       LYS  51   2.746   8.291  -7.600
  372   1HE   LYS  51          1HE       LYS  51   4.348   8.278  -5.735
  373   2HE   LYS  51          2HE       LYS  51   4.245   6.517  -5.672
  374   1HZ   LYS  51          1HZ       LYS  51   5.916   8.074  -7.266
  375   2HZ   LYS  51          2HZ       LYS  51   4.810   7.326  -8.317
  376   3HZ   LYS  51          3HZ       LYS  51   5.758   6.382  -7.273
  377    H    TYR  52           H        TYR  52   2.575   3.088  -5.229
  378    HA   TYR  52           HA       TYR  52   1.642   2.380  -2.592
  379   1HB   TYR  52          1HB       TYR  52   0.675   0.269  -3.212
  380   2HB   TYR  52          2HB       TYR  52  -0.092   1.499  -4.211
  381    HD1  TYR  52           HD1      TYR  52   2.311  -1.288  -4.197
  382    HD2  TYR  52           HD2      TYR  52   0.242   1.539  -6.609
  383    HE1  TYR  52           HE1      TYR  52   2.979  -2.533  -6.203
  384    HE2  TYR  52           HE2      TYR  52   0.898   0.295  -8.627
  385    HH   TYR  52           HH       TYR  52   2.711  -1.273  -9.311
  386    H    GLY  53           H        GLY  53   2.585   0.187  -2.020
  387   1HA   GLY  53          1HA       GLY  53   4.815  -0.817  -3.408
  388   2HA   GLY  53          2HA       GLY  53   5.339   0.216  -2.091
  389    H    PHE  54           H        PHE  54   5.912  -2.515  -2.112
  390    HA   PHE  54           HA       PHE  54   3.934  -3.784  -0.415
  391   1HB   PHE  54          1HB       PHE  54   6.582  -4.843  -1.390
  392   2HB   PHE  54          2HB       PHE  54   5.325  -5.783  -0.593
  393    HD1  PHE  54           HD1      PHE  54   6.204  -3.944  -3.670
  394    HD2  PHE  54           HD2      PHE  54   3.416  -6.543  -1.780
  395    HE1  PHE  54           HE1      PHE  54   5.128  -4.364  -5.844
  396    HE2  PHE  54           HE2      PHE  54   2.339  -6.971  -3.946
  397    HZ   PHE  54           HZ       PHE  54   3.194  -5.880  -5.988
  398    H    CYS  55           H        CYS  55   4.123  -4.062   1.759
  399    HA   CYS  55           HA       CYS  55   6.569  -2.991   3.008
  400   1HB   CYS  55          1HB       CYS  55   4.779  -2.418   4.884
  401   2HB   CYS  55          2HB       CYS  55   5.095  -1.329   3.535
  402    HA   PRO  56           HA       PRO  56   5.909  -7.094   4.985
  403   1HB   PRO  56          1HB       PRO  56   8.006  -8.417   4.026
  404   2HB   PRO  56          2HB       PRO  56   6.557  -8.195   3.042
  405   1HG   PRO  56          1HG       PRO  56   9.199  -6.861   2.828
  406   2HG   PRO  56          2HG       PRO  56   8.011  -7.205   1.562
  407   1HD   PRO  56          1HD       PRO  56   8.410  -4.743   2.954
  408   2HD   PRO  56          2HD       PRO  56   7.149  -5.119   1.763
  409    H    HIS  57           H        HIS  57   7.495  -8.304   6.446
  410    HA   HIS  57           HA       HIS  57   8.935  -6.344   8.009
  411   1HB   HIS  57          1HB       HIS  57   7.611  -8.173   9.074
  412   2HB   HIS  57          2HB       HIS  57   8.740  -9.344   8.401
  413    HD1  HIS  57           HD1      HIS  57  11.340  -8.951   9.255
  414    HD2  HIS  57           HD2      HIS  57   8.276  -7.323  11.556
  415    HE1  HIS  57           HE1      HIS  57  12.365  -8.466  11.497
  416    H    GLU  58           H        GLU  58   9.799  -9.435   6.475
  417    HA   GLU  58           HA       GLU  58  12.346  -8.303   5.681
  418   1HB   GLU  58          1HB       GLU  58  13.423 -10.490   6.435
  419   2HB   GLU  58          2HB       GLU  58  13.049  -9.303   7.668
  420   1HG   GLU  58          1HG       GLU  58  10.966 -10.587   8.149
  421   2HG   GLU  58          2HG       GLU  58  11.540 -11.825   7.036
  422    H    ALA  59           H        ALA  59  13.116  -9.094   3.773
  423    HA   ALA  59           HA       ALA  59  11.324 -10.938   2.363
  424   1HB   ALA  59          1HB       ALA  59  11.569  -9.690   0.534
  425   2HB   ALA  59          2HB       ALA  59  13.320  -9.607   0.723
  426   3HB   ALA  59          3HB       ALA  59  12.288  -8.477   1.599
  Start of MODEL   30
    1   1H    ARG   1          1H        ARG   1   9.164   4.796  11.735
    2   2H    ARG   1          2H        ARG   1   9.812   3.721  10.552
    3   3H    ARG   1          3H        ARG   1   9.284   3.116  12.073
    4    HA   ARG   1           HA       ARG   1   7.059   3.666  11.586
    5   1HB   ARG   1          1HB       ARG   1   8.055   5.609  10.074
    6   2HB   ARG   1          2HB       ARG   1   7.818   4.430   8.799
    7   1HG   ARG   1          1HG       ARG   1   5.639   5.339  10.663
    8   2HG   ARG   1          2HG       ARG   1   5.968   6.075   9.097
    9   1HD   ARG   1          1HD       ARG   1   5.622   3.799   8.072
   10   2HD   ARG   1          2HD       ARG   1   5.069   3.245   9.657
   11    HE   ARG   1           HE       ARG   1   3.573   4.755   7.756
   12   1HH1  ARG   1          1HH1      ARG   1   3.998   4.168  11.181
   13   2HH1  ARG   1          2HH1      ARG   1   2.476   4.873  11.632
   14   1HH2  ARG   1          1HH2      ARG   1   1.539   5.653   8.337
   15   2HH2  ARG   1          2HH2      ARG   1   1.069   5.713  10.006
   16    H    ILE   2           H        ILE   2   7.833   3.090   8.294
   17    HA   ILE   2           HA       ILE   2   8.429   0.333   8.438
   18    HB   ILE   2           HB       ILE   2   5.897   0.480   9.051
   19   1HG1  ILE   2          1HG1      ILE   2   6.834  -1.329   6.814
   20   2HG1  ILE   2          2HG1      ILE   2   7.075  -1.606   8.535
   21   1HG2  ILE   2          1HG2      ILE   2   5.803   0.942   6.085
   22   2HG2  ILE   2          2HG2      ILE   2   5.140   1.981   7.354
   23   3HG2  ILE   2          3HG2      ILE   2   4.424   0.397   7.043
   24   1HD1  ILE   2          1HD1      ILE   2   4.430  -1.524   7.107
   25   2HD1  ILE   2          2HD1      ILE   2   4.649  -1.760   8.840
   26   3HD1  ILE   2          3HD1      ILE   2   5.263  -2.961   7.706
   27    HA   PRO   3           HA       PRO   3   9.744   1.828   4.493
   28   1HB   PRO   3          1HB       PRO   3  11.016  -0.325   3.592
   29   2HB   PRO   3          2HB       PRO   3  11.603   0.564   5.005
   30   1HG   PRO   3          1HG       PRO   3   9.952  -1.939   4.898
   31   2HG   PRO   3          2HG       PRO   3  11.397  -1.601   5.876
   32   1HD   PRO   3          1HD       PRO   3   8.848  -1.388   6.848
   33   2HD   PRO   3          2HD       PRO   3  10.195  -0.389   7.440
   34    H    VAL   4           H        VAL   4   9.249   1.871   2.385
   35    HA   VAL   4           HA       VAL   4   7.237  -0.048   1.380
   36    HB   VAL   4           HB       VAL   4   7.805   2.828   0.521
   37   1HG1  VAL   4          1HG1      VAL   4   6.126   2.521  -1.192
   38   2HG1  VAL   4          2HG1      VAL   4   5.899   0.839  -0.714
   39   3HG1  VAL   4          3HG1      VAL   4   7.433   1.359  -1.418
   40   1HG2  VAL   4          1HG2      VAL   4   5.060   1.952   1.099
   41   2HG2  VAL   4          2HG2      VAL   4   5.903   3.433   1.561
   42   3HG2  VAL   4          3HG2      VAL   4   6.146   1.950   2.488
   43    H    LYS   5           H        LYS   5   7.938  -1.417  -0.048
   44    HA   LYS   5           HA       LYS   5  10.615  -1.105  -1.088
   45   1HB   LYS   5          1HB       LYS   5   8.666  -3.353  -0.887
   46   2HB   LYS   5          2HB       LYS   5  10.005  -3.476  -2.014
   47   1HG   LYS   5          1HG       LYS   5  10.219  -3.072   0.958
   48   2HG   LYS   5          2HG       LYS   5  10.487  -4.584   0.080
   49   1HD   LYS   5          1HD       LYS   5  12.422  -3.719  -1.008
   50   2HD   LYS   5          2HD       LYS   5  12.106  -2.086  -0.410
   51   1HE   LYS   5          1HE       LYS   5  12.413  -2.967   1.917
   52   2HE   LYS   5          2HE       LYS   5  12.871  -4.516   1.210
   53   1HZ   LYS   5          1HZ       LYS   5  14.863  -3.417   1.663
   54   2HZ   LYS   5          2HZ       LYS   5  14.302  -1.929   1.061
   55   3HZ   LYS   5          3HZ       LYS   5  14.645  -3.203  -0.013
   56    H    TYR   6           H        TYR   6   9.152  -3.150  -3.079
   57    HA   TYR   6           HA       TYR   6   9.617  -1.680  -5.405
   58   1HB   TYR   6          1HB       TYR   6   7.898  -4.151  -5.177
   59   2HB   TYR   6          2HB       TYR   6   8.891  -3.640  -6.545
   60    HD1  TYR   6           HD1      TYR   6   8.943  -6.342  -4.977
   61    HD2  TYR   6           HD2      TYR   6  11.330  -2.819  -4.766
   62    HE1  TYR   6           HE1      TYR   6  10.815  -7.662  -4.098
   63    HE2  TYR   6           HE2      TYR   6  13.198  -4.133  -3.889
   64    HH   TYR   6           HH       TYR   6  13.663  -7.113  -4.193
   65    H    GLY   7           H        GLY   7   8.141  -1.210  -7.124
   66   1HA   GLY   7          1HA       GLY   7   5.726  -1.021  -7.715
   67   2HA   GLY   7          2HA       GLY   7   5.522  -0.250  -6.154
   68    H    ASN   8           H        ASN   8   4.728   1.628  -7.216
   69    HA   ASN   8           HA       ASN   8   6.754   3.111  -8.752
   70   1HB   ASN   8          1HB       ASN   8   5.005   4.340  -9.802
   71   2HB   ASN   8          2HB       ASN   8   4.541   2.645  -9.854
   72   1HD2  ASN   8          1HD2      ASN   8   2.951   5.109  -9.998
   73   2HD2  ASN   8          2HD2      ASN   8   1.789   4.967  -8.728
   74    H    ALA   9           H        ALA   9   6.126   2.864  -5.726
   75    HA   ALA   9           HA       ALA   9   5.615   5.577  -4.926
   76   1HB   ALA   9          1HB       ALA   9   6.682   3.618  -3.011
   77   2HB   ALA   9          2HB       ALA   9   5.104   3.282  -3.724
   78   3HB   ALA   9          3HB       ALA   9   5.369   4.784  -2.837
   79    H    ASP  10           H        ASP  10   7.114   6.798  -3.621
   80    HA   ASP  10           HA       ASP  10   9.748   6.771  -4.789
   81   1HB   ASP  10          1HB       ASP  10   8.611   8.571  -2.638
   82   2HB   ASP  10          2HB       ASP  10  10.081   8.853  -3.565
   83    H    GLY  11           H        GLY  11   8.722   4.704  -2.729
   84   1HA   GLY  11          1HA       GLY  11   9.757   3.345  -1.185
   85   2HA   GLY  11          2HA       GLY  11  11.237   4.244  -1.480
   86    H    GLU  12           H        GLU  12   8.215   5.640  -0.341
   87    HA   GLU  12           HA       GLU  12   9.591   6.703   1.968
   88   1HB   GLU  12          1HB       GLU  12   6.736   7.108   1.065
   89   2HB   GLU  12          2HB       GLU  12   7.564   8.017   2.318
   90   1HG   GLU  12          1HG       GLU  12   8.484   7.951  -0.534
   91   2HG   GLU  12          2HG       GLU  12   7.370   9.158   0.106
   92    H    TYR  13           H        TYR  13   6.719   6.737   3.177
   93    HA   TYR  13           HA       TYR  13   6.969   4.214   4.622
   94   1HB   TYR  13          1HB       TYR  13   6.041   5.323   6.490
   95   2HB   TYR  13          2HB       TYR  13   7.300   6.372   5.865
   96    HD1  TYR  13           HD1      TYR  13   6.342   8.044   3.972
   97    HD2  TYR  13           HD2      TYR  13   4.109   6.324   7.143
   98    HE1  TYR  13           HE1      TYR  13   4.710   9.886   3.804
   99    HE2  TYR  13           HE2      TYR  13   2.457   8.157   6.995
  100    HH   TYR  13           HH       TYR  13   2.763  10.829   5.969
  101    H    CYS  14           H        CYS  14   4.929   3.270   5.403
  102    HA   CYS  14           HA       CYS  14   2.915   3.309   3.353
  103   1HB   CYS  14          1HB       CYS  14   3.096   1.840   5.987
  104   2HB   CYS  14          2HB       CYS  14   1.710   1.712   4.911
  105    H    LYS  15           H        LYS  15   1.245   4.677   3.313
  106    HA   LYS  15           HA       LYS  15   0.840   6.431   5.577
  107   1HB   LYS  15          1HB       LYS  15   0.883   7.145   3.116
  108   2HB   LYS  15          2HB       LYS  15  -0.743   6.478   3.013
  109   1HG   LYS  15          1HG       LYS  15  -1.536   8.023   4.661
  110   2HG   LYS  15          2HG       LYS  15   0.100   8.604   4.970
  111   1HD   LYS  15          1HD       LYS  15   0.212   9.367   2.604
  112   2HD   LYS  15          2HD       LYS  15  -1.487   8.918   2.428
  113   1HE   LYS  15          1HE       LYS  15  -1.174  11.319   2.888
  114   2HE   LYS  15          2HE       LYS  15  -2.133  10.504   4.124
  115   1HZ   LYS  15          1HZ       LYS  15  -0.537  10.799   5.686
  116   2HZ   LYS  15          2HZ       LYS  15  -0.123  12.121   4.696
  117   3HZ   LYS  15          3HZ       LYS  15   0.751  10.675   4.582
  118    H    PHE  16           H        PHE  16  -0.537   6.017   7.141
  119    HA   PHE  16           HA       PHE  16  -2.909   4.388   6.514
  120   1HB   PHE  16          1HB       PHE  16  -1.369   4.422   9.118
  121   2HB   PHE  16          2HB       PHE  16  -2.830   3.501   8.804
  122    HD1  PHE  16           HD1      PHE  16  -2.397   2.279   6.255
  123    HD2  PHE  16           HD2      PHE  16   0.372   2.976   9.403
  124    HE1  PHE  16           HE1      PHE  16  -1.062   0.374   5.487
  125    HE2  PHE  16           HE2      PHE  16   1.729   1.078   8.649
  126    HZ   PHE  16           HZ       PHE  16   1.026  -0.256   6.675
  127    HA   PRO  17           HA       PRO  17  -4.653   4.053   6.828
  128   1HB   PRO  17          1HB       PRO  17  -7.236   4.957   6.416
  129   2HB   PRO  17          2HB       PRO  17  -6.687   4.064   7.838
  130   1HG   PRO  17          1HG       PRO  17  -7.551   6.802   7.696
  131   2HG   PRO  17          2HG       PRO  17  -7.011   5.896   9.118
  132   1HD   PRO  17          1HD       PRO  17  -5.533   7.832   7.456
  133   2HD   PRO  17          2HD       PRO  17  -5.211   7.286   9.114
  134    H    PHE  18           H        PHE  18  -5.120   3.563   4.651
  135    HA   PHE  18           HA       PHE  18  -5.058   5.909   2.879
  136   1HB   PHE  18          1HB       PHE  18  -3.947   4.597   1.176
  137   2HB   PHE  18          2HB       PHE  18  -3.032   4.511   2.669
  138    HD1  PHE  18           HD1      PHE  18  -3.154   2.397   4.046
  139    HD2  PHE  18           HD2      PHE  18  -4.726   2.675   0.104
  140    HE1  PHE  18           HE1      PHE  18  -3.114  -0.053   3.862
  141    HE2  PHE  18           HE2      PHE  18  -4.693   0.228  -0.091
  142    HZ   PHE  18           HZ       PHE  18  -3.885  -1.158   1.783
  143    H    LEU  19           H        LEU  19  -6.421   6.002   1.135
  144    HA   LEU  19           HA       LEU  19  -8.877   4.507   1.470
  145   1HB   LEU  19          1HB       LEU  19  -8.720   7.007   1.101
  146   2HB   LEU  19          2HB       LEU  19  -8.273   6.649  -0.557
  147    HG   LEU  19           HG       LEU  19 -10.455   5.439  -0.815
  148   1HD1  LEU  19          1HD1      LEU  19 -10.900   6.592   1.929
  149   2HD1  LEU  19          2HD1      LEU  19 -11.032   4.908   1.419
  150   3HD1  LEU  19          3HD1      LEU  19 -12.215   6.093   0.867
  151   1HD2  LEU  19          1HD2      LEU  19 -11.455   7.339  -1.514
  152   2HD2  LEU  19          2HD2      LEU  19  -9.874   8.033  -1.162
  153   3HD2  LEU  19          3HD2      LEU  19 -11.178   8.180   0.015
  154    H    PHE  20           H        PHE  20  -9.050   2.601   0.556
  155    HA   PHE  20           HA       PHE  20  -7.994   2.185  -2.172
  156   1HB   PHE  20          1HB       PHE  20  -7.118   0.691  -0.282
  157   2HB   PHE  20          2HB       PHE  20  -8.752   0.058  -0.177
  158    HD1  PHE  20           HD1      PHE  20  -7.277  -2.019  -0.471
  159    HD2  PHE  20           HD2      PHE  20  -8.121   0.784  -3.553
  160    HE1  PHE  20           HE1      PHE  20  -6.791  -3.752  -2.147
  161    HE2  PHE  20           HE2      PHE  20  -7.631  -0.944  -5.243
  162    HZ   PHE  20           HZ       PHE  20  -6.969  -3.204  -4.551
  163    H    ASN  21           H        ASN  21  -9.705   2.730  -3.422
  164    HA   ASN  21           HA       ASN  21 -11.761   2.730  -4.389
  165   1HB   ASN  21          1HB       ASN  21 -11.577  -0.078  -3.331
  166   2HB   ASN  21          2HB       ASN  21 -13.012   0.478  -4.187
  167   1HD2  ASN  21          1HD2      ASN  21 -13.003  -0.109  -6.210
  168   2HD2  ASN  21          2HD2      ASN  21 -11.623  -0.206  -7.248
  169    H    GLY  22           H        GLY  22 -11.586   3.625  -1.532
  170   1HA   GLY  22          1HA       GLY  22 -13.409   4.765  -0.483
  171   2HA   GLY  22          2HA       GLY  22 -14.471   3.474  -1.007
  172    H    LYS  23           H        LYS  23 -11.631   2.148   0.200
  173    HA   LYS  23           HA       LYS  23 -12.815   1.880   2.886
  174   1HB   LYS  23          1HB       LYS  23 -12.840  -0.160   1.243
  175   2HB   LYS  23          2HB       LYS  23 -11.125  -0.258   1.611
  176   1HG   LYS  23          1HG       LYS  23 -11.643  -0.543   3.983
  177   2HG   LYS  23          2HG       LYS  23 -13.373  -0.464   3.615
  178   1HD   LYS  23          1HD       LYS  23 -12.980  -2.420   2.042
  179   2HD   LYS  23          2HD       LYS  23 -11.382  -2.569   2.773
  180   1HE   LYS  23          1HE       LYS  23 -14.026  -2.752   4.211
  181   2HE   LYS  23          2HE       LYS  23 -12.967  -4.102   3.809
  182   1HZ   LYS  23          1HZ       LYS  23 -11.733  -3.729   5.602
  183   2HZ   LYS  23          2HZ       LYS  23 -12.951  -2.664   6.133
  184   3HZ   LYS  23          3HZ       LYS  23 -11.603  -2.063   5.290
  185    H    GLU  24           H        GLU  24 -11.497   2.578   4.483
  186    HA   GLU  24           HA       GLU  24  -8.758   3.290   3.805
  187   1HB   GLU  24          1HB       GLU  24 -10.396   3.842   6.282
  188   2HB   GLU  24          2HB       GLU  24  -8.775   4.456   5.992
  189   1HG   GLU  24          1HG       GLU  24  -9.568   5.726   4.099
  190   2HG   GLU  24          2HG       GLU  24 -11.185   5.048   4.289
  191    H    TYR  25           H        TYR  25  -7.028   2.166   4.369
  192    HA   TYR  25           HA       TYR  25  -7.364   0.003   6.339
  193   1HB   TYR  25          1HB       TYR  25  -5.419   0.232   4.059
  194   2HB   TYR  25          2HB       TYR  25  -5.384  -1.064   5.234
  195    HD1  TYR  25           HD1      TYR  25  -7.498   0.533   2.680
  196    HD2  TYR  25           HD2      TYR  25  -6.681  -3.005   4.888
  197    HE1  TYR  25           HE1      TYR  25  -9.084  -0.699   1.245
  198    HE2  TYR  25           HE2      TYR  25  -8.260  -4.258   3.448
  199    HH   TYR  25           HH       TYR  25  -9.506  -3.021   0.554
  200    H    ASN  26           H        ASN  26  -6.205  -0.002   8.125
  201    HA   ASN  26           HA       ASN  26  -4.146   2.071   8.441
  202   1HB   ASN  26          1HB       ASN  26  -5.845   0.576  10.431
  203   2HB   ASN  26          2HB       ASN  26  -4.375   1.407  10.930
  204   1HD2  ASN  26          1HD2      ASN  26  -7.637   1.734  10.591
  205   2HD2  ASN  26          2HD2      ASN  26  -7.736   3.458  10.521
  206    H    SER  27           H        SER  27  -4.224  -0.833   7.332
  207    HA   SER  27           HA       SER  27  -1.566  -1.530   8.252
  208   1HB   SER  27          1HB       SER  27  -2.380  -3.967   8.510
  209   2HB   SER  27          2HB       SER  27  -2.746  -2.845   9.821
  210    HG   SER  27           HG       SER  27  -4.786  -3.165   9.459
  211    H    CYS  28           H        CYS  28  -0.638  -3.298   6.857
  212    HA   CYS  28           HA       CYS  28  -1.176  -2.731   4.114
  213   1HB   CYS  28          1HB       CYS  28   0.463  -4.995   5.264
  214   2HB   CYS  28          2HB       CYS  28   0.538  -4.371   3.623
  215    H    THR  29           H        THR  29  -2.487  -3.750   2.704
  216    HA   THR  29           HA       THR  29  -3.772  -6.222   3.605
  217    HB   THR  29           HB       THR  29  -5.304  -4.288   3.502
  218    HG1  THR  29           HG1      THR  29  -5.964  -6.502   2.882
  219   1HG2  THR  29          1HG2      THR  29  -4.469  -4.165   0.619
  220   2HG2  THR  29          2HG2      THR  29  -4.513  -2.867   1.812
  221   3HG2  THR  29          3HG2      THR  29  -6.017  -3.533   1.178
  222    H    ASP  30           H        ASP  30  -4.422  -7.733   1.902
  223    HA   ASP  30           HA       ASP  30  -2.517  -7.684  -0.323
  224   1HB   ASP  30          1HB       ASP  30  -3.969 -10.154   0.040
  225   2HB   ASP  30          2HB       ASP  30  -2.265  -9.899  -0.191
  226    H    THR  31           H        THR  31  -5.369  -6.592   0.237
  227    HA   THR  31           HA       THR  31  -7.101  -7.784  -1.651
  228    HB   THR  31           HB       THR  31  -7.097  -4.981  -0.519
  229    HG1  THR  31           HG1      THR  31  -7.338  -6.112   1.251
  230   1HG2  THR  31          1HG2      THR  31  -9.709  -6.099  -0.881
  231   2HG2  THR  31          2HG2      THR  31  -8.838  -6.057  -2.415
  232   3HG2  THR  31          3HG2      THR  31  -9.044  -4.578  -1.477
  233    H    GLY  32           H        GLY  32  -7.518  -7.261  -3.779
  234   1HA   GLY  32          1HA       GLY  32  -7.298  -6.081  -5.780
  235   2HA   GLY  32          2HA       GLY  32  -6.110  -5.044  -5.013
  236    H    ARG  33           H        ARG  33  -4.867  -7.682  -4.004
  237    HA   ARG  33           HA       ARG  33  -3.131  -8.042  -6.322
  238   1HB   ARG  33          1HB       ARG  33  -2.820  -9.106  -3.505
  239   2HB   ARG  33          2HB       ARG  33  -1.594  -9.102  -4.763
  240   1HG   ARG  33          1HG       ARG  33  -2.794  -6.646  -3.508
  241   2HG   ARG  33          2HG       ARG  33  -1.232  -7.352  -3.082
  242   1HD   ARG  33          1HD       ARG  33  -2.014  -6.259  -5.791
  243   2HD   ARG  33          2HD       ARG  33  -0.988  -5.444  -4.610
  244    HE   ARG  33           HE       ARG  33   0.088  -7.988  -5.194
  245   1HH1  ARG  33          1HH1      ARG  33  -0.275  -4.777  -6.546
  246   2HH1  ARG  33          2HH1      ARG  33   1.002  -4.986  -7.704
  247   1HH2  ARG  33          1HH2      ARG  33   1.840  -8.216  -6.624
  248   2HH2  ARG  33          2HH2      ARG  33   2.251  -6.928  -7.716
  249    H    SER  34           H        SER  34  -2.207 -10.495  -6.219
  250    HA   SER  34           HA       SER  34  -4.523 -12.299  -6.133
  251   1HB   SER  34          1HB       SER  34  -2.452 -12.269  -8.342
  252   2HB   SER  34          2HB       SER  34  -3.873 -13.310  -8.246
  253    HG   SER  34           HG       SER  34  -5.125 -11.704  -8.871
  254    H    ASP  35           H        ASP  35  -1.233 -11.722  -5.410
  255    HA   ASP  35           HA       ASP  35  -0.788 -14.536  -4.854
  256   1HB   ASP  35          1HB       ASP  35   1.013 -12.299  -5.476
  257   2HB   ASP  35          2HB       ASP  35   1.631 -13.643  -4.548
  258    H    GLY  36           H        GLY  36  -2.209 -12.413  -3.174
  259   1HA   GLY  36          1HA       GLY  36  -2.453 -12.010  -0.927
  260   2HA   GLY  36          2HA       GLY  36  -1.456 -13.431  -0.674
  261    H    PHE  37           H        PHE  37  -0.310 -10.547  -2.364
  262    HA   PHE  37           HA       PHE  37   1.753 -10.276  -0.323
  263   1HB   PHE  37          1HB       PHE  37   1.388  -9.126  -3.079
  264   2HB   PHE  37          2HB       PHE  37   2.585  -8.464  -1.973
  265    HD1  PHE  37           HD1      PHE  37   3.838  -9.194  -4.240
  266    HD2  PHE  37           HD2      PHE  37   2.410 -11.847  -1.232
  267    HE1  PHE  37           HE1      PHE  37   5.476 -10.882  -4.958
  268    HE2  PHE  37           HE2      PHE  37   4.042 -13.542  -1.951
  269    HZ   PHE  37           HZ       PHE  37   5.580 -13.060  -3.812
  270    H    LEU  38           H        LEU  38   1.610  -8.833   1.279
  271    HA   LEU  38           HA       LEU  38  -0.581  -7.004   1.359
  272   1HB   LEU  38          1HB       LEU  38   0.258  -6.464   3.575
  273   2HB   LEU  38          2HB       LEU  38   0.079  -8.183   3.364
  274    HG   LEU  38           HG       LEU  38   2.746  -6.791   3.113
  275   1HD1  LEU  38          1HD1      LEU  38   1.176  -7.485   5.505
  276   2HD1  LEU  38          2HD1      LEU  38   2.478  -6.310   5.297
  277   3HD1  LEU  38          3HD1      LEU  38   2.858  -8.018   5.512
  278   1HD2  LEU  38          1HD2      LEU  38   1.816  -9.627   3.269
  279   2HD2  LEU  38          2HD2      LEU  38   3.385  -9.194   3.951
  280   3HD2  LEU  38          3HD2      LEU  38   3.055  -8.901   2.243
  281    H    TRP  39           H        TRP  39  -0.587  -4.938   0.859
  282    HA   TRP  39           HA       TRP  39   1.986  -3.568   0.483
  283   1HB   TRP  39          1HB       TRP  39   1.130  -2.566  -1.612
  284   2HB   TRP  39          2HB       TRP  39   1.206  -4.318  -1.719
  285    HD1  TRP  39           HD1      TRP  39  -1.172  -5.645  -1.734
  286    HE1  TRP  39           HE1      TRP  39  -3.534  -4.867  -2.354
  287    HE3  TRP  39           HE3      TRP  39  -0.455  -0.579  -1.570
  288    HZ2  TRP  39           HZ2      TRP  39  -4.910  -2.436  -2.730
  289    HZ3  TRP  39           HZ3      TRP  39  -2.355   0.892  -2.074
  290    HH2  TRP  39           HH2      TRP  39  -4.534  -0.026  -2.640
  291    H    CYS  40           H        CYS  40   1.497  -1.146  -0.028
  292    HA   CYS  40           HA       CYS  40  -0.795  -0.037   1.389
  293   1HB   CYS  40          1HB       CYS  40   0.604   1.304   2.885
  294   2HB   CYS  40          2HB       CYS  40   0.918  -0.410   3.149
  295    H    SER  41           H        SER  41  -0.674   2.458   1.123
  296    HA   SER  41           HA       SER  41   0.676   3.023  -1.427
  297   1HB   SER  41          1HB       SER  41  -1.052   4.755  -1.822
  298   2HB   SER  41          2HB       SER  41  -1.743   3.140  -1.666
  299    HG   SER  41           HG       SER  41  -2.126   5.356  -0.122
  300    H    THR  42           H        THR  42   1.324   5.312  -1.741
  301    HA   THR  42           HA       THR  42   2.613   6.275   0.698
  302    HB   THR  42           HB       THR  42   3.025   7.355  -2.091
  303    HG1  THR  42           HG1      THR  42   3.844   4.923  -0.992
  304   1HG2  THR  42          1HG2      THR  42   5.457   7.258  -0.937
  305   2HG2  THR  42          2HG2      THR  42   4.446   7.548   0.478
  306   3HG2  THR  42          3HG2      THR  42   4.394   8.664  -0.886
  307    H    THR  43           H        THR  43   0.112   6.991  -1.524
  308    HA   THR  43           HA       THR  43  -0.315   9.663  -0.373
  309    HB   THR  43           HB       THR  43  -1.869   9.944  -2.327
  310    HG1  THR  43           HG1      THR  43  -2.310   8.289  -3.508
  311   1HG2  THR  43          1HG2      THR  43   0.460  10.739  -2.495
  312   2HG2  THR  43          2HG2      THR  43  -0.222  10.237  -4.043
  313   3HG2  THR  43          3HG2      THR  43   0.911   9.184  -3.193
  314    H    TYR  44           H        TYR  44  -2.688  10.211  -0.057
  315    HA   TYR  44           HA       TYR  44  -3.874   8.215   1.604
  316   1HB   TYR  44          1HB       TYR  44  -4.240  10.504   2.231
  317   2HB   TYR  44          2HB       TYR  44  -4.893  10.901   0.640
  318    HD1  TYR  44           HD1      TYR  44  -5.610   8.372   3.344
  319    HD2  TYR  44           HD2      TYR  44  -7.181  11.226   0.600
  320    HE1  TYR  44           HE1      TYR  44  -7.886   7.879   4.136
  321    HE2  TYR  44           HE2      TYR  44  -9.454  10.740   1.391
  322    HH   TYR  44           HH       TYR  44 -10.039   8.428   4.022
  323    H    ASN  45           H        ASN  45  -4.794   9.652  -1.524
  324    HA   ASN  45           HA       ASN  45  -6.864   7.640  -1.855
  325   1HB   ASN  45          1HB       ASN  45  -7.130  10.092  -2.485
  326   2HB   ASN  45          2HB       ASN  45  -6.049   9.779  -3.823
  327   1HD2  ASN  45          1HD2      ASN  45  -7.365   7.006  -4.022
  328   2HD2  ASN  45          2HD2      ASN  45  -8.808   7.412  -4.826
  329    H    PHE  46           H        PHE  46  -6.060   5.677  -2.424
  330    HA   PHE  46           HA       PHE  46  -3.713   5.417  -4.070
  331   1HB   PHE  46          1HB       PHE  46  -4.012   3.740  -2.391
  332   2HB   PHE  46          2HB       PHE  46  -5.656   3.378  -2.962
  333    HD1  PHE  46           HD1      PHE  46  -2.131   3.479  -4.293
  334    HD2  PHE  46           HD2      PHE  46  -5.910   1.512  -4.285
  335    HE1  PHE  46           HE1      PHE  46  -1.252   1.762  -5.818
  336    HE2  PHE  46           HE2      PHE  46  -5.035  -0.201  -5.801
  337    HZ   PHE  46           HZ       PHE  46  -2.696  -0.078  -6.573
  338    H    GLU  47           H        GLU  47  -7.172   4.929  -4.505
  339    HA   GLU  47           HA       GLU  47  -7.178   3.705  -6.983
  340   1HB   GLU  47          1HB       GLU  47  -9.113   4.297  -5.345
  341   2HB   GLU  47          2HB       GLU  47  -9.230   5.774  -6.288
  342   1HG   GLU  47          1HG       GLU  47  -9.484   4.372  -8.330
  343   2HG   GLU  47          2HG       GLU  47  -9.555   2.956  -7.281
  344    H    LYS  48           H        LYS  48  -7.040   7.168  -6.244
  345    HA   LYS  48           HA       LYS  48  -7.048   7.828  -9.046
  346   1HB   LYS  48          1HB       LYS  48  -8.309   9.312  -7.753
  347   2HB   LYS  48          2HB       LYS  48  -7.096   9.408  -6.494
  348   1HG   LYS  48          1HG       LYS  48  -5.686  10.801  -7.934
  349   2HG   LYS  48          2HG       LYS  48  -6.883  10.688  -9.232
  350   1HD   LYS  48          1HD       LYS  48  -7.346  11.878  -6.499
  351   2HD   LYS  48          2HD       LYS  48  -7.101  12.784  -7.995
  352   1HE   LYS  48          1HE       LYS  48  -9.128  11.813  -8.940
  353   2HE   LYS  48          2HE       LYS  48  -9.355  10.843  -7.486
  354   1HZ   LYS  48          1HZ       LYS  48  -9.657  12.847  -6.201
  355   2HZ   LYS  48          2HZ       LYS  48 -10.752  12.831  -7.500
  356   3HZ   LYS  48          3HZ       LYS  48  -9.375  13.814  -7.575
  357    H    ASP  49           H        ASP  49  -4.736   8.419  -6.346
  358    HA   ASP  49           HA       ASP  49  -2.732   9.462  -8.051
  359   1HB   ASP  49          1HB       ASP  49  -2.576   8.343  -5.248
  360   2HB   ASP  49          2HB       ASP  49  -1.204   9.082  -6.070
  361    H    GLY  50           H        GLY  50  -3.157   6.261  -6.598
  362   1HA   GLY  50          1HA       GLY  50  -2.551   4.207  -7.481
  363   2HA   GLY  50          2HA       GLY  50  -1.831   5.046  -8.841
  364    H    LYS  51           H        LYS  51  -0.630   6.317  -5.959
  365    HA   LYS  51           HA       LYS  51   1.934   5.097  -6.414
  366   1HB   LYS  51          1HB       LYS  51   0.878   7.223  -4.596
  367   2HB   LYS  51          2HB       LYS  51   2.424   6.488  -4.226
  368   1HG   LYS  51          1HG       LYS  51   2.604   8.596  -5.477
  369   2HG   LYS  51          2HG       LYS  51   3.339   7.225  -6.308
  370   1HD   LYS  51          1HD       LYS  51   1.369   7.048  -7.746
  371   2HD   LYS  51          2HD       LYS  51   0.636   8.419  -6.908
  372   1HE   LYS  51          1HE       LYS  51   2.325   9.905  -7.687
  373   2HE   LYS  51          2HE       LYS  51   3.295   8.568  -8.308
  374   1HZ   LYS  51          1HZ       LYS  51   2.256   9.468 -10.163
  375   2HZ   LYS  51          2HZ       LYS  51   0.763   9.649  -9.376
  376   3HZ   LYS  51          3HZ       LYS  51   1.311   8.103  -9.803
  377    H    TYR  52           H        TYR  52   2.301   3.077  -5.704
  378    HA   TYR  52           HA       TYR  52   1.553   2.434  -2.949
  379   1HB   TYR  52          1HB       TYR  52   0.663   0.293  -3.545
  380   2HB   TYR  52          2HB       TYR  52  -0.142   1.483  -4.561
  381    HD1  TYR  52           HD1      TYR  52   0.975   1.876  -6.920
  382    HD2  TYR  52           HD2      TYR  52   1.558  -1.596  -4.527
  383    HE1  TYR  52           HE1      TYR  52   1.689   0.630  -8.909
  384    HE2  TYR  52           HE2      TYR  52   2.269  -2.851  -6.513
  385    HH   TYR  52           HH       TYR  52   3.368  -2.069  -8.896
  386    H    GLY  53           H        GLY  53   2.566   0.379  -2.267
  387   1HA   GLY  53          1HA       GLY  53   4.874  -0.600  -3.594
  388   2HA   GLY  53          2HA       GLY  53   5.288   0.466  -2.266
  389    H    PHE  54           H        PHE  54   6.021  -2.187  -2.234
  390    HA   PHE  54           HA       PHE  54   4.056  -3.564  -0.627
  391   1HB   PHE  54          1HB       PHE  54   6.772  -4.489  -1.535
  392   2HB   PHE  54          2HB       PHE  54   5.569  -5.489  -0.731
  393    HD1  PHE  54           HD1      PHE  54   6.008  -3.347  -3.759
  394    HD2  PHE  54           HD2      PHE  54   4.075  -6.713  -2.008
  395    HE1  PHE  54           HE1      PHE  54   4.976  -3.872  -5.925
  396    HE2  PHE  54           HE2      PHE  54   3.042  -7.246  -4.178
  397    HZ   PHE  54           HZ       PHE  54   3.495  -5.826  -6.142
  398    H    CYS  55           H        CYS  55   4.254  -4.095   1.497
  399    HA   CYS  55           HA       CYS  55   5.837  -2.316   3.066
  400   1HB   CYS  55          1HB       CYS  55   4.244  -4.677   4.070
  401   2HB   CYS  55          2HB       CYS  55   4.706  -3.229   4.963
  402    HA   PRO  56           HA       PRO  56   8.398  -6.107   4.332
  403   1HB   PRO  56          1HB       PRO  56   7.981  -8.540   3.336
  404   2HB   PRO  56          2HB       PRO  56   6.973  -7.903   4.640
  405   1HG   PRO  56          1HG       PRO  56   6.382  -8.111   1.717
  406   2HG   PRO  56          2HG       PRO  56   5.318  -8.417   3.103
  407   1HD   PRO  56          1HD       PRO  56   5.344  -6.077   1.626
  408   2HD   PRO  56          2HD       PRO  56   4.739  -6.226   3.288
  409    H    HIS  57           H        HIS  57  10.156  -7.568   3.337
  410    HA   HIS  57           HA       HIS  57  11.067  -6.281   0.912
  411   1HB   HIS  57          1HB       HIS  57  13.138  -7.667   1.268
  412   2HB   HIS  57          2HB       HIS  57  12.745  -6.575   2.589
  413    HD1  HIS  57           HD1      HIS  57  12.036 -10.259   1.776
  414    HD2  HIS  57           HD2      HIS  57  13.011  -7.769   4.968
  415    HE1  HIS  57           HE1      HIS  57  12.282 -11.774   3.773
  416    H    GLU  58           H        GLU  58  12.580  -8.463  -0.152
  417    HA   GLU  58           HA       GLU  58  10.800  -9.473  -2.024
  418   1HB   GLU  58          1HB       GLU  58  12.576 -11.136  -2.565
  419   2HB   GLU  58          2HB       GLU  58  13.153  -9.478  -2.489
  420   1HG   GLU  58          1HG       GLU  58  14.030  -9.901  -0.238
  421   2HG   GLU  58          2HG       GLU  58  13.469 -11.568  -0.350
  422    H    ALA  59           H        ALA  59   9.653 -11.351  -2.278
  423    HA   ALA  59           HA       ALA  59   9.711 -13.385  -0.199
  424   1HB   ALA  59          1HB       ALA  59   7.124 -13.201  -0.112
  425   2HB   ALA  59          2HB       ALA  59   7.392 -11.552  -0.673
  426   3HB   ALA  59          3HB       ALA  59   8.100 -12.087   0.849
  Start of MODEL   31
    1   1H    ARG   1          1H        ARG   1   6.261   6.039  10.731
    2   2H    ARG   1          2H        ARG   1   4.837   5.169  11.136
    3   3H    ARG   1          3H        ARG   1   4.720   6.750  10.471
    4    HA   ARG   1           HA       ARG   1   4.220   5.232   8.797
    5   1HB   ARG   1          1HB       ARG   1   6.965   6.360   8.626
    6   2HB   ARG   1          2HB       ARG   1   6.164   5.653   7.247
    7   1HG   ARG   1          1HG       ARG   1   5.124   8.007   8.804
    8   2HG   ARG   1          2HG       ARG   1   6.080   8.131   7.327
    9   1HD   ARG   1          1HD       ARG   1   3.928   6.336   6.833
   10   2HD   ARG   1          2HD       ARG   1   3.266   7.766   7.620
   11    HE   ARG   1           HE       ARG   1   4.145   7.583   4.930
   12   1HH1  ARG   1          1HH1      ARG   1   4.166   9.791   7.648
   13   2HH1  ARG   1          2HH1      ARG   1   4.261  11.219   6.665
   14   1HH2  ARG   1          1HH2      ARG   1   4.229   9.467   3.629
   15   2HH2  ARG   1          2HH2      ARG   1   4.297  11.034   4.380
   16    H    ILE   2           H        ILE   2   5.585   3.727   7.146
   17    HA   ILE   2           HA       ILE   2   7.203   1.820   8.605
   18    HB   ILE   2           HB       ILE   2   4.635   1.156   8.581
   19   1HG1  ILE   2          1HG1      ILE   2   6.840  -0.795   7.875
   20   2HG1  ILE   2          2HG1      ILE   2   6.422  -0.246   9.495
   21   1HG2  ILE   2          1HG2      ILE   2   5.586   0.292   5.858
   22   2HG2  ILE   2          2HG2      ILE   2   4.238   1.373   6.231
   23   3HG2  ILE   2          3HG2      ILE   2   4.142  -0.339   6.650
   24   1HD1  ILE   2          1HD1      ILE   2   4.764  -1.714   9.680
   25   2HD1  ILE   2          2HD1      ILE   2   5.503  -2.519   8.292
   26   3HD1  ILE   2          3HD1      ILE   2   4.172  -1.387   8.051
   27    HA   PRO   3           HA       PRO   3   9.588   1.996   4.901
   28   1HB   PRO   3          1HB       PRO   3  10.181  -0.868   5.319
   29   2HB   PRO   3          2HB       PRO   3  11.285   0.498   5.167
   30   1HG   PRO   3          1HG       PRO   3  10.836  -0.652   7.530
   31   2HG   PRO   3          2HG       PRO   3  11.059   1.103   7.390
   32   1HD   PRO   3          1HD       PRO   3   8.533  -0.467   7.771
   33   2HD   PRO   3          2HD       PRO   3   8.999   1.108   8.455
   34    H    VAL   4           H        VAL   4   9.913   0.938   2.795
   35    HA   VAL   4           HA       VAL   4   7.562  -0.632   1.951
   36    HB   VAL   4           HB       VAL   4   8.888   1.624   0.387
   37   1HG1  VAL   4          1HG1      VAL   4   6.286   0.554  -0.487
   38   2HG1  VAL   4          2HG1      VAL   4   7.655  -0.541  -0.696
   39   3HG1  VAL   4          3HG1      VAL   4   7.683   1.063  -1.430
   40   1HG2  VAL   4          1HG2      VAL   4   7.261   2.051   2.429
   41   2HG2  VAL   4          2HG2      VAL   4   6.030   1.693   1.219
   42   3HG2  VAL   4          3HG2      VAL   4   7.165   3.016   0.953
   43    H    LYS   5           H        LYS   5   7.887  -2.127   0.294
   44    HA   LYS   5           HA       LYS   5  10.547  -3.207   0.139
   45   1HB   LYS   5          1HB       LYS   5   8.084  -4.320   0.179
   46   2HB   LYS   5          2HB       LYS   5   8.301  -4.223  -1.550
   47   1HG   LYS   5          1HG       LYS   5   8.795  -6.418  -0.330
   48   2HG   LYS   5          2HG       LYS   5   9.914  -5.881  -1.565
   49   1HD   LYS   5          1HD       LYS   5  11.613  -5.630  -0.091
   50   2HD   LYS   5          2HD       LYS   5  10.548  -5.064   1.202
   51   1HE   LYS   5          1HE       LYS   5  10.987  -7.897   0.273
   52   2HE   LYS   5          2HE       LYS   5  11.412  -7.201   1.840
   53   1HZ   LYS   5          1HZ       LYS   5   9.444  -8.406   2.194
   54   2HZ   LYS   5          2HZ       LYS   5   8.705  -7.817   0.781
   55   3HZ   LYS   5          3HZ       LYS   5   8.941  -6.788   2.111
   56    H    TYR   6           H        TYR   6   8.281  -2.871  -2.577
   57    HA   TYR   6           HA       TYR   6  10.138  -1.090  -3.934
   58   1HB   TYR   6          1HB       TYR   6   9.196  -3.619  -5.318
   59   2HB   TYR   6          2HB       TYR   6  10.295  -2.397  -5.957
   60    HD1  TYR   6           HD1      TYR   6   9.979  -5.313  -3.838
   61    HD2  TYR   6           HD2      TYR   6  12.637  -2.229  -5.075
   62    HE1  TYR   6           HE1      TYR   6  11.848  -6.569  -2.877
   63    HE2  TYR   6           HE2      TYR   6  14.522  -3.485  -4.122
   64    HH   TYR   6           HH       TYR   6  15.182  -5.309  -3.065
   65    H    GLY   7           H        GLY   7   9.054  -0.763  -6.321
   66   1HA   GLY   7          1HA       GLY   7   6.751  -0.750  -7.296
   67   2HA   GLY   7          2HA       GLY   7   6.239  -0.070  -5.761
   68    H    ASN   8           H        ASN   8   5.435   1.745  -6.877
   69    HA   ASN   8           HA       ASN   8   7.505   3.579  -7.934
   70   1HB   ASN   8          1HB       ASN   8   5.859   4.489  -9.408
   71   2HB   ASN   8          2HB       ASN   8   5.706   2.736  -9.513
   72   1HD2  ASN   8          1HD2      ASN   8   3.742   5.058  -9.895
   73   2HD2  ASN   8          2HD2      ASN   8   2.418   4.621  -8.870
   74    H    ALA   9           H        ALA   9   6.647   3.233  -5.140
   75    HA   ALA   9           HA       ALA   9   4.980   5.422  -4.403
   76   1HB   ALA   9          1HB       ALA   9   6.596   3.427  -2.930
   77   2HB   ALA   9          2HB       ALA   9   4.848   3.628  -3.005
   78   3HB   ALA   9          3HB       ALA   9   5.826   4.780  -2.096
   79    H    ASP  10           H        ASP  10   7.929   5.603  -5.652
   80    HA   ASP  10           HA       ASP  10   9.549   7.151  -5.773
   81   1HB   ASP  10          1HB       ASP  10   7.483   8.788  -4.329
   82   2HB   ASP  10          2HB       ASP  10   9.025   9.456  -4.854
   83    H    GLY  11           H        GLY  11   8.934   5.709  -2.880
   84   1HA   GLY  11          1HA       GLY  11  10.940   5.291  -1.539
   85   2HA   GLY  11          2HA       GLY  11  11.332   6.993  -1.725
   86    H    GLU  12           H        GLU  12   8.258   7.418  -1.243
   87    HA   GLU  12           HA       GLU  12   8.528   8.060   1.515
   88   1HB   GLU  12          1HB       GLU  12   6.162   7.980  -0.348
   89   2HB   GLU  12          2HB       GLU  12   5.990   8.393   1.348
   90   1HG   GLU  12          1HG       GLU  12   7.791   9.868  -0.549
   91   2HG   GLU  12          2HG       GLU  12   6.129  10.336  -0.206
   92    H    TYR  13           H        TYR  13   7.259   7.214   3.294
   93    HA   TYR  13           HA       TYR  13   7.149   4.334   3.224
   94   1HB   TYR  13          1HB       TYR  13   6.560   6.266   5.465
   95   2HB   TYR  13          2HB       TYR  13   6.576   4.510   5.629
   96    HD1  TYR  13           HD1      TYR  13   8.178   5.771   7.482
   97    HD2  TYR  13           HD2      TYR  13   9.132   5.021   3.407
   98    HE1  TYR  13           HE1      TYR  13  10.560   5.815   8.047
   99    HE2  TYR  13           HE2      TYR  13  11.525   5.070   3.958
  100    HH   TYR  13           HH       TYR  13  12.981   4.752   5.877
  101    H    CYS  14           H        CYS  14   5.160   3.224   4.263
  102    HA   CYS  14           HA       CYS  14   2.916   3.850   2.664
  103   1HB   CYS  14          1HB       CYS  14   3.349   1.942   4.945
  104   2HB   CYS  14          2HB       CYS  14   1.763   2.140   4.209
  105    H    LYS  15           H        LYS  15   0.990   4.795   3.123
  106    HA   LYS  15           HA       LYS  15   0.931   6.455   5.539
  107   1HB   LYS  15          1HB       LYS  15   0.723   7.514   3.269
  108   2HB   LYS  15          2HB       LYS  15  -0.791   6.649   3.059
  109   1HG   LYS  15          1HG       LYS  15  -1.305   8.874   3.717
  110   2HG   LYS  15          2HG       LYS  15  -1.659   7.812   5.086
  111   1HD   LYS  15          1HD       LYS  15   0.445   8.430   6.136
  112   2HD   LYS  15          2HD       LYS  15   0.877   9.417   4.740
  113   1HE   LYS  15          1HE       LYS  15  -1.119  10.820   5.165
  114   2HE   LYS  15          2HE       LYS  15  -1.436   9.874   6.618
  115   1HZ   LYS  15          1HZ       LYS  15  -0.295  11.702   7.413
  116   2HZ   LYS  15          2HZ       LYS  15   0.761  11.777   6.084
  117   3HZ   LYS  15          3HZ       LYS  15   0.953  10.561   7.258
  118    H    PHE  16           H        PHE  16  -0.422   5.986   7.142
  119    HA   PHE  16           HA       PHE  16  -2.700   4.213   6.568
  120   1HB   PHE  16          1HB       PHE  16  -1.006   4.282   9.083
  121   2HB   PHE  16          2HB       PHE  16  -2.425   3.272   8.837
  122    HD1  PHE  16           HD1      PHE  16  -2.139   2.080   6.289
  123    HD2  PHE  16           HD2      PHE  16   0.899   2.999   9.122
  124    HE1  PHE  16           HE1      PHE  16  -0.748   0.284   5.366
  125    HE2  PHE  16           HE2      PHE  16   2.305   1.207   8.206
  126    HZ   PHE  16           HZ       PHE  16   1.491  -0.192   6.325
  127    HA   PRO  17           HA       PRO  17  -4.417   3.827   6.831
  128   1HB   PRO  17          1HB       PRO  17  -7.056   4.538   6.585
  129   2HB   PRO  17          2HB       PRO  17  -6.377   3.693   7.978
  130   1HG   PRO  17          1HG       PRO  17  -7.414   6.391   7.849
  131   2HG   PRO  17          2HG       PRO  17  -6.846   5.488   9.262
  132   1HD   PRO  17          1HD       PRO  17  -5.455   7.521   7.665
  133   2HD   PRO  17          2HD       PRO  17  -5.083   6.919   9.293
  134    H    PHE  18           H        PHE  18  -4.750   3.426   4.667
  135    HA   PHE  18           HA       PHE  18  -4.911   5.818   2.981
  136   1HB   PHE  18          1HB       PHE  18  -3.919   4.552   1.177
  137   2HB   PHE  18          2HB       PHE  18  -2.918   4.418   2.614
  138    HD1  PHE  18           HD1      PHE  18  -3.196   2.254   4.016
  139    HD2  PHE  18           HD2      PHE  18  -4.557   2.681   0.009
  140    HE1  PHE  18           HE1      PHE  18  -3.194  -0.190   3.753
  141    HE2  PHE  18           HE2      PHE  18  -4.555   0.246  -0.266
  142    HZ   PHE  18           HZ       PHE  18  -3.867  -1.217   1.611
  143    H    LEU  19           H        LEU  19  -6.209   5.708   1.009
  144    HA   LEU  19           HA       LEU  19  -8.732   4.369   1.587
  145   1HB   LEU  19          1HB       LEU  19  -8.662   6.801   1.183
  146   2HB   LEU  19          2HB       LEU  19  -8.081   6.492  -0.443
  147    HG   LEU  19           HG       LEU  19 -10.237   5.189  -0.815
  148   1HD1  LEU  19          1HD1      LEU  19 -10.900   6.550   1.780
  149   2HD1  LEU  19          2HD1      LEU  19 -10.940   4.823   1.426
  150   3HD1  LEU  19          3HD1      LEU  19 -12.107   5.905   0.666
  151   1HD2  LEU  19          1HD2      LEU  19  -9.934   7.340  -1.817
  152   2HD2  LEU  19          2HD2      LEU  19 -10.284   8.156  -0.293
  153   3HD2  LEU  19          3HD2      LEU  19 -11.558   7.277  -1.139
  154    H    PHE  20           H        PHE  20  -9.151   2.512   0.685
  155    HA   PHE  20           HA       PHE  20  -8.337   2.044  -2.115
  156   1HB   PHE  20          1HB       PHE  20  -7.178   0.610  -0.241
  157   2HB   PHE  20          2HB       PHE  20  -8.753  -0.172  -0.143
  158    HD1  PHE  20           HD1      PHE  20  -7.413  -2.179  -0.625
  159    HD2  PHE  20           HD2      PHE  20  -8.004   0.926  -3.469
  160    HE1  PHE  20           HE1      PHE  20  -6.872  -3.761  -2.422
  161    HE2  PHE  20           HE2      PHE  20  -7.455  -0.655  -5.281
  162    HZ   PHE  20           HZ       PHE  20  -6.896  -2.992  -4.765
  163    H    ASN  21           H        ASN  21 -10.208   2.281  -3.226
  164    HA   ASN  21           HA       ASN  21 -12.388   2.101  -3.864
  165   1HB   ASN  21          1HB       ASN  21 -12.068  -0.542  -2.436
  166   2HB   ASN  21          2HB       ASN  21 -13.465  -0.119  -3.423
  167   1HD2  ASN  21          1HD2      ASN  21 -10.642  -1.728  -3.448
  168   2HD2  ASN  21          2HD2      ASN  21 -10.281  -1.675  -5.138
  169    H    GLY  22           H        GLY  22 -12.082   3.642  -1.557
  170   1HA   GLY  22          1HA       GLY  22 -13.601   4.725  -0.178
  171   2HA   GLY  22          2HA       GLY  22 -14.767   3.453  -0.506
  172    H    LYS  23           H        LYS  23 -11.847   2.101   0.506
  173    HA   LYS  23           HA       LYS  23 -12.823   2.019   3.286
  174   1HB   LYS  23          1HB       LYS  23 -13.127  -0.124   2.042
  175   2HB   LYS  23          2HB       LYS  23 -11.392  -0.191   1.792
  176   1HG   LYS  23          1HG       LYS  23 -11.015  -0.403   4.162
  177   2HG   LYS  23          2HG       LYS  23 -12.740  -0.210   4.486
  178   1HD   LYS  23          1HD       LYS  23 -11.518  -2.436   2.862
  179   2HD   LYS  23          2HD       LYS  23 -11.994  -2.565   4.559
  180   1HE   LYS  23          1HE       LYS  23 -14.307  -2.064   3.951
  181   2HE   LYS  23          2HE       LYS  23 -13.837  -1.915   2.253
  182   1HZ   LYS  23          1HZ       LYS  23 -13.374  -4.395   3.816
  183   2HZ   LYS  23          2HZ       LYS  23 -13.358  -4.195   2.125
  184   3HZ   LYS  23          3HZ       LYS  23 -14.826  -4.117   2.974
  185    H    GLU  24           H        GLU  24 -11.354   2.415   4.875
  186    HA   GLU  24           HA       GLU  24  -8.672   3.174   3.979
  187   1HB   GLU  24          1HB       GLU  24 -10.206   3.850   6.489
  188   2HB   GLU  24          2HB       GLU  24  -8.537   4.320   6.210
  189   1HG   GLU  24          1HG       GLU  24  -9.244   5.590   4.242
  190   2HG   GLU  24          2HG       GLU  24 -10.914   5.134   4.562
  191    H    TYR  25           H        TYR  25  -6.901   2.103   4.579
  192    HA   TYR  25           HA       TYR  25  -7.208  -0.057   6.561
  193   1HB   TYR  25          1HB       TYR  25  -5.319   0.116   4.233
  194   2HB   TYR  25          2HB       TYR  25  -5.350  -1.194   5.393
  195    HD1  TYR  25           HD1      TYR  25  -7.839  -2.246   5.671
  196    HD2  TYR  25           HD2      TYR  25  -6.331  -0.263   2.221
  197    HE1  TYR  25           HE1      TYR  25  -9.500  -3.419   4.272
  198    HE2  TYR  25           HE2      TYR  25  -7.989  -1.431   0.816
  199    HH   TYR  25           HH       TYR  25  -9.785  -4.087   1.923
  200    H    ASN  26           H        ASN  26  -6.037   0.088   8.350
  201    HA   ASN  26           HA       ASN  26  -3.978   2.153   8.531
  202   1HB   ASN  26          1HB       ASN  26  -5.525   0.581  10.580
  203   2HB   ASN  26          2HB       ASN  26  -4.057   1.445  11.024
  204   1HD2  ASN  26          1HD2      ASN  26  -7.378   1.686  10.409
  205   2HD2  ASN  26          2HD2      ASN  26  -7.514   3.406  10.510
  206    H    SER  27           H        SER  27  -3.966  -0.765   7.414
  207    HA   SER  27           HA       SER  27  -1.214  -1.239   8.041
  208   1HB   SER  27          1HB       SER  27  -1.708  -3.659   8.752
  209   2HB   SER  27          2HB       SER  27  -2.017  -2.399   9.950
  210    HG   SER  27           HG       SER  27  -4.035  -2.946   9.952
  211    H    CYS  28           H        CYS  28  -0.399  -3.135   6.817
  212    HA   CYS  28           HA       CYS  28  -1.042  -2.968   4.120
  213   1HB   CYS  28          1HB       CYS  28   0.249  -5.291   5.556
  214   2HB   CYS  28          2HB       CYS  28   0.354  -4.949   3.835
  215    H    THR  29           H        THR  29  -2.163  -4.313   2.675
  216    HA   THR  29           HA       THR  29  -3.807  -6.456   3.760
  217    HB   THR  29           HB       THR  29  -5.177  -4.400   3.760
  218    HG1  THR  29           HG1      THR  29  -6.511  -6.031   3.431
  219   1HG2  THR  29          1HG2      THR  29  -4.049  -3.328   1.771
  220   2HG2  THR  29          2HG2      THR  29  -5.806  -3.203   1.851
  221   3HG2  THR  29          3HG2      THR  29  -5.056  -4.374   0.768
  222    H    ASP  30           H        ASP  30  -4.648  -7.919   2.009
  223    HA   ASP  30           HA       ASP  30  -2.745  -7.933  -0.202
  224   1HB   ASP  30          1HB       ASP  30  -4.409 -10.243  -0.187
  225   2HB   ASP  30          2HB       ASP  30  -2.683 -10.156  -0.132
  226    H    THR  31           H        THR  31  -5.630  -6.770   0.408
  227    HA   THR  31           HA       THR  31  -7.400  -7.646  -1.541
  228    HB   THR  31           HB       THR  31  -7.087  -4.830  -0.523
  229    HG1  THR  31           HG1      THR  31  -7.275  -6.011   1.291
  230   1HG2  THR  31          1HG2      THR  31  -9.441  -6.305  -1.644
  231   2HG2  THR  31          2HG2      THR  31  -8.740  -4.784  -2.195
  232   3HG2  THR  31          3HG2      THR  31  -9.603  -4.853  -0.658
  233    H    GLY  32           H        GLY  32  -7.632  -7.263  -3.679
  234   1HA   GLY  32          1HA       GLY  32  -7.336  -6.169  -5.712
  235   2HA   GLY  32          2HA       GLY  32  -6.167  -5.109  -4.943
  236    H    ARG  33           H        ARG  33  -4.766  -7.465  -3.771
  237    HA   ARG  33           HA       ARG  33  -3.134  -8.109  -6.110
  238   1HB   ARG  33          1HB       ARG  33  -2.625  -8.548  -3.154
  239   2HB   ARG  33          2HB       ARG  33  -1.498  -8.944  -4.434
  240   1HG   ARG  33          1HG       ARG  33  -2.484  -6.179  -3.775
  241   2HG   ARG  33          2HG       ARG  33  -0.931  -6.858  -3.290
  242   1HD   ARG  33          1HD       ARG  33  -1.872  -6.360  -6.114
  243   2HD   ARG  33          2HD       ARG  33  -0.685  -5.406  -5.228
  244    HE   ARG  33           HE       ARG  33   0.057  -8.170  -5.441
  245   1HH1  ARG  33          1HH1      ARG  33   0.052  -5.091  -7.089
  246   2HH1  ARG  33          2HH1      ARG  33   1.407  -5.494  -8.104
  247   1HH2  ARG  33          1HH2      ARG  33   1.792  -8.726  -6.812
  248   2HH2  ARG  33          2HH2      ARG  33   2.362  -7.576  -7.984
  249    H    SER  34           H        SER  34  -3.586  -9.952  -7.131
  250    HA   SER  34           HA       SER  34  -5.149 -12.009  -5.851
  251   1HB   SER  34          1HB       SER  34  -3.826 -12.018  -8.581
  252   2HB   SER  34          2HB       SER  34  -5.098 -13.108  -8.024
  253    HG   SER  34           HG       SER  34  -5.878 -11.343  -9.318
  254    H    ASP  35           H        ASP  35  -1.943 -11.220  -5.797
  255    HA   ASP  35           HA       ASP  35  -0.896 -13.883  -5.818
  256   1HB   ASP  35          1HB       ASP  35   0.915 -11.845  -4.925
  257   2HB   ASP  35          2HB       ASP  35   1.092 -12.951  -6.257
  258    H    GLY  36           H        GLY  36  -2.351 -11.938  -3.659
  259   1HA   GLY  36          1HA       GLY  36  -2.723 -12.158  -1.402
  260   2HA   GLY  36          2HA       GLY  36  -1.748 -13.617  -1.448
  261    H    PHE  37           H        PHE  37  -0.574 -10.491  -2.515
  262    HA   PHE  37           HA       PHE  37   1.438 -10.610  -0.396
  263   1HB   PHE  37          1HB       PHE  37   1.342  -9.218  -3.056
  264   2HB   PHE  37          2HB       PHE  37   2.444  -8.653  -1.806
  265    HD1  PHE  37           HD1      PHE  37   3.656 -10.834  -0.611
  266    HD2  PHE  37           HD2      PHE  37   2.357 -10.512  -4.651
  267    HE1  PHE  37           HE1      PHE  37   5.292 -12.549  -1.275
  268    HE2  PHE  37           HE2      PHE  37   3.986 -12.225  -5.315
  269    HZ   PHE  37           HZ       PHE  37   5.455 -13.247  -3.626
  270    H    LEU  38           H        LEU  38   1.689  -9.072   1.126
  271    HA   LEU  38           HA       LEU  38  -0.530  -7.295   1.591
  272   1HB   LEU  38          1HB       LEU  38   1.494  -8.541   3.134
  273   2HB   LEU  38          2HB       LEU  38   1.676  -6.814   3.353
  274    HG   LEU  38           HG       LEU  38  -0.605  -6.624   4.146
  275   1HD1  LEU  38          1HD1      LEU  38  -1.122  -9.499   4.293
  276   2HD1  LEU  38          2HD1      LEU  38  -1.123  -8.838   2.658
  277   3HD1  LEU  38          3HD1      LEU  38  -2.201  -8.162   3.880
  278   1HD2  LEU  38          1HD2      LEU  38   0.109  -7.144   6.180
  279   2HD2  LEU  38          2HD2      LEU  38   1.451  -8.032   5.460
  280   3HD2  LEU  38          3HD2      LEU  38  -0.059  -8.866   5.834
  281    H    TRP  39           H        TRP  39  -0.643  -5.174   1.108
  282    HA   TRP  39           HA       TRP  39   1.830  -3.693   0.573
  283   1HB   TRP  39          1HB       TRP  39   1.013  -2.807  -1.538
  284   2HB   TRP  39          2HB       TRP  39   1.002  -4.560  -1.612
  285    HD1  TRP  39           HD1      TRP  39  -1.457  -5.759  -1.437
  286    HE1  TRP  39           HE1      TRP  39  -3.763  -4.911  -2.159
  287    HE3  TRP  39           HE3      TRP  39  -0.437  -0.747  -1.806
  288    HZ2  TRP  39           HZ2      TRP  39  -4.986  -2.467  -2.800
  289    HZ3  TRP  39           HZ3      TRP  39  -2.255   0.771  -2.500
  290    HH2  TRP  39           HH2      TRP  39  -4.477  -0.088  -2.980
  291    H    CYS  40           H        CYS  40   1.248  -1.327   0.081
  292    HA   CYS  40           HA       CYS  40  -1.164  -0.254   1.198
  293   1HB   CYS  40          1HB       CYS  40   0.373   1.171   2.829
  294   2HB   CYS  40          2HB       CYS  40  -0.341  -0.359   3.328
  295    H    SER  41           H        SER  41  -1.268   2.086   0.763
  296    HA   SER  41           HA       SER  41   0.593   2.763  -1.391
  297   1HB   SER  41          1HB       SER  41  -1.075   4.513  -1.985
  298   2HB   SER  41          2HB       SER  41  -1.743   2.881  -1.997
  299    HG   SER  41           HG       SER  41  -2.381   5.036  -0.419
  300    H    THR  42           H        THR  42   1.016   5.166  -1.651
  301    HA   THR  42           HA       THR  42   2.294   6.110   0.785
  302    HB   THR  42           HB       THR  42   2.377   7.111  -2.068
  303    HG1  THR  42           HG1      THR  42   4.563   6.166  -1.844
  304   1HG2  THR  42          1HG2      THR  42   4.566   7.739  -0.200
  305   2HG2  THR  42          2HG2      THR  42   3.069   8.652  -0.011
  306   3HG2  THR  42          3HG2      THR  42   3.920   8.662  -1.556
  307    H    THR  43           H        THR  43  -0.186   7.009  -1.488
  308    HA   THR  43           HA       THR  43  -0.809   9.436   0.012
  309    HB   THR  43           HB       THR  43  -0.402   9.751  -2.340
  310    HG1  THR  43           HG1      THR  43  -2.395  10.656  -2.971
  311   1HG2  THR  43          1HG2      THR  43  -0.729   7.881  -3.522
  312   2HG2  THR  43          2HG2      THR  43  -2.287   8.652  -3.836
  313   3HG2  THR  43          3HG2      THR  43  -2.152   7.404  -2.594
  314    H    TYR  44           H        TYR  44  -3.194   9.967   0.131
  315    HA   TYR  44           HA       TYR  44  -4.588   7.873   1.455
  316   1HB   TYR  44          1HB       TYR  44  -5.509  10.557   0.487
  317   2HB   TYR  44          2HB       TYR  44  -6.505   9.482   1.454
  318    HD1  TYR  44           HD1      TYR  44  -5.320   8.704   3.738
  319    HD2  TYR  44           HD2      TYR  44  -4.335  12.226   1.554
  320    HE1  TYR  44           HE1      TYR  44  -4.376   9.704   5.779
  321    HE2  TYR  44           HE2      TYR  44  -3.401  13.229   3.589
  322    HH   TYR  44           HH       TYR  44  -3.984  12.092   6.644
  323    H    ASN  45           H        ASN  45  -5.506   9.735  -1.434
  324    HA   ASN  45           HA       ASN  45  -7.288   7.659  -2.300
  325   1HB   ASN  45          1HB       ASN  45  -7.680  10.117  -2.697
  326   2HB   ASN  45          2HB       ASN  45  -6.356  10.093  -3.841
  327   1HD2  ASN  45          1HD2      ASN  45  -7.387   7.283  -4.614
  328   2HD2  ASN  45          2HD2      ASN  45  -8.675   7.712  -5.632
  329    H    PHE  46           H        PHE  46  -6.278   5.818  -2.893
  330    HA   PHE  46           HA       PHE  46  -3.785   5.820  -4.342
  331   1HB   PHE  46          1HB       PHE  46  -4.131   4.113  -2.677
  332   2HB   PHE  46          2HB       PHE  46  -5.644   3.602  -3.447
  333    HD1  PHE  46           HD1      PHE  46  -5.564   1.748  -4.844
  334    HD2  PHE  46           HD2      PHE  46  -1.981   3.975  -4.225
  335    HE1  PHE  46           HE1      PHE  46  -4.324   0.120  -6.196
  336    HE2  PHE  46           HE2      PHE  46  -0.742   2.345  -5.576
  337    HZ   PHE  46           HZ       PHE  46  -1.907   0.416  -6.565
  338    H    GLU  47           H        GLU  47  -7.137   5.625  -5.082
  339    HA   GLU  47           HA       GLU  47  -7.161   4.277  -7.503
  340   1HB   GLU  47          1HB       GLU  47  -9.130   5.029  -6.160
  341   2HB   GLU  47          2HB       GLU  47  -8.873   6.649  -6.773
  342   1HG   GLU  47          1HG       GLU  47  -9.277   5.878  -9.041
  343   2HG   GLU  47          2HG       GLU  47  -9.503   4.231  -8.448
  344    H    LYS  48           H        LYS  48  -6.734   7.770  -6.958
  345    HA   LYS  48           HA       LYS  48  -6.353   8.178  -9.786
  346   1HB   LYS  48          1HB       LYS  48  -7.614   9.903  -8.786
  347   2HB   LYS  48          2HB       LYS  48  -6.528  10.028  -7.413
  348   1HG   LYS  48          1HG       LYS  48  -4.830  11.072  -8.863
  349   2HG   LYS  48          2HG       LYS  48  -5.938  10.980 -10.233
  350   1HD   LYS  48          1HD       LYS  48  -6.032  13.186  -9.344
  351   2HD   LYS  48          2HD       LYS  48  -7.548  12.373  -8.950
  352   1HE   LYS  48          1HE       LYS  48  -6.892  12.051  -6.684
  353   2HE   LYS  48          2HE       LYS  48  -5.231  12.526  -7.037
  354   1HZ   LYS  48          1HZ       LYS  48  -7.629  14.208  -6.743
  355   2HZ   LYS  48          2HZ       LYS  48  -6.369  14.744  -7.746
  356   3HZ   LYS  48          3HZ       LYS  48  -6.068  14.423  -6.103
  357    H    ASP  49           H        ASP  49  -4.299   8.494  -6.868
  358    HA   ASP  49           HA       ASP  49  -2.042   9.453  -8.318
  359   1HB   ASP  49          1HB       ASP  49  -2.504   8.459  -5.547
  360   2HB   ASP  49          2HB       ASP  49  -0.849   8.536  -6.144
  361    H    GLY  50           H        GLY  50  -2.728   6.294  -6.855
  362   1HA   GLY  50          1HA       GLY  50  -2.218   4.197  -7.706
  363   2HA   GLY  50          2HA       GLY  50  -1.435   4.981  -9.065
  364    H    LYS  51           H        LYS  51  -0.310   6.200  -6.107
  365    HA   LYS  51           HA       LYS  51   2.253   4.919  -6.486
  366   1HB   LYS  51          1HB       LYS  51   1.231   6.951  -4.512
  367   2HB   LYS  51          2HB       LYS  51   2.781   6.176  -4.285
  368   1HG   LYS  51          1HG       LYS  51   3.340   8.132  -5.320
  369   2HG   LYS  51          2HG       LYS  51   3.269   7.003  -6.676
  370   1HD   LYS  51          1HD       LYS  51   1.162   7.839  -7.375
  371   2HD   LYS  51          2HD       LYS  51   0.940   8.730  -5.862
  372   1HE   LYS  51          1HE       LYS  51   2.828  10.176  -6.439
  373   2HE   LYS  51          2HE       LYS  51   3.051   9.287  -7.945
  374   1HZ   LYS  51          1HZ       LYS  51   0.485  10.634  -7.321
  375   2HZ   LYS  51          2HZ       LYS  51   1.089  10.140  -8.833
  376   3HZ   LYS  51          3HZ       LYS  51   1.784  11.472  -8.030
  377    H    TYR  52           H        TYR  52   2.727   2.974  -5.667
  378    HA   TYR  52           HA       TYR  52   1.669   2.245  -3.041
  379   1HB   TYR  52          1HB       TYR  52   0.882   0.116  -3.742
  380   2HB   TYR  52          2HB       TYR  52   0.216   1.261  -4.904
  381    HD1  TYR  52           HD1      TYR  52   1.683   1.631  -7.059
  382    HD2  TYR  52           HD2      TYR  52   1.955  -1.765  -4.518
  383    HE1  TYR  52           HE1      TYR  52   2.732   0.362  -8.881
  384    HE2  TYR  52           HE2      TYR  52   3.006  -3.052  -6.325
  385    HH   TYR  52           HH       TYR  52   4.412  -1.836  -8.891
  386    H    GLY  53           H        GLY  53   2.632   0.119  -2.367
  387   1HA   GLY  53          1HA       GLY  53   5.095  -0.753  -3.448
  388   2HA   GLY  53          2HA       GLY  53   5.343   0.255  -2.032
  389    H    PHE  54           H        PHE  54   6.025  -2.497  -2.107
  390    HA   PHE  54           HA       PHE  54   3.898  -3.850  -0.663
  391   1HB   PHE  54          1HB       PHE  54   6.627  -4.829  -1.493
  392   2HB   PHE  54          2HB       PHE  54   5.363  -5.820  -0.771
  393    HD1  PHE  54           HD1      PHE  54   2.984  -5.389  -2.058
  394    HD2  PHE  54           HD2      PHE  54   6.878  -5.120  -3.761
  395    HE1  PHE  54           HE1      PHE  54   2.026  -5.799  -4.291
  396    HE2  PHE  54           HE2      PHE  54   5.934  -5.533  -5.992
  397    HZ   PHE  54           HZ       PHE  54   3.509  -5.880  -6.264
  398    H    CYS  55           H        CYS  55   4.404  -4.945   1.404
  399    HA   CYS  55           HA       CYS  55   5.787  -3.068   3.130
  400   1HB   CYS  55          1HB       CYS  55   4.340  -5.585   3.948
  401   2HB   CYS  55          2HB       CYS  55   4.639  -4.141   4.916
  402    HA   PRO  56           HA       PRO  56   9.475  -5.473   3.454
  403   1HB   PRO  56          1HB       PRO  56  10.555  -4.407   5.653
  404   2HB   PRO  56          2HB       PRO  56  10.398  -3.488   4.153
  405   1HG   PRO  56          1HG       PRO  56   8.694  -3.403   6.614
  406   2HG   PRO  56          2HG       PRO  56   9.267  -2.066   5.597
  407   1HD   PRO  56          1HD       PRO  56   6.750  -3.156   5.433
  408   2HD   PRO  56          2HD       PRO  56   7.565  -2.319   4.095
  409    H    HIS  57           H        HIS  57  10.462  -7.157   4.561
  410    HA   HIS  57           HA       HIS  57  10.526  -9.066   5.780
  411   1HB   HIS  57          1HB       HIS  57  10.498  -7.000   7.559
  412   2HB   HIS  57          2HB       HIS  57   9.155  -7.979   8.140
  413    HD1  HIS  57           HD1      HIS  57  12.794  -8.547   7.121
  414    HD2  HIS  57           HD2      HIS  57   9.968  -9.889   9.873
  415    HE1  HIS  57           HE1      HIS  57  14.002 -10.198   8.590
  416    H    GLU  58           H        GLU  58   8.645  -9.887   7.878
  417    HA   GLU  58           HA       GLU  58   6.436 -10.606   6.102
  418   1HB   GLU  58          1HB       GLU  58   5.974 -12.244   8.139
  419   2HB   GLU  58          2HB       GLU  58   7.146 -12.630   6.891
  420   1HG   GLU  58          1HG       GLU  58   8.251 -13.154   8.849
  421   2HG   GLU  58          2HG       GLU  58   8.865 -11.550   8.463
  422    H    ALA  59           H        ALA  59   7.114  -9.315   9.293
  423    HA   ALA  59           HA       ALA  59   5.949  -8.088  10.778
  424   1HB   ALA  59          1HB       ALA  59   4.546  -6.326   9.910
  425   2HB   ALA  59          2HB       ALA  59   4.444  -7.142   8.350
  426   3HB   ALA  59          3HB       ALA  59   5.989  -6.505   8.915
  Start of MODEL   32
    1   1H    ARG   1          1H        ARG   1   9.722   4.406  11.666
    2   2H    ARG   1          2H        ARG   1  10.793   3.260  10.966
    3   3H    ARG   1          3H        ARG   1   9.590   2.744  12.091
    4    HA   ARG   1           HA       ARG   1   7.965   2.783  10.605
    5   1HB   ARG   1          1HB       ARG   1   8.529   5.316  10.339
    6   2HB   ARG   1          2HB       ARG   1   9.410   4.820   8.904
    7   1HG   ARG   1          1HG       ARG   1   7.290   5.545   8.181
    8   2HG   ARG   1          2HG       ARG   1   7.263   3.784   8.079
    9   1HD   ARG   1          1HD       ARG   1   6.089   3.679  10.231
   10   2HD   ARG   1          2HD       ARG   1   6.115   5.442  10.327
   11    HE   ARG   1           HE       ARG   1   4.890   4.589   7.914
   12   1HH1  ARG   1          1HH1      ARG   1   4.318   4.743  11.362
   13   2HH1  ARG   1          2HH1      ARG   1   2.601   4.917  11.199
   14   1HH2  ARG   1          1HH2      ARG   1   2.617   4.790   7.706
   15   2HH2  ARG   1          2HH2      ARG   1   1.633   4.939   9.134
   16    H    ILE   2           H        ILE   2   8.565   3.123   7.691
   17    HA   ILE   2           HA       ILE   2  10.745   1.349   7.133
   18    HB   ILE   2           HB       ILE   2   8.568  -0.050   7.752
   19   1HG1  ILE   2          1HG1      ILE   2  10.869  -0.781   6.779
   20   2HG1  ILE   2          2HG1      ILE   2   9.497  -1.878   6.668
   21   1HG2  ILE   2          1HG2      ILE   2   7.991   0.957   5.014
   22   2HG2  ILE   2          2HG2      ILE   2   6.894   0.635   6.364
   23   3HG2  ILE   2          3HG2      ILE   2   7.554  -0.702   5.421
   24   1HD1  ILE   2          1HD1      ILE   2   9.313  -0.499   4.317
   25   2HD1  ILE   2          2HD1      ILE   2  10.077  -2.073   4.529
   26   3HD1  ILE   2          3HD1      ILE   2  11.059  -0.605   4.562
   27    HA   PRO   3           HA       PRO   3  10.540   4.180   3.733
   28   1HB   PRO   3          1HB       PRO   3  12.604   3.257   2.289
   29   2HB   PRO   3          2HB       PRO   3  12.824   4.117   3.818
   30   1HG   PRO   3          1HG       PRO   3  12.820   1.166   3.297
   31   2HG   PRO   3          2HG       PRO   3  13.964   2.127   4.253
   32   1HD   PRO   3          1HD       PRO   3  11.960   0.722   5.408
   33   2HD   PRO   3          2HD       PRO   3  12.528   2.270   6.069
   34    H    VAL   4           H        VAL   4   9.499   1.039   3.527
   35    HA   VAL   4           HA       VAL   4   8.193  -0.063   1.982
   36    HB   VAL   4           HB       VAL   4   8.513   2.517   0.382
   37   1HG1  VAL   4          1HG1      VAL   4   8.010   0.527  -1.032
   38   2HG1  VAL   4          2HG1      VAL   4   6.772   1.780  -1.055
   39   3HG1  VAL   4          3HG1      VAL   4   6.524   0.317  -0.106
   40   1HG2  VAL   4          1HG2      VAL   4   6.224   1.466   2.056
   41   2HG2  VAL   4          2HG2      VAL   4   6.196   2.931   1.076
   42   3HG2  VAL   4          3HG2      VAL   4   7.286   2.822   2.456
   43    H    LYS   5           H        LYS   5   8.436  -1.217  -0.124
   44    HA   LYS   5           HA       LYS   5  11.281  -1.273  -0.829
   45   1HB   LYS   5          1HB       LYS   5   9.310  -3.410  -0.283
   46   2HB   LYS   5          2HB       LYS   5  10.474  -3.728  -1.560
   47   1HG   LYS   5          1HG       LYS   5  11.097  -3.054   1.312
   48   2HG   LYS   5          2HG       LYS   5  11.244  -4.646   0.538
   49   1HD   LYS   5          1HD       LYS   5  13.050  -3.942  -0.809
   50   2HD   LYS   5          2HD       LYS   5  12.788  -2.240  -0.419
   51   1HE   LYS   5          1HE       LYS   5  13.414  -2.704   1.918
   52   2HE   LYS   5          2HE       LYS   5  13.705  -4.390   1.495
   53   1HZ   LYS   5          1HZ       LYS   5  15.758  -3.206   1.540
   54   2HZ   LYS   5          2HZ       LYS   5  15.176  -2.020   0.475
   55   3HZ   LYS   5          3HZ       LYS   5  15.416  -3.619  -0.067
   56    H    TYR   6           H        TYR   6   9.326  -3.353  -2.603
   57    HA   TYR   6           HA       TYR   6   9.986  -1.987  -5.028
   58   1HB   TYR   6          1HB       TYR   6   8.241  -4.437  -4.783
   59   2HB   TYR   6          2HB       TYR   6   9.253  -3.945  -6.143
   60    HD1  TYR   6           HD1      TYR   6   9.313  -5.388  -2.737
   61    HD2  TYR   6           HD2      TYR   6  11.624  -4.414  -6.182
   62    HE1  TYR   6           HE1      TYR   6  11.193  -6.677  -1.833
   63    HE2  TYR   6           HE2      TYR   6  13.502  -5.707  -5.285
   64    HH   TYR   6           HH       TYR   6  14.352  -6.564  -3.261
   65    H    GLY   7           H        GLY   7   8.558  -1.310  -6.649
   66   1HA   GLY   7          1HA       GLY   7   6.122  -1.145  -7.239
   67   2HA   GLY   7          2HA       GLY   7   5.919  -0.403  -5.666
   68    H    ASN   8           H        ASN   8   5.137   1.509  -6.644
   69    HA   ASN   8           HA       ASN   8   7.221   3.024  -8.075
   70   1HB   ASN   8          1HB       ASN   8   5.528   4.202  -9.305
   71   2HB   ASN   8          2HB       ASN   8   5.221   2.475  -9.454
   72   1HD2  ASN   8          1HD2      ASN   8   3.418   4.773  -9.784
   73   2HD2  ASN   8          2HD2      ASN   8   2.129   4.517  -8.661
   74    H    ALA   9           H        ALA   9   6.419   2.833  -5.121
   75    HA   ALA   9           HA       ALA   9   5.716   5.599  -4.551
   76   1HB   ALA   9          1HB       ALA   9   6.335   4.096  -2.207
   77   2HB   ALA   9          2HB       ALA   9   5.255   3.165  -3.247
   78   3HB   ALA   9          3HB       ALA   9   4.795   4.784  -2.717
   79    H    ASP  10           H        ASP  10   8.426   3.721  -5.024
   80    HA   ASP  10           HA       ASP  10  10.645   4.038  -4.903
   81   1HB   ASP  10          1HB       ASP  10   9.970   6.330  -5.758
   82   2HB   ASP  10          2HB       ASP  10  10.138   6.900  -4.099
   83    H    GLY  11           H        GLY  11  10.315   6.531  -2.459
   84   1HA   GLY  11          1HA       GLY  11  11.097   4.551  -0.442
   85   2HA   GLY  11          2HA       GLY  11  11.990   6.046  -0.621
   86    H    GLU  12           H        GLU  12   8.609   6.380  -1.088
   87    HA   GLU  12           HA       GLU  12   8.442   7.836   1.426
   88   1HB   GLU  12          1HB       GLU  12   6.786   7.710  -1.044
   89   2HB   GLU  12          2HB       GLU  12   5.964   8.082   0.470
   90   1HG   GLU  12          1HG       GLU  12   6.502  10.127  -0.578
   91   2HG   GLU  12          2HG       GLU  12   7.557   9.947   0.818
   92    H    TYR  13           H        TYR  13   7.662   7.086   3.213
   93    HA   TYR  13           HA       TYR  13   6.997   4.475   3.728
   94   1HB   TYR  13          1HB       TYR  13   6.404   5.193   5.905
   95   2HB   TYR  13          2HB       TYR  13   7.747   6.183   5.356
   96    HD1  TYR  13           HD1      TYR  13   7.030   8.429   4.170
   97    HD2  TYR  13           HD2      TYR  13   4.613   6.201   6.853
   98    HE1  TYR  13           HE1      TYR  13   5.702  10.461   4.638
   99    HE2  TYR  13           HE2      TYR  13   3.272   8.212   7.339
  100    HH   TYR  13           HH       TYR  13   2.813  10.331   6.682
  101    H    CYS  14           H        CYS  14   4.991   3.618   4.701
  102    HA   CYS  14           HA       CYS  14   2.772   4.007   2.938
  103   1HB   CYS  14          1HB       CYS  14   2.832   2.418   5.504
  104   2HB   CYS  14          2HB       CYS  14   1.756   2.192   4.131
  105    H    LYS  15           H        LYS  15   1.040   5.324   3.284
  106    HA   LYS  15           HA       LYS  15   0.957   6.734   5.856
  107   1HB   LYS  15          1HB       LYS  15   1.041   8.006   3.644
  108   2HB   LYS  15          2HB       LYS  15  -0.615   7.466   3.387
  109   1HG   LYS  15          1HG       LYS  15  -1.389   8.639   5.300
  110   2HG   LYS  15          2HG       LYS  15   0.261   8.974   5.834
  111   1HD   LYS  15          1HD       LYS  15  -0.679  10.969   4.866
  112   2HD   LYS  15          2HD       LYS  15   0.592  10.356   3.812
  113   1HE   LYS  15          1HE       LYS  15  -1.011   9.453   2.289
  114   2HE   LYS  15          2HE       LYS  15  -2.343   9.797   3.395
  115   1HZ   LYS  15          1HZ       LYS  15  -1.569  11.411   1.378
  116   2HZ   LYS  15          2HZ       LYS  15  -0.740  12.105   2.689
  117   3HZ   LYS  15          3HZ       LYS  15  -2.429  11.930   2.748
  118    H    PHE  16           H        PHE  16  -0.502   6.239   7.293
  119    HA   PHE  16           HA       PHE  16  -2.818   4.652   6.421
  120   1HB   PHE  16          1HB       PHE  16  -1.355   4.628   9.071
  121   2HB   PHE  16          2HB       PHE  16  -2.795   3.691   8.710
  122    HD1  PHE  16           HD1      PHE  16   0.018   2.726   9.585
  123    HD2  PHE  16           HD2      PHE  16  -1.909   3.060   5.808
  124    HE1  PHE  16           HE1      PHE  16   1.426   0.922   8.713
  125    HE2  PHE  16           HE2      PHE  16  -0.508   1.257   4.924
  126    HZ   PHE  16           HZ       PHE  16   1.176   0.154   6.372
  127    HA   PRO  17           HA       PRO  17  -4.519   4.111   6.706
  128   1HB   PRO  17          1HB       PRO  17  -7.144   4.461   6.420
  129   2HB   PRO  17          2HB       PRO  17  -6.450   4.071   8.001
  130   1HG   PRO  17          1HG       PRO  17  -7.510   6.667   7.005
  131   2HG   PRO  17          2HG       PRO  17  -7.464   6.027   8.655
  132   1HD   PRO  17          1HD       PRO  17  -5.652   7.875   7.461
  133   2HD   PRO  17          2HD       PRO  17  -5.529   7.133   9.068
  134    H    PHE  18           H        PHE  18  -4.981   3.610   4.529
  135    HA   PHE  18           HA       PHE  18  -5.184   5.974   2.792
  136   1HB   PHE  18          1HB       PHE  18  -4.079   4.753   1.027
  137   2HB   PHE  18          2HB       PHE  18  -3.104   4.662   2.483
  138    HD1  PHE  18           HD1      PHE  18  -3.076   2.547   3.809
  139    HD2  PHE  18           HD2      PHE  18  -4.867   2.802  -0.043
  140    HE1  PHE  18           HE1      PHE  18  -2.971   0.109   3.604
  141    HE2  PHE  18           HE2      PHE  18  -4.770   0.354  -0.254
  142    HZ   PHE  18           HZ       PHE  18  -3.814  -1.014   1.565
  143    H    LEU  19           H        LEU  19  -6.675   6.021   1.145
  144    HA   LEU  19           HA       LEU  19  -9.003   4.363   1.580
  145   1HB   LEU  19          1HB       LEU  19  -9.116   6.839   1.317
  146   2HB   LEU  19          2HB       LEU  19  -8.618   6.635  -0.352
  147    HG   LEU  19           HG       LEU  19 -10.677   5.242  -0.708
  148   1HD1  LEU  19          1HD1      LEU  19 -10.867   5.665   2.143
  149   2HD1  LEU  19          2HD1      LEU  19 -11.765   4.561   1.109
  150   3HD1  LEU  19          3HD1      LEU  19 -12.326   6.216   1.313
  151   1HD2  LEU  19          1HD2      LEU  19 -11.422   7.148  -1.568
  152   2HD2  LEU  19          2HD2      LEU  19 -10.387   8.070  -0.486
  153   3HD2  LEU  19          3HD2      LEU  19 -12.011   7.627   0.027
  154    H    PHE  20           H        PHE  20  -9.324   2.543   0.536
  155    HA   PHE  20           HA       PHE  20  -8.371   2.279  -2.238
  156   1HB   PHE  20          1HB       PHE  20  -7.201   0.833  -0.431
  157   2HB   PHE  20          2HB       PHE  20  -8.735  -0.021  -0.346
  158    HD1  PHE  20           HD1      PHE  20  -7.322  -1.956  -0.846
  159    HD2  PHE  20           HD2      PHE  20  -8.012   1.155  -3.659
  160    HE1  PHE  20           HE1      PHE  20  -6.716  -3.501  -2.657
  161    HE2  PHE  20           HE2      PHE  20  -7.409  -0.389  -5.490
  162    HZ   PHE  20           HZ       PHE  20  -6.768  -2.711  -4.997
  163    H    ASN  21           H        ASN  21 -10.215   2.596  -3.367
  164    HA   ASN  21           HA       ASN  21 -12.330   2.361  -4.161
  165   1HB   ASN  21          1HB       ASN  21 -11.825  -0.393  -3.055
  166   2HB   ASN  21          2HB       ASN  21 -13.326   0.016  -3.875
  167   1HD2  ASN  21          1HD2      ASN  21 -11.252   1.948  -5.377
  168   2HD2  ASN  21          2HD2      ASN  21 -10.715   0.911  -6.657
  169    H    GLY  22           H        GLY  22 -12.122   3.524  -1.518
  170   1HA   GLY  22          1HA       GLY  22 -13.911   4.434  -0.286
  171   2HA   GLY  22          2HA       GLY  22 -14.892   3.047  -0.705
  172    H    LYS  23           H        LYS  23 -12.008   1.809   0.267
  173    HA   LYS  23           HA       LYS  23 -12.925   1.639   3.061
  174   1HB   LYS  23          1HB       LYS  23 -13.092  -0.520   1.792
  175   2HB   LYS  23          2HB       LYS  23 -11.352  -0.464   1.549
  176   1HG   LYS  23          1HG       LYS  23 -11.016  -0.567   3.979
  177   2HG   LYS  23          2HG       LYS  23 -12.757  -0.645   4.213
  178   1HD   LYS  23          1HD       LYS  23 -11.423  -2.655   2.461
  179   2HD   LYS  23          2HD       LYS  23 -11.295  -2.814   4.214
  180   1HE   LYS  23          1HE       LYS  23 -13.153  -4.104   3.530
  181   2HE   LYS  23          2HE       LYS  23 -13.786  -2.659   4.315
  182   1HZ   LYS  23          1HZ       LYS  23 -13.515  -2.933   1.368
  183   2HZ   LYS  23          2HZ       LYS  23 -14.367  -1.731   2.218
  184   3HZ   LYS  23          3HZ       LYS  23 -14.930  -3.332   2.208
  185    H    GLU  24           H        GLU  24 -11.530   2.219   4.620
  186    HA   GLU  24           HA       GLU  24  -8.891   3.162   3.780
  187   1HB   GLU  24          1HB       GLU  24 -10.269   3.462   6.450
  188   2HB   GLU  24          2HB       GLU  24  -8.799   4.275   5.939
  189   1HG   GLU  24          1HG       GLU  24 -10.066   5.438   4.202
  190   2HG   GLU  24          2HG       GLU  24 -11.535   4.636   4.752
  191    H    TYR  25           H        TYR  25  -6.992   2.294   4.492
  192    HA   TYR  25           HA       TYR  25  -7.175  -0.033   6.287
  193   1HB   TYR  25          1HB       TYR  25  -5.313   0.352   3.962
  194   2HB   TYR  25          2HB       TYR  25  -5.223  -0.985   5.087
  195    HD1  TYR  25           HD1      TYR  25  -7.411   0.610   2.554
  196    HD2  TYR  25           HD2      TYR  25  -6.508  -2.911   4.760
  197    HE1  TYR  25           HE1      TYR  25  -8.986  -0.663   1.141
  198    HE2  TYR  25           HE2      TYR  25  -8.072  -4.199   3.345
  199    HH   TYR  25           HH       TYR  25  -9.781  -2.687   0.623
  200    H    ASN  26           H        ASN  26  -6.019   0.077   8.060
  201    HA   ASN  26           HA       ASN  26  -4.002   2.193   8.318
  202   1HB   ASN  26          1HB       ASN  26  -5.582   0.590  10.319
  203   2HB   ASN  26          2HB       ASN  26  -4.147   1.487  10.798
  204   1HD2  ASN  26          1HD2      ASN  26  -7.452   1.635  10.319
  205   2HD2  ASN  26          2HD2      ASN  26  -7.644   3.352  10.365
  206    H    SER  27           H        SER  27  -3.891  -0.610   7.065
  207    HA   SER  27           HA       SER  27  -1.208  -1.189   7.880
  208   1HB   SER  27          1HB       SER  27  -1.756  -3.620   8.414
  209   2HB   SER  27          2HB       SER  27  -2.236  -2.440   9.641
  210    HG   SER  27           HG       SER  27  -3.946  -3.843   9.285
  211    H    CYS  28           H        CYS  28  -0.317  -3.034   6.595
  212    HA   CYS  28           HA       CYS  28  -0.888  -2.689   3.862
  213   1HB   CYS  28          1HB       CYS  28   0.529  -5.050   5.103
  214   2HB   CYS  28          2HB       CYS  28   0.738  -4.409   3.476
  215    H    THR  29           H        THR  29  -2.156  -3.818   2.437
  216    HA   THR  29           HA       THR  29  -3.610  -6.130   3.486
  217    HB   THR  29           HB       THR  29  -5.039  -4.094   3.375
  218    HG1  THR  29           HG1      THR  29  -6.153  -5.952   3.182
  219   1HG2  THR  29          1HG2      THR  29  -4.572  -4.264   0.397
  220   2HG2  THR  29          2HG2      THR  29  -4.169  -2.918   1.460
  221   3HG2  THR  29          3HG2      THR  29  -5.855  -3.334   1.166
  222    H    ASP  30           H        ASP  30  -4.508  -7.540   1.704
  223    HA   ASP  30           HA       ASP  30  -2.550  -7.688  -0.466
  224   1HB   ASP  30          1HB       ASP  30  -4.230 -10.003  -0.247
  225   2HB   ASP  30          2HB       ASP  30  -2.496  -9.919  -0.278
  226    H    THR  31           H        THR  31  -5.419  -6.481   0.105
  227    HA   THR  31           HA       THR  31  -7.158  -7.488  -1.847
  228    HB   THR  31           HB       THR  31  -7.013  -4.657  -0.821
  229    HG1  THR  31           HG1      THR  31  -7.169  -5.702   1.028
  230   1HG2  THR  31          1HG2      THR  31  -9.496  -6.205  -1.457
  231   2HG2  THR  31          2HG2      THR  31  -8.678  -5.198  -2.651
  232   3HG2  THR  31          3HG2      THR  31  -9.317  -4.475  -1.177
  233    H    GLY  32           H        GLY  32  -7.561  -6.854  -3.991
  234   1HA   GLY  32          1HA       GLY  32  -7.212  -5.664  -5.972
  235   2HA   GLY  32          2HA       GLY  32  -5.933  -4.760  -5.178
  236    H    ARG  33           H        ARG  33  -4.955  -7.508  -4.217
  237    HA   ARG  33           HA       ARG  33  -3.338  -8.052  -6.601
  238   1HB   ARG  33          1HB       ARG  33  -2.869  -9.049  -3.785
  239   2HB   ARG  33          2HB       ARG  33  -1.732  -9.047  -5.123
  240   1HG   ARG  33          1HG       ARG  33  -2.829  -6.556  -3.842
  241   2HG   ARG  33          2HG       ARG  33  -1.301  -7.316  -3.391
  242   1HD   ARG  33          1HD       ARG  33  -2.001  -6.278  -6.140
  243   2HD   ARG  33          2HD       ARG  33  -1.004  -5.436  -4.953
  244    HE   ARG  33           HE       ARG  33   0.039  -8.028  -5.465
  245   1HH1  ARG  33          1HH1      ARG  33  -0.198  -4.798  -6.805
  246   2HH1  ARG  33          2HH1      ARG  33   1.184  -4.988  -7.839
  247   1HH2  ARG  33          1HH2      ARG  33   1.893  -8.268  -6.809
  248   2HH2  ARG  33          2HH2      ARG  33   2.385  -6.942  -7.820
  249    H    SER  34           H        SER  34  -2.679 -10.472  -6.719
  250    HA   SER  34           HA       SER  34  -5.076 -12.108  -6.209
  251   1HB   SER  34          1HB       SER  34  -3.207 -12.318  -8.585
  252   2HB   SER  34          2HB       SER  34  -4.614 -13.341  -8.277
  253    HG   SER  34           HG       SER  34  -5.933 -11.734  -8.806
  254    H    ASP  35           H        ASP  35  -1.714 -11.741  -5.820
  255    HA   ASP  35           HA       ASP  35  -1.340 -14.537  -5.142
  256   1HB   ASP  35          1HB       ASP  35   0.456 -12.329  -5.840
  257   2HB   ASP  35          2HB       ASP  35   1.094 -13.580  -4.801
  258    H    GLY  36           H        GLY  36  -2.641 -12.202  -3.573
  259   1HA   GLY  36          1HA       GLY  36  -2.920 -11.657  -1.366
  260   2HA   GLY  36          2HA       GLY  36  -2.209 -13.219  -1.014
  261    H    PHE  37           H        PHE  37  -0.745 -10.346  -2.538
  262    HA   PHE  37           HA       PHE  37   1.370 -10.484  -0.525
  263   1HB   PHE  37          1HB       PHE  37   1.194  -9.217  -3.235
  264   2HB   PHE  37          2HB       PHE  37   2.396  -8.653  -2.078
  265    HD1  PHE  37           HD1      PHE  37   3.804  -9.405  -4.157
  266    HD2  PHE  37           HD2      PHE  37   1.804 -12.070  -1.511
  267    HE1  PHE  37           HE1      PHE  37   5.302 -11.221  -4.860
  268    HE2  PHE  37           HE2      PHE  37   3.303 -13.892  -2.213
  269    HZ   PHE  37           HZ       PHE  37   5.051 -13.467  -3.887
  270    H    LEU  38           H        LEU  38   1.696  -8.985   0.986
  271    HA   LEU  38           HA       LEU  38  -0.375  -7.035   1.387
  272   1HB   LEU  38          1HB       LEU  38   2.091  -7.631   2.978
  273   2HB   LEU  38          2HB       LEU  38   0.883  -6.472   3.457
  274    HG   LEU  38           HG       LEU  38  -0.758  -8.492   3.315
  275   1HD1  LEU  38          1HD1      LEU  38   0.137 -10.627   3.644
  276   2HD1  LEU  38          2HD1      LEU  38   1.767 -10.004   3.900
  277   3HD1  LEU  38          3HD1      LEU  38   1.043  -9.942   2.293
  278   1HD2  LEU  38          1HD2      LEU  38   0.924  -8.933   5.645
  279   2HD2  LEU  38          2HD2      LEU  38  -0.742  -8.370   5.532
  280   3HD2  LEU  38          3HD2      LEU  38   0.586  -7.226   5.343
  281    H    TRP  39           H        TRP  39  -0.388  -5.045   0.668
  282    HA   TRP  39           HA       TRP  39   2.180  -3.691   0.233
  283   1HB   TRP  39          1HB       TRP  39   1.299  -2.649  -1.809
  284   2HB   TRP  39          2HB       TRP  39   1.332  -4.398  -1.953
  285    HD1  TRP  39           HD1      TRP  39  -1.068  -5.689  -1.890
  286    HE1  TRP  39           HE1      TRP  39  -3.419  -4.882  -2.508
  287    HE3  TRP  39           HE3      TRP  39  -0.284  -0.634  -1.752
  288    HZ2  TRP  39           HZ2      TRP  39  -4.762  -2.446  -2.890
  289    HZ3  TRP  39           HZ3      TRP  39  -2.175   0.862  -2.255
  290    HH2  TRP  39           HH2      TRP  39  -4.366  -0.038  -2.809
  291    H    CYS  40           H        CYS  40   1.769  -1.255  -0.116
  292    HA   CYS  40           HA       CYS  40  -0.494  -0.265   1.451
  293   1HB   CYS  40          1HB       CYS  40   0.928   1.016   2.929
  294   2HB   CYS  40          2HB       CYS  40   1.448  -0.664   2.992
  295    H    SER  41           H        SER  41  -0.580   2.185   1.302
  296    HA   SER  41           HA       SER  41   0.564   3.043  -1.272
  297   1HB   SER  41          1HB       SER  41  -1.959   2.745  -1.201
  298   2HB   SER  41          2HB       SER  41  -2.004   4.086  -0.058
  299    HG   SER  41           HG       SER  41  -0.687   4.380  -2.532
  300    H    THR  42           H        THR  42   0.868   5.403  -1.443
  301    HA   THR  42           HA       THR  42   1.918   6.456   1.089
  302    HB   THR  42           HB       THR  42   2.523   7.370  -1.735
  303    HG1  THR  42           HG1      THR  42   4.285   5.841  -0.157
  304   1HG2  THR  42          1HG2      THR  42   4.357   7.748   0.573
  305   2HG2  THR  42          2HG2      THR  42   3.004   8.857   0.358
  306   3HG2  THR  42          3HG2      THR  42   4.211   8.676  -0.917
  307    H    THR  43           H        THR  43  -0.200   7.131  -1.598
  308    HA   THR  43           HA       THR  43  -0.853   9.783  -0.604
  309    HB   THR  43           HB       THR  43  -2.340   9.846  -2.615
  310    HG1  THR  43           HG1      THR  43  -2.851   8.041  -3.525
  311   1HG2  THR  43          1HG2      THR  43   0.465   8.941  -3.240
  312   2HG2  THR  43          2HG2      THR  43  -0.043  10.597  -2.903
  313   3HG2  THR  43          3HG2      THR  43  -0.630   9.769  -4.345
  314    H    TYR  44           H        TYR  44  -3.177  10.340  -0.190
  315    HA   TYR  44           HA       TYR  44  -4.326   8.461   1.596
  316   1HB   TYR  44          1HB       TYR  44  -4.751  10.832   1.929
  317   2HB   TYR  44          2HB       TYR  44  -5.547  10.941   0.357
  318    HD1  TYR  44           HD1      TYR  44  -5.819   8.757   3.405
  319    HD2  TYR  44           HD2      TYR  44  -7.871  11.075   0.478
  320    HE1  TYR  44           HE1      TYR  44  -7.968   8.183   4.461
  321    HE2  TYR  44           HE2      TYR  44 -10.021  10.506   1.532
  322    HH   TYR  44           HH       TYR  44 -10.186   8.297   4.326
  323    H    ASN  45           H        ASN  45  -5.549   9.720  -1.507
  324    HA   ASN  45           HA       ASN  45  -7.280   7.396  -1.688
  325   1HB   ASN  45          1HB       ASN  45  -8.029   9.758  -2.301
  326   2HB   ASN  45          2HB       ASN  45  -7.018   9.619  -3.721
  327   1HD2  ASN  45          1HD2      ASN  45  -7.860   6.648  -3.779
  328   2HD2  ASN  45          2HD2      ASN  45  -9.397   6.783  -4.474
  329    H    PHE  46           H        PHE  46  -6.172   5.609  -2.270
  330    HA   PHE  46           HA       PHE  46  -3.915   5.630  -4.015
  331   1HB   PHE  46          1HB       PHE  46  -4.045   3.882  -2.385
  332   2HB   PHE  46          2HB       PHE  46  -5.652   3.381  -2.961
  333    HD1  PHE  46           HD1      PHE  46  -5.858   1.950  -4.887
  334    HD2  PHE  46           HD2      PHE  46  -2.025   3.389  -3.714
  335    HE1  PHE  46           HE1      PHE  46  -4.798   0.371  -6.434
  336    HE2  PHE  46           HE2      PHE  46  -0.966   1.805  -5.263
  337    HZ   PHE  46           HZ       PHE  46  -2.346   0.298  -6.627
  338    H    GLU  47           H        GLU  47  -7.326   5.025  -4.417
  339    HA   GLU  47           HA       GLU  47  -7.389   3.926  -6.975
  340   1HB   GLU  47          1HB       GLU  47  -9.256   4.295  -5.245
  341   2HB   GLU  47          2HB       GLU  47  -9.395   5.905  -5.917
  342   1HG   GLU  47          1HG       GLU  47  -9.908   4.941  -8.105
  343   2HG   GLU  47          2HG       GLU  47  -9.810   3.325  -7.402
  344    H    LYS  48           H        LYS  48  -7.169   7.275  -5.927
  345    HA   LYS  48           HA       LYS  48  -7.478   8.339  -8.565
  346   1HB   LYS  48          1HB       LYS  48  -8.222   9.509  -6.483
  347   2HB   LYS  48          2HB       LYS  48  -6.537   9.745  -6.057
  348   1HG   LYS  48          1HG       LYS  48  -7.271  11.783  -6.959
  349   2HG   LYS  48          2HG       LYS  48  -6.292  11.042  -8.223
  350   1HD   LYS  48          1HD       LYS  48  -9.286  10.735  -8.138
  351   2HD   LYS  48          2HD       LYS  48  -8.513  12.125  -8.900
  352   1HE   LYS  48          1HE       LYS  48  -7.390  10.720 -10.481
  353   2HE   LYS  48          2HE       LYS  48  -7.904   9.264  -9.632
  354   1HZ   LYS  48          1HZ       LYS  48  -9.631  11.164 -11.135
  355   2HZ   LYS  48          2HZ       LYS  48 -10.229   9.901 -10.163
  356   3HZ   LYS  48          3HZ       LYS  48  -9.287   9.543 -11.531
  357    H    ASP  49           H        ASP  49  -4.712   8.000  -6.312
  358    HA   ASP  49           HA       ASP  49  -2.939   9.052  -8.364
  359   1HB   ASP  49          1HB       ASP  49  -2.561   8.405  -5.449
  360   2HB   ASP  49          2HB       ASP  49  -1.190   8.771  -6.493
  361    H    GLY  50           H        GLY  50  -2.671   6.213  -6.200
  362   1HA   GLY  50          1HA       GLY  50  -2.459   3.993  -7.075
  363   2HA   GLY  50          2HA       GLY  50  -1.811   4.690  -8.544
  364    H    LYS  51           H        LYS  51  -0.432   6.088  -5.743
  365    HA   LYS  51           HA       LYS  51   2.086   4.808  -6.321
  366   1HB   LYS  51          1HB       LYS  51   1.199   6.962  -4.446
  367   2HB   LYS  51          2HB       LYS  51   2.742   6.170  -4.172
  368   1HG   LYS  51          1HG       LYS  51   3.167   8.121  -5.403
  369   2HG   LYS  51          2HG       LYS  51   3.347   6.772  -6.521
  370   1HD   LYS  51          1HD       LYS  51   1.141   7.227  -7.434
  371   2HD   LYS  51          2HD       LYS  51   0.925   8.550  -6.282
  372   1HE   LYS  51          1HE       LYS  51   2.996   9.597  -7.268
  373   2HE   LYS  51          2HE       LYS  51   2.939   8.359  -8.520
  374   1HZ   LYS  51          1HZ       LYS  51   1.894  10.242  -9.416
  375   2HZ   LYS  51          2HZ       LYS  51   0.990  10.530  -8.007
  376   3HZ   LYS  51          3HZ       LYS  51   0.613   9.206  -8.997
  377    H    TYR  52           H        TYR  52   2.506   2.816  -5.569
  378    HA   TYR  52           HA       TYR  52   1.765   2.208  -2.799
  379   1HB   TYR  52          1HB       TYR  52   0.892   0.068  -3.372
  380   2HB   TYR  52          2HB       TYR  52   0.128   1.204  -4.476
  381    HD1  TYR  52           HD1      TYR  52   2.321  -1.651  -4.150
  382    HD2  TYR  52           HD2      TYR  52   0.877   1.293  -6.857
  383    HE1  TYR  52           HE1      TYR  52   3.154  -2.987  -6.029
  384    HE2  TYR  52           HE2      TYR  52   1.701  -0.038  -8.749
  385    HH   TYR  52           HH       TYR  52   2.997  -1.790  -9.351
  386    H    GLY  53           H        GLY  53   2.874   0.258  -2.010
  387   1HA   GLY  53          1HA       GLY  53   5.270  -0.605  -3.347
  388   2HA   GLY  53          2HA       GLY  53   5.553   0.387  -1.931
  389    H    PHE  54           H        PHE  54   6.347  -2.336  -2.158
  390    HA   PHE  54           HA       PHE  54   4.381  -3.823  -0.634
  391   1HB   PHE  54          1HB       PHE  54   7.079  -4.604  -1.710
  392   2HB   PHE  54          2HB       PHE  54   6.029  -5.690  -0.807
  393    HD1  PHE  54           HD1      PHE  54   3.501  -5.647  -1.736
  394    HD2  PHE  54           HD2      PHE  54   6.997  -4.790  -4.005
  395    HE1  PHE  54           HE1      PHE  54   2.287  -6.204  -3.804
  396    HE2  PHE  54           HE2      PHE  54   5.797  -5.344  -6.075
  397    HZ   PHE  54           HZ       PHE  54   3.437  -6.060  -5.977
  398    H    CYS  55           H        CYS  55   4.493  -4.331   1.442
  399    HA   CYS  55           HA       CYS  55   6.095  -2.713   3.128
  400   1HB   CYS  55          1HB       CYS  55   4.301  -5.009   3.909
  401   2HB   CYS  55          2HB       CYS  55   4.864  -3.697   4.947
  402    HA   PRO  56           HA       PRO  56   8.126  -6.988   4.447
  403   1HB   PRO  56          1HB       PRO  56   8.484  -8.657   2.297
  404   2HB   PRO  56          2HB       PRO  56   7.235  -8.860   3.524
  405   1HG   PRO  56          1HG       PRO  56   7.035  -7.637   0.803
  406   2HG   PRO  56          2HG       PRO  56   5.885  -8.694   1.645
  407   1HD   PRO  56          1HD       PRO  56   5.480  -6.058   1.493
  408   2HD   PRO  56          2HD       PRO  56   5.066  -6.965   2.963
  409    H    HIS  57           H        HIS  57  10.064  -6.026   4.650
  410    HA   HIS  57           HA       HIS  57  11.415  -4.860   2.425
  411   1HB   HIS  57          1HB       HIS  57  13.319  -4.598   4.139
  412   2HB   HIS  57          2HB       HIS  57  11.826  -3.717   4.420
  413    HD1  HIS  57           HD1      HIS  57  13.287  -7.087   5.480
  414    HD2  HIS  57           HD2      HIS  57  11.002  -3.949   6.978
  415    HE1  HIS  57           HE1      HIS  57  12.818  -7.677   7.880
  416    H    GLU  58           H        GLU  58  11.487  -7.981   3.904
  417    HA   GLU  58           HA       GLU  58  13.726  -8.687   2.143
  418   1HB   GLU  58          1HB       GLU  58  14.175 -10.570   3.753
  419   2HB   GLU  58          2HB       GLU  58  14.552  -8.968   4.339
  420   1HG   GLU  58          1HG       GLU  58  12.439  -8.990   5.626
  421   2HG   GLU  58          2HG       GLU  58  12.153 -10.641   5.072
  422    H    ALA  59           H        ALA  59  12.579  -9.332   0.383
  423    HA   ALA  59           HA       ALA  59  10.691 -11.555   0.784
  424   1HB   ALA  59          1HB       ALA  59   9.314 -10.773  -0.888
  425   2HB   ALA  59          2HB       ALA  59  10.605  -9.872  -1.679
  426   3HB   ALA  59          3HB       ALA  59   9.893  -9.261  -0.187
  Start of MODEL   33
    1   1H    ARG   1          1H        ARG   1  13.017   6.339   7.414
    2   2H    ARG   1          2H        ARG   1  12.098   7.236   8.549
    3   3H    ARG   1          3H        ARG   1  12.062   7.663   6.879
    4    HA   ARG   1           HA       ARG   1  11.010   5.204   8.117
    5   1HB   ARG   1          1HB       ARG   1   9.831   7.449   8.364
    6   2HB   ARG   1          2HB       ARG   1   9.647   7.442   6.621
    7   1HG   ARG   1          1HG       ARG   1   8.227   5.519   6.710
    8   2HG   ARG   1          2HG       ARG   1   8.560   5.303   8.432
    9   1HD   ARG   1          1HD       ARG   1   7.417   7.300   9.009
   10   2HD   ARG   1          2HD       ARG   1   7.321   7.810   7.327
   11    HE   ARG   1           HE       ARG   1   5.909   5.355   7.738
   12   1HH1  ARG   1          1HH1      ARG   1   5.756   8.805   8.347
   13   2HH1  ARG   1          2HH1      ARG   1   4.021   8.878   8.272
   14   1HH2  ARG   1          1HH2      ARG   1   3.619   5.454   7.619
   15   2HH2  ARG   1          2HH2      ARG   1   2.805   6.972   7.845
   16    H    ILE   2           H        ILE   2  11.241   3.511   6.779
   17    HA   ILE   2           HA       ILE   2  10.796   3.884   3.932
   18    HB   ILE   2           HB       ILE   2  13.226   4.166   4.190
   19   1HG1  ILE   2          1HG1      ILE   2  13.928   2.441   2.527
   20   2HG1  ILE   2          2HG1      ILE   2  12.392   1.623   2.791
   21   1HG2  ILE   2          1HG2      ILE   2  12.970   1.857   5.889
   22   2HG2  ILE   2          2HG2      ILE   2  14.327   2.977   5.704
   23   3HG2  ILE   2          3HG2      ILE   2  14.180   1.583   4.630
   24   1HD1  ILE   2          1HD1      ILE   2  11.958   4.393   2.165
   25   2HD1  ILE   2          2HD1      ILE   2  11.373   2.946   1.339
   26   3HD1  ILE   2          3HD1      ILE   2  12.953   3.617   0.937
   27    HA   PRO   3           HA       PRO   3   9.163  -0.145   5.636
   28   1HB   PRO   3          1HB       PRO   3   6.487   0.903   5.727
   29   2HB   PRO   3          2HB       PRO   3   7.510   0.420   7.083
   30   1HG   PRO   3          1HG       PRO   3   6.756   3.006   6.638
   31   2HG   PRO   3          2HG       PRO   3   8.266   2.557   7.452
   32   1HD   PRO   3          1HD       PRO   3   7.844   3.278   4.549
   33   2HD   PRO   3          2HD       PRO   3   9.080   3.886   5.682
   34    H    VAL   4           H        VAL   4   9.462   1.075   2.887
   35    HA   VAL   4           HA       VAL   4   7.344  -0.515   1.582
   36    HB   VAL   4           HB       VAL   4   8.523   2.083   0.503
   37   1HG1  VAL   4          1HG1      VAL   4   6.952   1.897  -1.291
   38   2HG1  VAL   4          2HG1      VAL   4   6.209   0.470  -0.567
   39   3HG1  VAL   4          3HG1      VAL   4   7.852   0.379  -1.197
   40   1HG2  VAL   4          1HG2      VAL   4   5.970   1.482   1.960
   41   2HG2  VAL   4          2HG2      VAL   4   6.025   2.772   0.761
   42   3HG2  VAL   4          3HG2      VAL   4   7.091   2.832   2.160
   43    H    LYS   5           H        LYS   5   7.963  -1.745  -0.158
   44    HA   LYS   5           HA       LYS   5  10.862  -2.075  -0.441
   45   1HB   LYS   5          1HB       LYS   5   8.558  -3.904  -0.400
   46   2HB   LYS   5          2HB       LYS   5   9.765  -4.279  -1.621
   47   1HG   LYS   5          1HG       LYS   5  10.300  -3.971   1.326
   48   2HG   LYS   5          2HG       LYS   5  10.126  -5.506   0.457
   49   1HD   LYS   5          1HD       LYS   5  12.083  -5.062  -0.857
   50   2HD   LYS   5          2HD       LYS   5  12.216  -3.432  -0.185
   51   1HE   LYS   5          1HE       LYS   5  12.691  -4.323   2.000
   52   2HE   LYS   5          2HE       LYS   5  12.403  -5.968   1.438
   53   1HZ   LYS   5          1HZ       LYS   5  14.810  -5.048   1.619
   54   2HZ   LYS   5          2HZ       LYS   5  14.464  -4.328   0.121
   55   3HZ   LYS   5          3HZ       LYS   5  14.374  -6.024   0.292
   56    H    TYR   6           H        TYR   6   8.518  -3.340  -2.684
   57    HA   TYR   6           HA       TYR   6   9.901  -1.928  -4.840
   58   1HB   TYR   6          1HB       TYR   6   7.969  -4.234  -5.144
   59   2HB   TYR   6          2HB       TYR   6   9.189  -3.678  -6.288
   60    HD1  TYR   6           HD1      TYR   6  11.698  -3.721  -5.273
   61    HD2  TYR   6           HD2      TYR   6   8.472  -6.160  -3.935
   62    HE1  TYR   6           HE1      TYR   6  13.298  -5.321  -4.325
   63    HE2  TYR   6           HE2      TYR   6  10.069  -7.763  -2.988
   64    HH   TYR   6           HH       TYR   6  12.360  -7.821  -2.197
   65    H    GLY   7           H        GLY   7   8.521  -1.386  -6.766
   66   1HA   GLY   7          1HA       GLY   7   6.244  -0.872  -7.512
   67   2HA   GLY   7          2HA       GLY   7   5.930  -0.223  -5.913
   68    H    ASN   8           H        ASN   8   5.320   1.759  -6.964
   69    HA   ASN   8           HA       ASN   8   7.593   3.221  -8.111
   70   1HB   ASN   8          1HB       ASN   8   6.018   4.681  -9.223
   71   2HB   ASN   8          2HB       ASN   8   5.642   3.003  -9.586
   72   1HD2  ASN   8          1HD2      ASN   8   3.964   5.336  -9.788
   73   2HD2  ASN   8          2HD2      ASN   8   2.599   5.054  -8.766
   74    H    ALA   9           H        ALA   9   6.371   2.902  -5.199
   75    HA   ALA   9           HA       ALA   9   6.209   5.704  -4.450
   76   1HB   ALA   9          1HB       ALA   9   6.091   3.327  -2.611
   77   2HB   ALA   9          2HB       ALA   9   4.682   3.919  -3.499
   78   3HB   ALA   9          3HB       ALA   9   5.486   4.959  -2.320
   79    H    ASP  10           H        ASP  10   8.600   5.691  -5.343
   80    HA   ASP  10           HA       ASP  10  10.564   4.605  -3.552
   81   1HB   ASP  10          1HB       ASP  10  12.203   5.898  -4.954
   82   2HB   ASP  10          2HB       ASP  10  11.202   4.758  -5.843
   83    H    GLY  11           H        GLY  11  11.316   5.457  -1.754
   84   1HA   GLY  11          1HA       GLY  11  12.021   7.091  -0.251
   85   2HA   GLY  11          2HA       GLY  11  11.491   8.323  -1.386
   86    H    GLU  12           H        GLU  12   8.873   6.689  -1.469
   87    HA   GLU  12           HA       GLU  12   7.546   8.241   0.558
   88   1HB   GLU  12          1HB       GLU  12   6.575   6.423  -1.641
   89   2HB   GLU  12          2HB       GLU  12   5.479   7.159  -0.477
   90   1HG   GLU  12          1HG       GLU  12   6.056   9.345  -1.190
   91   2HG   GLU  12          2HG       GLU  12   7.385   8.748  -2.157
   92    H    TYR  13           H        TYR  13   5.993   7.308   2.046
   93    HA   TYR  13           HA       TYR  13   6.840   4.697   3.035
   94   1HB   TYR  13          1HB       TYR  13   6.230   5.658   5.264
   95   2HB   TYR  13          2HB       TYR  13   7.670   6.304   4.476
   96    HD1  TYR  13           HD1      TYR  13   3.999   7.008   4.491
   97    HD2  TYR  13           HD2      TYR  13   7.962   8.526   4.674
   98    HE1  TYR  13           HE1      TYR  13   3.101   9.290   4.747
   99    HE2  TYR  13           HE2      TYR  13   7.083  10.817   4.931
  100    HH   TYR  13           HH       TYR  13   4.764  11.806   5.870
  101    H    CYS  14           H        CYS  14   5.115   3.622   4.493
  102    HA   CYS  14           HA       CYS  14   2.697   3.445   3.001
  103   1HB   CYS  14          1HB       CYS  14   3.645   2.196   5.567
  104   2HB   CYS  14          2HB       CYS  14   1.997   1.964   4.995
  105    H    LYS  15           H        LYS  15   1.033   4.770   3.138
  106    HA   LYS  15           HA       LYS  15   0.761   6.547   5.416
  107   1HB   LYS  15          1HB       LYS  15   0.421   7.029   2.823
  108   2HB   LYS  15          2HB       LYS  15  -1.212   6.487   3.176
  109   1HG   LYS  15          1HG       LYS  15   0.173   8.707   4.669
  110   2HG   LYS  15          2HG       LYS  15  -0.885   8.957   3.280
  111   1HD   LYS  15          1HD       LYS  15  -2.735   7.925   4.487
  112   2HD   LYS  15          2HD       LYS  15  -1.679   7.624   5.868
  113   1HE   LYS  15          1HE       LYS  15  -1.367  10.004   6.188
  114   2HE   LYS  15          2HE       LYS  15  -2.328  10.350   4.751
  115   1HZ   LYS  15          1HZ       LYS  15  -3.866  10.639   6.396
  116   2HZ   LYS  15          2HZ       LYS  15  -3.205   9.447   7.406
  117   3HZ   LYS  15          3HZ       LYS  15  -4.123   8.995   6.050
  118    H    PHE  16           H        PHE  16  -0.276   5.826   7.144
  119    HA   PHE  16           HA       PHE  16  -2.614   4.075   6.752
  120   1HB   PHE  16          1HB       PHE  16  -0.732   4.231   9.117
  121   2HB   PHE  16          2HB       PHE  16  -2.158   3.204   9.026
  122    HD1  PHE  16           HD1      PHE  16  -2.002   2.034   6.388
  123    HD2  PHE  16           HD2      PHE  16   1.104   2.888   9.163
  124    HE1  PHE  16           HE1      PHE  16  -0.639   0.249   5.402
  125    HE2  PHE  16           HE2      PHE  16   2.483   1.108   8.189
  126    HZ   PHE  16           HZ       PHE  16   1.621  -0.247   6.301
  127    HA   PRO  17           HA       PRO  17  -4.342   3.783   6.970
  128   1HB   PRO  17          1HB       PRO  17  -6.936   4.550   6.722
  129   2HB   PRO  17          2HB       PRO  17  -6.294   3.736   8.149
  130   1HG   PRO  17          1HG       PRO  17  -7.173   6.512   7.859
  131   2HG   PRO  17          2HG       PRO  17  -6.863   5.583   9.333
  132   1HD   PRO  17          1HD       PRO  17  -5.166   7.528   8.019
  133   2HD   PRO  17          2HD       PRO  17  -4.927   6.723   9.580
  134    H    PHE  18           H        PHE  18  -5.231   3.460   4.839
  135    HA   PHE  18           HA       PHE  18  -5.192   5.892   3.188
  136   1HB   PHE  18          1HB       PHE  18  -4.065   4.772   1.379
  137   2HB   PHE  18          2HB       PHE  18  -3.096   4.603   2.836
  138    HD1  PHE  18           HD1      PHE  18  -3.195   2.386   4.081
  139    HD2  PHE  18           HD2      PHE  18  -4.724   2.929   0.147
  140    HE1  PHE  18           HE1      PHE  18  -3.086  -0.043   3.702
  141    HE2  PHE  18           HE2      PHE  18  -4.626   0.506  -0.243
  142    HZ   PHE  18           HZ       PHE  18  -3.809  -1.006   1.534
  143    H    LEU  19           H        LEU  19  -6.504   5.875   1.318
  144    HA   LEU  19           HA       LEU  19  -8.913   4.294   1.711
  145   1HB   LEU  19          1HB       LEU  19  -8.971   6.764   1.451
  146   2HB   LEU  19          2HB       LEU  19  -8.398   6.568  -0.197
  147    HG   LEU  19           HG       LEU  19 -10.443   5.204  -0.659
  148   1HD1  LEU  19          1HD1      LEU  19 -11.517   4.460   1.148
  149   2HD1  LEU  19          2HD1      LEU  19 -12.263   6.056   1.177
  150   3HD1  LEU  19          3HD1      LEU  19 -10.856   5.720   2.188
  151   1HD2  LEU  19          1HD2      LEU  19 -11.881   7.499  -0.120
  152   2HD2  LEU  19          2HD2      LEU  19 -10.956   7.155  -1.582
  153   3HD2  LEU  19          3HD2      LEU  19 -10.213   8.056  -0.259
  154    H    PHE  20           H        PHE  20  -9.430   2.592   0.559
  155    HA   PHE  20           HA       PHE  20  -8.384   2.266  -2.184
  156   1HB   PHE  20          1HB       PHE  20  -7.156   0.818  -0.417
  157   2HB   PHE  20          2HB       PHE  20  -8.708   0.015  -0.252
  158    HD1  PHE  20           HD1      PHE  20  -6.965   1.129  -3.364
  159    HD2  PHE  20           HD2      PHE  20  -8.527  -2.050  -1.011
  160    HE1  PHE  20           HE1      PHE  20  -6.485  -0.476  -5.182
  161    HE2  PHE  20           HE2      PHE  20  -8.049  -3.652  -2.807
  162    HZ   PHE  20           HZ       PHE  20  -7.030  -2.855  -4.912
  163    H    ASN  21           H        ASN  21 -10.261   2.517  -3.307
  164    HA   ASN  21           HA       ASN  21 -12.391   2.211  -4.054
  165   1HB   ASN  21          1HB       ASN  21 -11.833  -0.541  -2.947
  166   2HB   ASN  21          2HB       ASN  21 -13.254  -0.147  -3.908
  167   1HD2  ASN  21          1HD2      ASN  21 -13.093  -0.565  -5.962
  168   2HD2  ASN  21          2HD2      ASN  21 -11.634  -0.613  -6.888
  169    H    GLY  22           H        GLY  22 -12.362   3.498  -1.582
  170   1HA   GLY  22          1HA       GLY  22 -14.092   4.236  -0.213
  171   2HA   GLY  22          2HA       GLY  22 -15.036   2.836  -0.671
  172    H    LYS  23           H        LYS  23 -12.032   1.771   0.318
  173    HA   LYS  23           HA       LYS  23 -12.970   1.501   3.101
  174   1HB   LYS  23          1HB       LYS  23 -13.176  -0.637   1.828
  175   2HB   LYS  23          2HB       LYS  23 -11.443  -0.590   1.534
  176   1HG   LYS  23          1HG       LYS  23 -11.047  -0.685   3.963
  177   2HG   LYS  23          2HG       LYS  23 -12.787  -0.796   4.227
  178   1HD   LYS  23          1HD       LYS  23 -12.869  -2.895   3.016
  179   2HD   LYS  23          2HD       LYS  23 -11.149  -2.771   2.637
  180   1HE   LYS  23          1HE       LYS  23 -11.568  -4.302   4.501
  181   2HE   LYS  23          2HE       LYS  23 -10.586  -2.917   4.990
  182   1HZ   LYS  23          1HZ       LYS  23 -12.415  -3.563   6.559
  183   2HZ   LYS  23          2HZ       LYS  23 -13.532  -3.034   5.392
  184   3HZ   LYS  23          3HZ       LYS  23 -12.431  -1.933   6.078
  185    H    GLU  24           H        GLU  24 -11.567   2.099   4.632
  186    HA   GLU  24           HA       GLU  24  -8.891   2.899   3.765
  187   1HB   GLU  24          1HB       GLU  24 -10.331   3.521   6.352
  188   2HB   GLU  24          2HB       GLU  24  -8.800   4.208   5.827
  189   1HG   GLU  24          1HG       GLU  24 -10.010   5.146   3.849
  190   2HG   GLU  24          2HG       GLU  24 -11.512   4.618   4.606
  191    H    TYR  25           H        TYR  25  -7.071   1.964   4.456
  192    HA   TYR  25           HA       TYR  25  -7.335  -0.286   6.338
  193   1HB   TYR  25          1HB       TYR  25  -5.351   0.091   4.110
  194   2HB   TYR  25          2HB       TYR  25  -5.379  -1.280   5.201
  195    HD1  TYR  25           HD1      TYR  25  -7.221   0.446   2.514
  196    HD2  TYR  25           HD2      TYR  25  -6.860  -3.102   4.827
  197    HE1  TYR  25           HE1      TYR  25  -8.768  -0.699   0.981
  198    HE2  TYR  25           HE2      TYR  25  -8.409  -4.266   3.291
  199    HH   TYR  25           HH       TYR  25  -9.761  -4.064   1.516
  200    H    ASN  26           H        ASN  26  -6.194  -0.239   8.139
  201    HA   ASN  26           HA       ASN  26  -4.405   2.024   8.582
  202   1HB   ASN  26          1HB       ASN  26  -5.232  -0.015  10.647
  203   2HB   ASN  26          2HB       ASN  26  -4.691   1.640  10.906
  204   1HD2  ASN  26          1HD2      ASN  26  -6.210   3.173  11.130
  205   2HD2  ASN  26          2HD2      ASN  26  -7.881   2.984  10.745
  206    H    SER  27           H        SER  27  -4.106  -0.950   7.381
  207    HA   SER  27           HA       SER  27  -1.287  -1.067   7.993
  208   1HB   SER  27          1HB       SER  27  -1.414  -3.496   8.634
  209   2HB   SER  27          2HB       SER  27  -2.129  -2.406   9.823
  210    HG   SER  27           HG       SER  27  -4.009  -3.307   9.501
  211    H    CYS  28           H        CYS  28  -0.356  -3.074   6.742
  212    HA   CYS  28           HA       CYS  28  -0.945  -2.706   4.015
  213   1HB   CYS  28          1HB       CYS  28   0.465  -5.069   5.273
  214   2HB   CYS  28          2HB       CYS  28   0.589  -4.536   3.601
  215    H    THR  29           H        THR  29  -2.215  -3.826   2.580
  216    HA   THR  29           HA       THR  29  -3.744  -6.074   3.657
  217    HB   THR  29           HB       THR  29  -5.158  -4.048   3.501
  218    HG1  THR  29           HG1      THR  29  -6.226  -5.967   3.198
  219   1HG2  THR  29          1HG2      THR  29  -5.621  -3.931   0.705
  220   2HG2  THR  29          2HG2      THR  29  -3.903  -3.654   0.988
  221   3HG2  THR  29          3HG2      THR  29  -5.100  -2.645   1.796
  222    H    ASP  30           H        ASP  30  -4.618  -7.527   1.938
  223    HA   ASP  30           HA       ASP  30  -2.674  -7.728  -0.241
  224   1HB   ASP  30          1HB       ASP  30  -4.307 -10.059   0.143
  225   2HB   ASP  30          2HB       ASP  30  -2.578  -9.941   0.011
  226    H    THR  31           H        THR  31  -5.555  -6.536   0.273
  227    HA   THR  31           HA       THR  31  -7.275  -7.704  -1.615
  228    HB   THR  31           HB       THR  31  -7.232  -4.810  -0.780
  229    HG1  THR  31           HG1      THR  31  -7.238  -5.824   1.131
  230   1HG2  THR  31          1HG2      THR  31  -9.671  -4.982  -0.904
  231   2HG2  THR  31          2HG2      THR  31  -9.508  -6.620  -1.536
  232   3HG2  THR  31          3HG2      THR  31  -8.897  -5.253  -2.468
  233    H    GLY  32           H        GLY  32  -7.618  -7.317  -3.762
  234   1HA   GLY  32          1HA       GLY  32  -7.382  -6.221  -5.816
  235   2HA   GLY  32          2HA       GLY  32  -6.131  -5.213  -5.102
  236    H    ARG  33           H        ARG  33  -4.874  -7.700  -3.967
  237    HA   ARG  33           HA       ARG  33  -3.307  -8.379  -6.335
  238   1HB   ARG  33          1HB       ARG  33  -2.825  -9.113  -3.436
  239   2HB   ARG  33          2HB       ARG  33  -1.689  -9.295  -4.760
  240   1HG   ARG  33          1HG       ARG  33  -2.749  -6.656  -3.773
  241   2HG   ARG  33          2HG       ARG  33  -1.208  -7.361  -3.289
  242   1HD   ARG  33          1HD       ARG  33  -2.012  -6.616  -6.101
  243   2HD   ARG  33          2HD       ARG  33  -0.933  -5.690  -5.063
  244    HE   ARG  33           HE       ARG  33  -0.010  -8.370  -5.418
  245   1HH1  ARG  33          1HH1      ARG  33  -0.171  -5.225  -6.958
  246   2HH1  ARG  33          2HH1      ARG  33   1.231  -5.504  -7.950
  247   1HH2  ARG  33          1HH2      ARG  33   1.776  -8.758  -6.793
  248   2HH2  ARG  33          2HH2      ARG  33   2.328  -7.507  -7.865
  249    H    SER  34           H        SER  34  -2.735 -10.690  -6.681
  250    HA   SER  34           HA       SER  34  -5.064 -12.370  -6.048
  251   1HB   SER  34          1HB       SER  34  -3.014 -12.699  -8.248
  252   2HB   SER  34          2HB       SER  34  -4.455 -13.690  -8.014
  253    HG   SER  34           HG       SER  34  -4.507 -11.791  -9.558
  254    H    ASP  35           H        ASP  35  -1.694 -12.070  -5.409
  255    HA   ASP  35           HA       ASP  35  -1.592 -14.838  -4.541
  256   1HB   ASP  35          1HB       ASP  35   0.480 -12.878  -5.278
  257   2HB   ASP  35          2HB       ASP  35   0.902 -14.299  -4.359
  258    H    GLY  36           H        GLY  36  -2.703 -12.356  -3.129
  259   1HA   GLY  36          1HA       GLY  36  -2.915 -11.671  -0.950
  260   2HA   GLY  36          2HA       GLY  36  -2.153 -13.186  -0.512
  261    H    PHE  37           H        PHE  37  -0.873 -10.328  -2.249
  262    HA   PHE  37           HA       PHE  37   1.370 -10.345  -0.366
  263   1HB   PHE  37          1HB       PHE  37   1.034  -9.478  -3.159
  264   2HB   PHE  37          2HB       PHE  37   1.983  -8.378  -2.165
  265    HD1  PHE  37           HD1      PHE  37   3.791  -8.991  -3.848
  266    HD2  PHE  37           HD2      PHE  37   2.151 -11.776  -1.076
  267    HE1  PHE  37           HE1      PHE  37   5.764 -10.436  -4.136
  268    HE2  PHE  37           HE2      PHE  37   4.120 -13.223  -1.358
  269    HZ   PHE  37           HZ       PHE  37   5.931 -12.548  -2.891
  270    H    LEU  38           H        LEU  38   1.694  -8.789   1.090
  271    HA   LEU  38           HA       LEU  38  -0.427  -6.914   1.562
  272   1HB   LEU  38          1HB       LEU  38   2.169  -7.348   2.990
  273   2HB   LEU  38          2HB       LEU  38   0.935  -6.235   3.520
  274    HG   LEU  38           HG       LEU  38  -0.604  -8.319   3.579
  275   1HD1  LEU  38          1HD1      LEU  38   2.066  -9.522   3.141
  276   2HD1  LEU  38          2HD1      LEU  38   0.468 -10.101   2.679
  277   3HD1  LEU  38          3HD1      LEU  38   1.025 -10.287   4.342
  278   1HD2  LEU  38          1HD2      LEU  38  -0.319  -7.534   5.666
  279   2HD2  LEU  38          2HD2      LEU  38   1.424  -7.353   5.477
  280   3HD2  LEU  38          3HD2      LEU  38   0.734  -8.936   5.842
  281    H    TRP  39           H        TRP  39  -0.551  -4.917   0.842
  282    HA   TRP  39           HA       TRP  39   1.934  -3.487   0.218
  283   1HB   TRP  39          1HB       TRP  39   0.977  -2.610  -1.862
  284   2HB   TRP  39          2HB       TRP  39   1.038  -4.365  -1.901
  285    HD1  TRP  39           HD1      TRP  39  -1.343  -5.674  -1.685
  286    HE1  TRP  39           HE1      TRP  39  -3.718  -4.924  -2.280
  287    HE3  TRP  39           HE3      TRP  39  -0.580  -0.621  -1.929
  288    HZ2  TRP  39           HZ2      TRP  39  -5.092  -2.512  -2.780
  289    HZ3  TRP  39           HZ3      TRP  39  -2.487   0.832  -2.478
  290    HH2  TRP  39           HH2      TRP  39  -4.694  -0.102  -2.890
  291    H    CYS  40           H        CYS  40   1.323  -1.072  -0.301
  292    HA   CYS  40           HA       CYS  40  -0.951  -0.095   1.237
  293   1HB   CYS  40          1HB       CYS  40   0.346   1.203   2.780
  294   2HB   CYS  40          2HB       CYS  40   0.968  -0.445   2.857
  295    H    SER  41           H        SER  41  -0.937   2.411   1.128
  296    HA   SER  41           HA       SER  41   0.248   3.263  -1.429
  297   1HB   SER  41          1HB       SER  41  -2.265   3.062  -1.477
  298   2HB   SER  41          2HB       SER  41  -2.333   4.316  -0.239
  299    HG   SER  41           HG       SER  41  -1.049   4.655  -2.754
  300    H    THR  42           H        THR  42   0.484   5.751  -1.488
  301    HA   THR  42           HA       THR  42   1.387   6.665   1.173
  302    HB   THR  42           HB       THR  42   2.654   7.239  -1.515
  303    HG1  THR  42           HG1      THR  42   3.574   5.637   0.640
  304   1HG2  THR  42          1HG2      THR  42   4.305   8.463  -0.524
  305   2HG2  THR  42          2HG2      THR  42   4.036   7.753   1.068
  306   3HG2  THR  42          3HG2      THR  42   2.911   8.954   0.438
  307    H    THR  43           H        THR  43  -0.239   7.482  -1.796
  308    HA   THR  43           HA       THR  43  -0.530  10.275  -1.041
  309    HB   THR  43           HB       THR  43  -1.871  10.317  -3.209
  310    HG1  THR  43           HG1      THR  43  -2.424   8.315  -3.692
  311   1HG2  THR  43          1HG2      THR  43   0.751  10.619  -2.867
  312   2HG2  THR  43          2HG2      THR  43  -0.028  10.680  -4.450
  313   3HG2  THR  43          3HG2      THR  43   0.769   9.198  -3.913
  314    H    TYR  44           H        TYR  44  -1.813   7.956   0.444
  315    HA   TYR  44           HA       TYR  44  -3.697   7.615   1.661
  316   1HB   TYR  44          1HB       TYR  44  -3.722  10.218   1.605
  317   2HB   TYR  44          2HB       TYR  44  -5.025  10.017   0.432
  318    HD1  TYR  44           HD1      TYR  44  -6.765   8.023   1.378
  319    HD2  TYR  44           HD2      TYR  44  -4.461  10.737   3.712
  320    HE1  TYR  44           HE1      TYR  44  -8.356   7.774   3.228
  321    HE2  TYR  44           HE2      TYR  44  -6.053  10.492   5.567
  322    HH   TYR  44           HH       TYR  44  -8.829   8.281   5.331
  323    H    ASN  45           H        ASN  45  -5.133   9.145  -1.216
  324    HA   ASN  45           HA       ASN  45  -6.827   6.819  -1.576
  325   1HB   ASN  45          1HB       ASN  45  -7.614   9.228  -1.865
  326   2HB   ASN  45          2HB       ASN  45  -6.679   9.268  -3.340
  327   1HD2  ASN  45          1HD2      ASN  45  -7.521   6.334  -3.759
  328   2HD2  ASN  45          2HD2      ASN  45  -9.093   6.566  -4.366
  329    H    PHE  46           H        PHE  46  -5.901   5.119  -2.551
  330    HA   PHE  46           HA       PHE  46  -3.577   5.174  -4.082
  331   1HB   PHE  46          1HB       PHE  46  -4.465   3.164  -2.955
  332   2HB   PHE  46          2HB       PHE  46  -5.773   3.085  -4.154
  333    HD1  PHE  46           HD1      PHE  46  -5.139   0.853  -4.894
  334    HD2  PHE  46           HD2      PHE  46  -2.329   4.051  -5.078
  335    HE1  PHE  46           HE1      PHE  46  -3.702  -0.488  -6.359
  336    HE2  PHE  46           HE2      PHE  46  -0.899   2.705  -6.545
  337    HZ   PHE  46           HZ       PHE  46  -1.584   0.435  -7.192
  338    H    GLU  47           H        GLU  47  -6.884   4.597  -5.294
  339    HA   GLU  47           HA       GLU  47  -6.340   4.488  -7.983
  340   1HB   GLU  47          1HB       GLU  47  -8.524   4.099  -6.692
  341   2HB   GLU  47          2HB       GLU  47  -8.821   5.809  -6.925
  342   1HG   GLU  47          1HG       GLU  47  -8.815   5.550  -9.301
  343   2HG   GLU  47          2HG       GLU  47  -8.339   3.858  -9.162
  344    H    LYS  48           H        LYS  48  -6.832   7.343  -6.005
  345    HA   LYS  48           HA       LYS  48  -7.129   9.210  -8.042
  346   1HB   LYS  48          1HB       LYS  48  -7.679   9.958  -5.886
  347   2HB   LYS  48          2HB       LYS  48  -6.159   9.409  -5.201
  348   1HG   LYS  48          1HG       LYS  48  -4.981  11.271  -6.095
  349   2HG   LYS  48          2HG       LYS  48  -6.335  11.753  -7.115
  350   1HD   LYS  48          1HD       LYS  48  -6.390  13.231  -5.302
  351   2HD   LYS  48          2HD       LYS  48  -7.656  12.053  -4.958
  352   1HE   LYS  48          1HE       LYS  48  -6.501  12.404  -2.930
  353   2HE   LYS  48          2HE       LYS  48  -5.965  10.837  -3.532
  354   1HZ   LYS  48          1HZ       LYS  48  -3.897  11.701  -4.171
  355   2HZ   LYS  48          2HZ       LYS  48  -4.202  12.432  -2.666
  356   3HZ   LYS  48          3HZ       LYS  48  -4.437  13.310  -4.098
  357    H    ASP  49           H        ASP  49  -4.103   8.408  -6.296
  358    HA   ASP  49           HA       ASP  49  -2.655   9.780  -8.434
  359   1HB   ASP  49          1HB       ASP  49  -1.881   9.000  -5.637
  360   2HB   ASP  49          2HB       ASP  49  -0.693   9.554  -6.814
  361    H    GLY  50           H        GLY  50  -2.192   6.794  -6.509
  362   1HA   GLY  50          1HA       GLY  50  -2.028   4.696  -7.751
  363   2HA   GLY  50          2HA       GLY  50  -1.161   5.593  -8.977
  364    H    LYS  51           H        LYS  51  -0.179   6.499  -5.850
  365    HA   LYS  51           HA       LYS  51   2.349   5.160  -6.247
  366   1HB   LYS  51          1HB       LYS  51   1.354   7.148  -4.231
  367   2HB   LYS  51          2HB       LYS  51   2.867   6.297  -3.982
  368   1HG   LYS  51          1HG       LYS  51   3.458   8.326  -4.944
  369   2HG   LYS  51          2HG       LYS  51   3.550   7.156  -6.256
  370   1HD   LYS  51          1HD       LYS  51   1.458   7.905  -7.154
  371   2HD   LYS  51          2HD       LYS  51   1.179   8.951  -5.755
  372   1HE   LYS  51          1HE       LYS  51   3.313   9.232  -7.874
  373   2HE   LYS  51          2HE       LYS  51   1.958  10.321  -7.561
  374   1HZ   LYS  51          1HZ       LYS  51   3.401  10.041  -5.188
  375   2HZ   LYS  51          2HZ       LYS  51   3.230  11.427  -6.142
  376   3HZ   LYS  51          3HZ       LYS  51   4.522  10.351  -6.420
  377    H    TYR  52           H        TYR  52   2.644   3.158  -5.625
  378    HA   TYR  52           HA       TYR  52   1.547   2.290  -3.053
  379   1HB   TYR  52          1HB       TYR  52   0.687   0.249  -3.948
  380   2HB   TYR  52          2HB       TYR  52   0.067   1.529  -4.984
  381    HD1  TYR  52           HD1      TYR  52   2.384  -1.302  -4.752
  382    HD2  TYR  52           HD2      TYR  52   0.811   1.735  -7.283
  383    HE1  TYR  52           HE1      TYR  52   3.352  -2.437  -6.698
  384    HE2  TYR  52           HE2      TYR  52   1.773   0.605  -9.241
  385    HH   TYR  52           HH       TYR  52   2.466  -1.848  -9.797
  386    H    GLY  53           H        GLY  53   2.572   0.290  -2.309
  387   1HA   GLY  53          1HA       GLY  53   5.009  -0.548  -3.562
  388   2HA   GLY  53          2HA       GLY  53   5.262   0.386  -2.097
  389    H    PHE  54           H        PHE  54   5.994  -2.339  -2.426
  390    HA   PHE  54           HA       PHE  54   3.979  -3.848  -0.983
  391   1HB   PHE  54          1HB       PHE  54   6.710  -4.659  -1.948
  392   2HB   PHE  54          2HB       PHE  54   5.548  -5.742  -1.203
  393    HD1  PHE  54           HD1      PHE  54   6.587  -6.491  -3.759
  394    HD2  PHE  54           HD2      PHE  54   3.383  -3.836  -2.868
  395    HE1  PHE  54           HE1      PHE  54   5.602  -6.930  -5.972
  396    HE2  PHE  54           HE2      PHE  54   2.389  -4.270  -5.066
  397    HZ   PHE  54           HZ       PHE  54   3.503  -5.827  -6.632
  398    H    CYS  55           H        CYS  55   4.207  -4.618   1.113
  399    HA   CYS  55           HA       CYS  55   5.898  -2.994   2.784
  400   1HB   CYS  55          1HB       CYS  55   4.033  -5.255   3.542
  401   2HB   CYS  55          2HB       CYS  55   4.726  -4.063   4.642
  402    HA   PRO  56           HA       PRO  56   9.334  -5.705   3.137
  403   1HB   PRO  56          1HB       PRO  56   9.680  -5.025   5.913
  404   2HB   PRO  56          2HB       PRO  56  10.696  -4.627   4.540
  405   1HG   PRO  56          1HG       PRO  56   9.216  -2.768   5.852
  406   2HG   PRO  56          2HG       PRO  56   9.579  -2.664   4.118
  407   1HD   PRO  56          1HD       PRO  56   7.066  -3.543   5.482
  408   2HD   PRO  56          2HD       PRO  56   7.272  -2.580   4.004
  409    H    HIS  57           H        HIS  57   7.862  -7.566   3.000
  410    HA   HIS  57           HA       HIS  57   8.500  -9.546   4.862
  411   1HB   HIS  57          1HB       HIS  57   6.791  -8.207   6.216
  412   2HB   HIS  57          2HB       HIS  57   5.586  -8.739   5.050
  413    HD1  HIS  57           HD1      HIS  57   5.406 -11.495   4.868
  414    HD2  HIS  57           HD2      HIS  57   7.110  -9.880   8.304
  415    HE1  HIS  57           HE1      HIS  57   5.293 -13.318   6.600
  416    H    GLU  58           H        GLU  58   8.903  -9.653   2.360
  417    HA   GLU  58           HA       GLU  58   6.713 -10.513   0.758
  418   1HB   GLU  58          1HB       GLU  58   8.502 -11.153  -0.899
  419   2HB   GLU  58          2HB       GLU  58   8.490  -9.470  -0.411
  420   1HG   GLU  58          1HG       GLU  58  10.339 -10.068   1.218
  421   2HG   GLU  58          2HG       GLU  58  10.428 -11.623   0.393
  422    H    ALA  59           H        ALA  59   9.547 -12.287   1.998
  423    HA   ALA  59           HA       ALA  59   7.898 -14.593   2.521
  424   1HB   ALA  59          1HB       ALA  59   9.116 -14.432   0.006
  425   2HB   ALA  59          2HB       ALA  59   8.362 -15.843   0.748
  426   3HB   ALA  59          3HB       ALA  59  10.090 -15.565   0.946
  Start of MODEL   34
    1   1H    ARG   1          1H        ARG   1   5.382   5.234  11.360
    2   2H    ARG   1          2H        ARG   1   4.343   3.866  11.418
    3   3H    ARG   1          3H        ARG   1   3.678   5.450  11.337
    4    HA   ARG   1           HA       ARG   1   3.543   4.329   9.237
    5   1HB   ARG   1          1HB       ARG   1   3.907   6.830   9.518
    6   2HB   ARG   1          2HB       ARG   1   5.616   6.547   9.211
    7   1HG   ARG   1          1HG       ARG   1   5.162   5.786   7.004
    8   2HG   ARG   1          2HG       ARG   1   3.423   5.813   7.297
    9   1HD   ARG   1          1HD       ARG   1   3.627   8.285   7.696
   10   2HD   ARG   1          2HD       ARG   1   5.296   8.170   7.136
   11    HE   ARG   1           HE       ARG   1   3.519   7.026   5.240
   12   1HH1  ARG   1          1HH1      ARG   1   4.611  10.118   6.459
   13   2HH1  ARG   1          2HH1      ARG   1   4.237  10.965   4.988
   14   1HH2  ARG   1          1HH2      ARG   1   3.004   8.148   3.320
   15   2HH2  ARG   1          2HH2      ARG   1   3.314   9.851   3.210
   16    H    ILE   2           H        ILE   2   4.426   2.279   8.926
   17    HA   ILE   2           HA       ILE   2   7.238   1.819   8.987
   18    HB   ILE   2           HB       ILE   2   6.697  -0.433   8.054
   19   1HG1  ILE   2          1HG1      ILE   2   3.837   0.536   8.205
   20   2HG1  ILE   2          2HG1      ILE   2   4.739   0.222   6.726
   21   1HG2  ILE   2          1HG2      ILE   2   5.683  -1.317  10.037
   22   2HG2  ILE   2          2HG2      ILE   2   4.917   0.220  10.415
   23   3HG2  ILE   2          3HG2      ILE   2   6.671   0.055  10.532
   24   1HD1  ILE   2          1HD1      ILE   2   4.853  -2.106   7.219
   25   2HD1  ILE   2          2HD1      ILE   2   3.176  -1.583   7.359
   26   3HD1  ILE   2          3HD1      ILE   2   4.134  -1.858   8.813
   27    HA   PRO   3           HA       PRO   3   8.737   2.693   5.003
   28   1HB   PRO   3          1HB       PRO   3  10.319   0.502   4.576
   29   2HB   PRO   3          2HB       PRO   3  10.759   1.856   5.624
   30   1HG   PRO   3          1HG       PRO   3   9.520  -0.782   6.361
   31   2HG   PRO   3          2HG       PRO   3  10.879   0.066   7.128
   32   1HD   PRO   3          1HD       PRO   3   8.457   0.182   8.198
   33   2HD   PRO   3          2HD       PRO   3   9.471   1.644   8.142
   34    H    VAL   4           H        VAL   4   9.107   1.860   2.833
   35    HA   VAL   4           HA       VAL   4   7.148  -0.168   1.942
   36    HB   VAL   4           HB       VAL   4   7.831   2.511   0.643
   37   1HG1  VAL   4          1HG1      VAL   4   5.919   1.749  -0.919
   38   2HG1  VAL   4          2HG1      VAL   4   6.349   0.126  -0.383
   39   3HG1  VAL   4          3HG1      VAL   4   7.553   1.130  -1.190
   40   1HG2  VAL   4          1HG2      VAL   4   5.700   1.629   2.403
   41   2HG2  VAL   4          2HG2      VAL   4   5.084   2.264   0.876
   42   3HG2  VAL   4          3HG2      VAL   4   6.139   3.256   1.882
   43    H    LYS   5           H        LYS   5   7.888  -1.338  -0.060
   44    HA   LYS   5           HA       LYS   5  10.713  -0.836  -0.684
   45   1HB   LYS   5          1HB       LYS   5  10.050  -2.881   0.977
   46   2HB   LYS   5          2HB       LYS   5   9.978  -3.690  -0.582
   47   1HG   LYS   5          1HG       LYS   5  12.347  -2.076   0.334
   48   2HG   LYS   5          2HG       LYS   5  12.185  -3.814   0.592
   49   1HD   LYS   5          1HD       LYS   5  12.243  -4.259  -1.731
   50   2HD   LYS   5          2HD       LYS   5  11.998  -2.562  -2.142
   51   1HE   LYS   5          1HE       LYS   5  14.436  -3.581  -0.686
   52   2HE   LYS   5          2HE       LYS   5  14.350  -3.430  -2.440
   53   1HZ   LYS   5          1HZ       LYS   5  14.111  -1.103  -2.278
   54   2HZ   LYS   5          2HZ       LYS   5  15.396  -1.516  -1.253
   55   3HZ   LYS   5          3HZ       LYS   5  13.869  -1.151  -0.596
   56    H    TYR   6           H        TYR   6   8.947  -3.664  -1.756
   57    HA   TYR   6           HA       TYR   6   9.474  -3.107  -4.477
   58   1HB   TYR   6          1HB       TYR   6   7.341  -5.046  -3.597
   59   2HB   TYR   6          2HB       TYR   6   8.420  -5.139  -4.987
   60    HD1  TYR   6           HD1      TYR   6   8.305  -5.439  -1.293
   61    HD2  TYR   6           HD2      TYR   6  10.543  -6.229  -4.830
   62    HE1  TYR   6           HE1      TYR   6   9.834  -6.851   0.003
   63    HE2  TYR   6           HE2      TYR   6  12.074  -7.647  -3.539
   64    HH   TYR   6           HH       TYR   6  12.254  -7.605  -0.215
   65    H    GLY   7           H        GLY   7   8.082  -2.594  -6.168
   66   1HA   GLY   7          1HA       GLY   7   5.691  -2.188  -6.773
   67   2HA   GLY   7          2HA       GLY   7   5.614  -1.174  -5.348
   68    H    ASN   8           H        ASN   8   5.001   0.610  -6.617
   69    HA   ASN   8           HA       ASN   8   7.145   1.691  -8.342
   70   1HB   ASN   8          1HB       ASN   8   5.511   2.661  -9.765
   71   2HB   ASN   8          2HB       ASN   8   4.975   1.011  -9.453
   72   1HD2  ASN   8          1HD2      ASN   8   3.444   3.386 -10.255
   73   2HD2  ASN   8          2HD2      ASN   8   2.256   3.608  -9.014
   74    H    ALA   9           H        ALA   9   6.022   2.121  -5.363
   75    HA   ALA   9           HA       ALA   9   5.301   4.813  -5.096
   76   1HB   ALA   9          1HB       ALA   9   5.833   2.662  -3.387
   77   2HB   ALA   9          2HB       ALA   9   5.082   4.212  -3.005
   78   3HB   ALA   9          3HB       ALA   9   6.828   4.014  -2.843
   79    H    ASP  10           H        ASP  10   6.499   6.625  -4.321
   80    HA   ASP  10           HA       ASP  10   8.977   6.957  -5.700
   81   1HB   ASP  10          1HB       ASP  10   8.941   9.263  -4.678
   82   2HB   ASP  10          2HB       ASP  10   7.561   8.862  -5.686
   83    H    GLY  11           H        GLY  11   8.086   7.068  -2.249
   84   1HA   GLY  11          1HA       GLY  11  10.261   5.638  -1.327
   85   2HA   GLY  11          2HA       GLY  11  10.806   7.307  -1.400
   86    H    GLU  12           H        GLU  12   7.572   7.498  -0.795
   87    HA   GLU  12           HA       GLU  12   8.060   8.140   1.964
   88   1HB   GLU  12          1HB       GLU  12   5.508   8.070   0.352
   89   2HB   GLU  12          2HB       GLU  12   5.597   8.600   2.025
   90   1HG   GLU  12          1HG       GLU  12   7.086   9.869  -0.261
   91   2HG   GLU  12          2HG       GLU  12   5.561  10.451   0.408
   92    H    TYR  13           H        TYR  13   6.766   7.211   3.747
   93    HA   TYR  13           HA       TYR  13   6.831   4.329   3.567
   94   1HB   TYR  13          1HB       TYR  13   6.020   6.042   5.915
   95   2HB   TYR  13          2HB       TYR  13   6.459   4.337   5.947
   96    HD1  TYR  13           HD1      TYR  13   8.870   4.109   4.476
   97    HD2  TYR  13           HD2      TYR  13   7.624   7.294   7.003
   98    HE1  TYR  13           HE1      TYR  13  11.214   4.689   4.888
   99    HE2  TYR  13           HE2      TYR  13   9.966   7.889   7.417
  100    HH   TYR  13           HH       TYR  13  12.618   6.184   5.781
  101    H    CYS  14           H        CYS  14   4.970   3.200   4.892
  102    HA   CYS  14           HA       CYS  14   2.712   3.173   3.274
  103   1HB   CYS  14          1HB       CYS  14   3.187   2.165   6.068
  104   2HB   CYS  14          2HB       CYS  14   1.658   1.920   5.235
  105    H    LYS  15           H        LYS  15   0.867   4.267   3.193
  106    HA   LYS  15           HA       LYS  15   0.503   6.502   4.999
  107   1HB   LYS  15          1HB       LYS  15   0.073   6.845   2.619
  108   2HB   LYS  15          2HB       LYS  15  -1.123   5.554   2.624
  109   1HG   LYS  15          1HG       LYS  15  -2.161   7.770   2.639
  110   2HG   LYS  15          2HG       LYS  15  -2.560   6.853   4.094
  111   1HD   LYS  15          1HD       LYS  15  -0.671   8.066   5.241
  112   2HD   LYS  15          2HD       LYS  15  -0.570   9.096   3.810
  113   1HE   LYS  15          1HE       LYS  15  -2.892   9.786   4.138
  114   2HE   LYS  15          2HE       LYS  15  -3.005   8.738   5.554
  115   1HZ   LYS  15          1HZ       LYS  15  -2.519  11.219   5.894
  116   2HZ   LYS  15          2HZ       LYS  15  -0.937  10.843   5.396
  117   3HZ   LYS  15          3HZ       LYS  15  -1.597  10.094   6.774
  118    H    PHE  16           H        PHE  16  -0.343   6.087   6.912
  119    HA   PHE  16           HA       PHE  16  -2.593   4.189   7.059
  120   1HB   PHE  16          1HB       PHE  16  -0.396   4.742   9.057
  121   2HB   PHE  16          2HB       PHE  16  -1.848   3.834   9.457
  122    HD1  PHE  16           HD1      PHE  16   0.900   2.769   9.765
  123    HD2  PHE  16           HD2      PHE  16  -1.775   2.637   6.459
  124    HE1  PHE  16           HE1      PHE  16   1.976   0.711   8.978
  125    HE2  PHE  16           HE2      PHE  16  -0.706   0.587   5.665
  126    HZ   PHE  16           HZ       PHE  16   1.188  -0.413   6.918
  127    HA   PRO  17           HA       PRO  17  -4.276   4.098   7.026
  128   1HB   PRO  17          1HB       PRO  17  -6.862   5.007   6.731
  129   2HB   PRO  17          2HB       PRO  17  -6.266   4.092   8.116
  130   1HG   PRO  17          1HG       PRO  17  -7.135   6.829   8.057
  131   2HG   PRO  17          2HG       PRO  17  -6.560   5.892   9.442
  132   1HD   PRO  17          1HD       PRO  17  -5.119   7.842   7.758
  133   2HD   PRO  17          2HD       PRO  17  -4.771   7.304   9.416
  134    H    PHE  18           H        PHE  18  -4.877   3.697   4.867
  135    HA   PHE  18           HA       PHE  18  -4.827   6.076   3.134
  136   1HB   PHE  18          1HB       PHE  18  -3.869   4.723   1.353
  137   2HB   PHE  18          2HB       PHE  18  -2.847   4.666   2.781
  138    HD1  PHE  18           HD1      PHE  18  -2.951   2.598   4.244
  139    HD2  PHE  18           HD2      PHE  18  -4.673   2.787   0.361
  140    HE1  PHE  18           HE1      PHE  18  -2.963   0.148   4.140
  141    HE2  PHE  18           HE2      PHE  18  -4.691   0.335   0.242
  142    HZ   PHE  18           HZ       PHE  18  -3.827  -1.007   2.126
  143    H    LEU  19           H        LEU  19  -6.207   6.102   1.326
  144    HA   LEU  19           HA       LEU  19  -8.686   4.675   1.824
  145   1HB   LEU  19          1HB       LEU  19  -8.628   7.118   1.444
  146   2HB   LEU  19          2HB       LEU  19  -8.031   6.834  -0.178
  147    HG   LEU  19           HG       LEU  19 -10.166   5.518  -0.589
  148   1HD1  LEU  19          1HD1      LEU  19 -11.863   6.834   1.169
  149   2HD1  LEU  19          2HD1      LEU  19 -10.541   6.251   2.180
  150   3HD1  LEU  19          3HD1      LEU  19 -11.453   5.121   1.179
  151   1HD2  LEU  19          1HD2      LEU  19  -9.723   8.389  -0.443
  152   2HD2  LEU  19          2HD2      LEU  19 -11.427   7.948  -0.360
  153   3HD2  LEU  19          3HD2      LEU  19 -10.449   7.413  -1.725
  154    H    PHE  20           H        PHE  20  -8.955   2.739   0.920
  155    HA   PHE  20           HA       PHE  20  -7.923   2.294  -1.812
  156   1HB   PHE  20          1HB       PHE  20  -7.047   0.765   0.038
  157   2HB   PHE  20          2HB       PHE  20  -8.696   0.158   0.166
  158    HD1  PHE  20           HD1      PHE  20  -7.553  -2.012  -0.244
  159    HD2  PHE  20           HD2      PHE  20  -7.846   1.033  -3.196
  160    HE1  PHE  20           HE1      PHE  20  -7.165  -3.700  -1.988
  161    HE2  PHE  20           HE2      PHE  20  -7.456  -0.651  -4.956
  162    HZ   PHE  20           HZ       PHE  20  -7.126  -3.016  -4.359
  163    H    ASN  21           H        ASN  21  -9.643   2.948  -3.009
  164    HA   ASN  21           HA       ASN  21 -11.716   3.036  -3.934
  165   1HB   ASN  21          1HB       ASN  21 -11.438   0.129  -3.234
  166   2HB   ASN  21          2HB       ASN  21 -12.883   0.733  -4.038
  167   1HD2  ASN  21          1HD2      ASN  21 -12.840   0.574  -6.152
  168   2HD2  ASN  21          2HD2      ASN  21 -11.434   0.614  -7.153
  169    H    GLY  22           H        GLY  22 -11.647   3.801  -1.130
  170   1HA   GLY  22          1HA       GLY  22 -13.559   4.706  -0.015
  171   2HA   GLY  22          2HA       GLY  22 -14.485   3.321  -0.555
  172    H    LYS  23           H        LYS  23 -11.713   1.975   0.460
  173    HA   LYS  23           HA       LYS  23 -12.712   1.728   3.221
  174   1HB   LYS  23          1HB       LYS  23 -12.757  -0.309   1.574
  175   2HB   LYS  23          2HB       LYS  23 -11.033  -0.383   1.911
  176   1HG   LYS  23          1HG       LYS  23 -11.630  -0.490   4.360
  177   2HG   LYS  23          2HG       LYS  23 -13.307  -0.702   3.858
  178   1HD   LYS  23          1HD       LYS  23 -10.974  -2.503   3.200
  179   2HD   LYS  23          2HD       LYS  23 -12.298  -2.860   4.311
  180   1HE   LYS  23          1HE       LYS  23 -13.878  -2.744   2.424
  181   2HE   LYS  23          2HE       LYS  23 -12.528  -2.440   1.330
  182   1HZ   LYS  23          1HZ       LYS  23 -13.077  -4.759   1.240
  183   2HZ   LYS  23          2HZ       LYS  23 -13.000  -4.905   2.931
  184   3HZ   LYS  23          3HZ       LYS  23 -11.586  -4.608   2.043
  185    H    GLU  24           H        GLU  24 -11.382   2.546   4.714
  186    HA   GLU  24           HA       GLU  24  -8.624   3.119   3.962
  187   1HB   GLU  24          1HB       GLU  24 -10.143   3.956   6.433
  188   2HB   GLU  24          2HB       GLU  24  -8.565   4.549   5.935
  189   1HG   GLU  24          1HG       GLU  24  -9.571   5.518   3.932
  190   2HG   GLU  24          2HG       GLU  24 -11.146   4.920   4.441
  191    H    TYR  25           H        TYR  25  -6.935   2.021   4.650
  192    HA   TYR  25           HA       TYR  25  -7.347  -0.040   6.711
  193   1HB   TYR  25          1HB       TYR  25  -5.255   0.139   4.554
  194   2HB   TYR  25          2HB       TYR  25  -5.377  -1.163   5.722
  195    HD1  TYR  25           HD1      TYR  25  -7.694  -2.393   5.768
  196    HD2  TYR  25           HD2      TYR  25  -6.234  -0.100   2.506
  197    HE1  TYR  25           HE1      TYR  25  -9.240  -3.575   4.245
  198    HE2  TYR  25           HE2      TYR  25  -7.764  -1.272   0.975
  199    HH   TYR  25           HH       TYR  25  -9.506  -4.077   1.920
  200    H    ASN  26           H        ASN  26  -6.078  -0.153   8.497
  201    HA   ASN  26           HA       ASN  26  -4.265   2.101   8.994
  202   1HB   ASN  26          1HB       ASN  26  -5.507   0.047  10.833
  203   2HB   ASN  26          2HB       ASN  26  -4.272   1.179  11.364
  204   1HD2  ASN  26          1HD2      ASN  26  -6.088   2.690   9.050
  205   2HD2  ASN  26          2HD2      ASN  26  -7.214   3.504  10.077
  206    H    SER  27           H        SER  27  -4.151  -0.914   7.780
  207    HA   SER  27           HA       SER  27  -1.318  -1.221   8.412
  208   1HB   SER  27          1HB       SER  27  -1.773  -3.735   8.637
  209   2HB   SER  27          2HB       SER  27  -2.276  -2.723   9.995
  210    HG   SER  27           HG       SER  27  -3.774  -4.377   8.600
  211    H    CYS  28           H        CYS  28  -0.617  -3.353   6.995
  212    HA   CYS  28           HA       CYS  28  -1.139  -2.557   4.269
  213   1HB   CYS  28          1HB       CYS  28   0.343  -5.035   5.127
  214   2HB   CYS  28          2HB       CYS  28   0.543  -4.097   3.656
  215    H    THR  29           H        THR  29  -2.146  -3.852   2.656
  216    HA   THR  29           HA       THR  29  -3.665  -6.135   3.662
  217    HB   THR  29           HB       THR  29  -5.120  -4.117   3.603
  218    HG1  THR  29           HG1      THR  29  -5.924  -6.268   3.163
  219   1HG2  THR  29          1HG2      THR  29  -3.911  -3.619   1.103
  220   2HG2  THR  29          2HG2      THR  29  -5.183  -2.698   1.906
  221   3HG2  THR  29          3HG2      THR  29  -5.609  -3.995   0.793
  222    H    ASP  30           H        ASP  30  -4.482  -7.537   1.889
  223    HA   ASP  30           HA       ASP  30  -2.546  -7.453  -0.255
  224   1HB   ASP  30          1HB       ASP  30  -3.720 -10.022  -0.214
  225   2HB   ASP  30          2HB       ASP  30  -2.096  -9.573   0.096
  226    H    THR  31           H        THR  31  -5.497  -6.605   0.407
  227    HA   THR  31           HA       THR  31  -7.233  -7.633  -1.536
  228    HB   THR  31           HB       THR  31  -7.232  -4.860  -0.339
  229    HG1  THR  31           HG1      THR  31  -7.192  -6.039   1.433
  230   1HG2  THR  31          1HG2      THR  31  -9.785  -5.550  -0.248
  231   2HG2  THR  31          2HG2      THR  31  -9.309  -6.470  -1.674
  232   3HG2  THR  31          3HG2      THR  31  -9.072  -4.723  -1.632
  233    H    GLY  32           H        GLY  32  -7.925  -6.700  -3.561
  234   1HA   GLY  32          1HA       GLY  32  -7.729  -5.317  -5.437
  235   2HA   GLY  32          2HA       GLY  32  -6.339  -4.550  -4.682
  236    H    ARG  33           H        ARG  33  -4.768  -6.742  -4.132
  237    HA   ARG  33           HA       ARG  33  -3.759  -7.397  -6.782
  238   1HB   ARG  33          1HB       ARG  33  -2.740  -8.282  -4.078
  239   2HB   ARG  33          2HB       ARG  33  -1.885  -8.363  -5.600
  240   1HG   ARG  33          1HG       ARG  33  -2.750  -5.716  -4.512
  241   2HG   ARG  33          2HG       ARG  33  -1.327  -6.517  -3.865
  242   1HD   ARG  33          1HD       ARG  33  -1.776  -5.693  -6.754
  243   2HD   ARG  33          2HD       ARG  33  -0.669  -4.964  -5.584
  244    HE   ARG  33           HE       ARG  33  -0.088  -7.757  -5.895
  245   1HH1  ARG  33          1HH1      ARG  33   0.245  -4.617  -7.404
  246   2HH1  ARG  33          2HH1      ARG  33   1.697  -5.031  -8.266
  247   1HH2  ARG  33          1HH2      ARG  33   1.821  -8.319  -7.052
  248   2HH2  ARG  33          2HH2      ARG  33   2.587  -7.135  -8.071
  249    H    SER  34           H        SER  34  -2.789  -9.864  -6.699
  250    HA   SER  34           HA       SER  34  -4.690 -11.718  -5.535
  251   1HB   SER  34          1HB       SER  34  -4.345 -11.651  -8.542
  252   2HB   SER  34          2HB       SER  34  -5.365 -12.753  -7.623
  253    HG   SER  34           HG       SER  34  -6.742 -11.105  -7.151
  254    H    ASP  35           H        ASP  35  -1.673 -11.270  -5.375
  255    HA   ASP  35           HA       ASP  35  -0.964 -14.029  -5.932
  256   1HB   ASP  35          1HB       ASP  35  -0.104 -11.769  -7.463
  257   2HB   ASP  35          2HB       ASP  35   1.196 -12.820  -6.960
  258    H    GLY  36           H        GLY  36  -0.966 -13.009  -3.256
  259   1HA   GLY  36          1HA       GLY  36   0.705 -13.585  -1.614
  260   2HA   GLY  36          2HA       GLY  36   1.947 -13.240  -2.806
  261    H    PHE  37           H        PHE  37  -0.206 -11.008  -3.185
  262    HA   PHE  37           HA       PHE  37   0.755  -8.682  -2.731
  263   1HB   PHE  37          1HB       PHE  37  -1.659  -8.381  -1.670
  264   2HB   PHE  37          2HB       PHE  37  -1.389  -8.676  -3.356
  265    HD1  PHE  37           HD1      PHE  37  -1.221 -11.228  -0.611
  266    HD2  PHE  37           HD2      PHE  37  -3.313  -9.806  -4.030
  267    HE1  PHE  37           HE1      PHE  37  -2.623 -13.242  -0.581
  268    HE2  PHE  37           HE2      PHE  37  -4.715 -11.817  -4.001
  269    HZ   PHE  37           HZ       PHE  37  -4.378 -13.539  -2.283
  270    H    LEU  38           H        LEU  38   1.247  -7.278  -1.192
  271    HA   LEU  38           HA       LEU  38   0.303  -7.338   1.496
  272   1HB   LEU  38          1HB       LEU  38   2.397  -8.994   1.260
  273   2HB   LEU  38          2HB       LEU  38   3.300  -7.493   1.314
  274    HG   LEU  38           HG       LEU  38   3.143  -8.623   3.515
  275   1HD1  LEU  38          1HD1      LEU  38   1.560  -6.218   4.031
  276   2HD1  LEU  38          2HD1      LEU  38   2.960  -5.963   2.988
  277   3HD1  LEU  38          3HD1      LEU  38   3.169  -6.665   4.593
  278   1HD2  LEU  38          1HD2      LEU  38   1.232  -9.308   4.431
  279   2HD2  LEU  38          2HD2      LEU  38   0.540  -9.115   2.820
  280   3HD2  LEU  38          3HD2      LEU  38   0.387  -7.820   4.005
  281    H    TRP  39           H        TRP  39  -0.383  -5.210   0.628
  282    HA   TRP  39           HA       TRP  39   1.890  -3.374   0.368
  283   1HB   TRP  39          1HB       TRP  39   0.954  -2.351  -1.597
  284   2HB   TRP  39          2HB       TRP  39   1.045  -4.081  -1.861
  285    HD1  TRP  39           HD1      TRP  39  -1.347  -5.450  -1.944
  286    HE1  TRP  39           HE1      TRP  39  -3.721  -4.636  -2.430
  287    HE3  TRP  39           HE3      TRP  39  -0.657  -0.398  -1.401
  288    HZ2  TRP  39           HZ2      TRP  39  -5.110  -2.212  -2.612
  289    HZ3  TRP  39           HZ3      TRP  39  -2.574   1.085  -1.782
  290    HH2  TRP  39           HH2      TRP  39  -4.756   0.186  -2.370
  291    H    CYS  40           H        CYS  40   1.296  -1.142   0.227
  292    HA   CYS  40           HA       CYS  40  -1.049  -0.271   1.710
  293   1HB   CYS  40          1HB       CYS  40   0.332   1.072   3.241
  294   2HB   CYS  40          2HB       CYS  40   0.729  -0.637   3.414
  295    H    SER  41           H        SER  41  -1.500   1.986   1.143
  296    HA   SER  41           HA       SER  41  -0.234   2.684  -1.360
  297   1HB   SER  41          1HB       SER  41  -2.707   3.011  -0.925
  298   2HB   SER  41          2HB       SER  41  -2.262   4.345   0.139
  299    HG   SER  41           HG       SER  41  -1.313   4.247  -2.517
  300    H    THR  42           H        THR  42   0.617   4.869  -1.730
  301    HA   THR  42           HA       THR  42   2.232   5.714   0.571
  302    HB   THR  42           HB       THR  42   2.640   6.406  -2.346
  303    HG1  THR  42           HG1      THR  42   4.141   4.432  -1.045
  304   1HG2  THR  42          1HG2      THR  42   4.883   6.911  -1.796
  305   2HG2  THR  42          2HG2      THR  42   4.698   6.270  -0.162
  306   3HG2  THR  42          3HG2      THR  42   3.874   7.760  -0.624
  307    H    THR  43           H        THR  43  -0.359   6.594  -1.407
  308    HA   THR  43           HA       THR  43  -0.210   9.395  -0.529
  309    HB   THR  43           HB       THR  43  -1.713   9.827  -2.509
  310    HG1  THR  43           HG1      THR  43  -2.547   8.034  -3.260
  311   1HG2  THR  43          1HG2      THR  43  -0.037   9.955  -4.086
  312   2HG2  THR  43          2HG2      THR  43   0.756   8.486  -3.509
  313   3HG2  THR  43          3HG2      THR  43   0.857   9.973  -2.568
  314    H    TYR  44           H        TYR  44  -2.700  10.263  -0.867
  315    HA   TYR  44           HA       TYR  44  -4.134   9.063   1.295
  316   1HB   TYR  44          1HB       TYR  44  -5.055  11.174  -0.634
  317   2HB   TYR  44          2HB       TYR  44  -5.776  10.813   0.927
  318    HD1  TYR  44           HD1      TYR  44  -4.028  10.979   2.959
  319    HD2  TYR  44           HD2      TYR  44  -3.608  12.979  -0.777
  320    HE1  TYR  44           HE1      TYR  44  -2.528  12.622   4.006
  321    HE2  TYR  44           HE2      TYR  44  -2.110  14.623   0.266
  322    HH   TYR  44           HH       TYR  44  -0.479  14.367   2.674
  323    H    ASN  45           H        ASN  45  -5.010   9.682  -2.084
  324    HA   ASN  45           HA       ASN  45  -6.897   7.440  -1.965
  325   1HB   ASN  45          1HB       ASN  45  -7.675   9.703  -2.767
  326   2HB   ASN  45          2HB       ASN  45  -6.597   9.531  -4.132
  327   1HD2  ASN  45          1HD2      ASN  45  -7.336   6.554  -4.159
  328   2HD2  ASN  45          2HD2      ASN  45  -8.851   6.626  -4.928
  329    H    PHE  46           H        PHE  46  -5.938   5.581  -2.484
  330    HA   PHE  46           HA       PHE  46  -3.560   5.308  -3.924
  331   1HB   PHE  46          1HB       PHE  46  -4.157   3.554  -2.442
  332   2HB   PHE  46          2HB       PHE  46  -5.735   3.329  -3.235
  333    HD1  PHE  46           HD1      PHE  46  -5.924   1.518  -4.633
  334    HD2  PHE  46           HD2      PHE  46  -2.070   3.268  -4.146
  335    HE1  PHE  46           HE1      PHE  46  -4.975  -0.188  -6.112
  336    HE2  PHE  46           HE2      PHE  46  -1.119   1.550  -5.627
  337    HZ   PHE  46           HZ       PHE  46  -2.564  -0.176  -6.611
  338    H    GLU  47           H        GLU  47  -6.885   4.652  -5.050
  339    HA   GLU  47           HA       GLU  47  -6.198   3.801  -7.601
  340   1HB   GLU  47          1HB       GLU  47  -8.491   3.863  -6.298
  341   2HB   GLU  47          2HB       GLU  47  -8.716   5.347  -7.214
  342   1HG   GLU  47          1HG       GLU  47  -8.182   3.987  -9.282
  343   2HG   GLU  47          2HG       GLU  47  -8.345   2.559  -8.260
  344    H    LYS  48           H        LYS  48  -6.856   7.104  -6.479
  345    HA   LYS  48           HA       LYS  48  -6.814   8.248  -9.057
  346   1HB   LYS  48          1HB       LYS  48  -7.896   9.530  -7.401
  347   2HB   LYS  48          2HB       LYS  48  -6.567   9.369  -6.268
  348   1HG   LYS  48          1HG       LYS  48  -5.221  10.925  -7.625
  349   2HG   LYS  48          2HG       LYS  48  -6.563  11.098  -8.759
  350   1HD   LYS  48          1HD       LYS  48  -6.634  12.969  -7.299
  351   2HD   LYS  48          2HD       LYS  48  -7.964  11.902  -6.843
  352   1HE   LYS  48          1HE       LYS  48  -6.607  11.010  -5.002
  353   2HE   LYS  48          2HE       LYS  48  -5.287  12.094  -5.452
  354   1HZ   LYS  48          1HZ       LYS  48  -7.991  13.061  -4.714
  355   2HZ   LYS  48          2HZ       LYS  48  -6.557  13.973  -4.844
  356   3HZ   LYS  48          3HZ       LYS  48  -6.747  12.858  -3.579
  357    H    ASP  49           H        ASP  49  -4.267   7.929  -6.585
  358    HA   ASP  49           HA       ASP  49  -2.359   9.281  -8.281
  359   1HB   ASP  49          1HB       ASP  49  -2.207   8.054  -5.543
  360   2HB   ASP  49          2HB       ASP  49  -0.756   8.601  -6.376
  361    H    GLY  50           H        GLY  50  -2.642   5.982  -6.957
  362   1HA   GLY  50          1HA       GLY  50  -2.213   4.033  -8.190
  363   2HA   GLY  50          2HA       GLY  50  -1.343   4.994  -9.366
  364    H    LYS  51           H        LYS  51  -0.266   5.951  -6.377
  365    HA   LYS  51           HA       LYS  51   2.139   4.350  -6.696
  366   1HB   LYS  51          1HB       LYS  51   1.514   6.787  -5.057
  367   2HB   LYS  51          2HB       LYS  51   2.981   5.860  -4.790
  368   1HG   LYS  51          1HG       LYS  51   3.767   7.394  -6.243
  369   2HG   LYS  51          2HG       LYS  51   3.213   6.182  -7.396
  370   1HD   LYS  51          1HD       LYS  51   2.429   8.238  -8.225
  371   2HD   LYS  51          2HD       LYS  51   1.027   7.479  -7.466
  372   1HE   LYS  51          1HE       LYS  51   1.273   8.858  -5.511
  373   2HE   LYS  51          2HE       LYS  51   2.796   9.513  -6.107
  374   1HZ   LYS  51          1HZ       LYS  51   0.899  10.011  -8.076
  375   2HZ   LYS  51          2HZ       LYS  51   1.638  11.134  -7.041
  376   3HZ   LYS  51          3HZ       LYS  51   0.158  10.417  -6.598
  377    H    TYR  52           H        TYR  52   2.583   2.620  -5.572
  378    HA   TYR  52           HA       TYR  52   1.593   2.286  -2.859
  379   1HB   TYR  52          1HB       TYR  52   0.534   0.182  -3.288
  380   2HB   TYR  52          2HB       TYR  52  -0.105   1.304  -4.488
  381    HD1  TYR  52           HD1      TYR  52   1.982  -1.647  -3.941
  382    HD2  TYR  52           HD2      TYR  52   0.548   1.109  -6.854
  383    HE1  TYR  52           HE1      TYR  52   2.748  -3.148  -5.725
  384    HE2  TYR  52           HE2      TYR  52   1.307  -0.395  -8.643
  385    HH   TYR  52           HH       TYR  52   2.523  -2.217  -9.131
  386    H    GLY  53           H        GLY  53   2.487   0.153  -1.992
  387   1HA   GLY  53          1HA       GLY  53   4.749  -0.998  -3.261
  388   2HA   GLY  53          2HA       GLY  53   5.225   0.100  -1.985
  389    H    PHE  54           H        PHE  54   5.721  -2.684  -1.980
  390    HA   PHE  54           HA       PHE  54   3.754  -3.804  -0.181
  391   1HB   PHE  54          1HB       PHE  54   6.249  -4.998  -1.366
  392   2HB   PHE  54          2HB       PHE  54   5.171  -5.860  -0.278
  393    HD1  PHE  54           HD1      PHE  54   5.358  -7.400  -2.426
  394    HD2  PHE  54           HD2      PHE  54   3.197  -3.738  -2.252
  395    HE1  PHE  54           HE1      PHE  54   4.043  -8.082  -4.366
  396    HE2  PHE  54           HE2      PHE  54   1.882  -4.414  -4.191
  397    HZ   PHE  54           HZ       PHE  54   2.289  -6.600  -5.255
  398    H    CYS  55           H        CYS  55   4.075  -4.291   1.934
  399    HA   CYS  55           HA       CYS  55   5.988  -2.672   3.320
  400   1HB   CYS  55          1HB       CYS  55   4.194  -4.800   4.501
  401   2HB   CYS  55          2HB       CYS  55   4.872  -3.385   5.312
  402    HA   PRO  56           HA       PRO  56   9.289  -5.632   3.160
  403   1HB   PRO  56          1HB       PRO  56  10.863  -4.405   5.021
  404   2HB   PRO  56          2HB       PRO  56  10.772  -3.934   3.325
  405   1HG   PRO  56          1HG       PRO  56   9.407  -2.745   5.703
  406   2HG   PRO  56          2HG       PRO  56  10.152  -1.927   4.317
  407   1HD   PRO  56          1HD       PRO  56   7.491  -2.228   4.514
  408   2HD   PRO  56          2HD       PRO  56   8.328  -2.312   2.949
  409    H    HIS  57           H        HIS  57   9.897  -7.407   4.218
  410    HA   HIS  57           HA       HIS  57   9.249  -7.687   7.064
  411   1HB   HIS  57          1HB       HIS  57   8.510 -10.065   6.566
  412   2HB   HIS  57          2HB       HIS  57   7.408  -8.801   6.036
  413    HD1  HIS  57           HD1      HIS  57   7.693  -8.196   3.346
  414    HD2  HIS  57           HD2      HIS  57   9.077 -11.883   4.676
  415    HE1  HIS  57           HE1      HIS  57   7.896  -9.628   1.284
  416    H    GLU  58           H        GLU  58  10.079 -10.558   6.901
  417    HA   GLU  58           HA       GLU  58  12.903 -10.059   7.146
  418   1HB   GLU  58          1HB       GLU  58  13.054 -12.402   7.904
  419   2HB   GLU  58          2HB       GLU  58  11.864 -11.482   8.802
  420   1HG   GLU  58          1HG       GLU  58  10.083 -12.510   7.448
  421   2HG   GLU  58          2HG       GLU  58  11.301 -13.465   6.608
  422    H    ALA  59           H        ALA  59  13.044 -13.126   6.181
  423    HA   ALA  59           HA       ALA  59  13.595 -12.369   3.392
  424   1HB   ALA  59          1HB       ALA  59  15.331 -14.007   3.346
  425   2HB   ALA  59          2HB       ALA  59  14.861 -14.630   4.926
  426   3HB   ALA  59          3HB       ALA  59  15.562 -13.018   4.784
  Start of MODEL   35
    1   1H    ARG   1          1H        ARG   1  10.519   7.487   8.562
    2   2H    ARG   1          2H        ARG   1  11.194   5.903   8.536
    3   3H    ARG   1          3H        ARG   1  10.183   6.389   9.838
    4    HA   ARG   1           HA       ARG   1   8.769   5.155   8.629
    5   1HB   ARG   1          1HB       ARG   1   8.053   7.552   9.023
    6   2HB   ARG   1          2HB       ARG   1   8.507   7.891   7.359
    7   1HG   ARG   1          1HG       ARG   1   6.205   7.585   7.313
    8   2HG   ARG   1          2HG       ARG   1   6.871   6.070   6.698
    9   1HD   ARG   1          1HD       ARG   1   6.578   5.033   8.889
   10   2HD   ARG   1          2HD       ARG   1   5.954   6.558   9.531
   11    HE   ARG   1           HE       ARG   1   4.459   5.708   7.257
   12   1HH1  ARG   1          1HH1      ARG   1   4.910   5.104  10.659
   13   2HH1  ARG   1          2HH1      ARG   1   3.309   4.486  10.901
   14   1HH2  ARG   1          1HH2      ARG   1   2.320   4.960   7.570
   15   2HH2  ARG   1          2HH2      ARG   1   1.808   4.467   9.155
   16    H    ILE   2           H        ILE   2   9.708   3.631   7.256
   17    HA   ILE   2           HA       ILE   2   9.504   4.206   4.459
   18    HB   ILE   2           HB       ILE   2  11.743   5.100   4.920
   19   1HG1  ILE   2          1HG1      ILE   2  12.993   3.800   3.206
   20   2HG1  ILE   2          2HG1      ILE   2  11.733   2.574   3.250
   21   1HG2  ILE   2          1HG2      ILE   2  12.016   2.679   6.426
   22   2HG2  ILE   2          2HG2      ILE   2  13.040   4.116   6.418
   23   3HG2  ILE   2          3HG2      ILE   2  13.326   2.819   5.256
   24   1HD1  ILE   2          1HD1      ILE   2  10.604   5.185   2.812
   25   2HD1  ILE   2          2HD1      ILE   2  10.478   3.727   1.827
   26   3HD1  ILE   2          3HD1      ILE   2  11.848   4.821   1.619
   27    HA   PRO   3           HA       PRO   3   9.066  -0.315   5.658
   28   1HB   PRO   3          1HB       PRO   3   6.230  -0.151   5.950
   29   2HB   PRO   3          2HB       PRO   3   7.428  -0.407   7.217
   30   1HG   PRO   3          1HG       PRO   3   5.848   1.835   7.019
   31   2HG   PRO   3          2HG       PRO   3   7.416   1.784   7.845
   32   1HD   PRO   3          1HD       PRO   3   6.789   2.718   5.052
   33   2HD   PRO   3          2HD       PRO   3   7.828   3.477   6.280
   34    H    VAL   4           H        VAL   4   9.060   1.083   3.100
   35    HA   VAL   4           HA       VAL   4   7.180  -0.654   1.620
   36    HB   VAL   4           HB       VAL   4   8.101   2.137   0.787
   37   1HG1  VAL   4          1HG1      VAL   4   6.458   0.025  -0.553
   38   2HG1  VAL   4          2HG1      VAL   4   7.757   1.021  -1.208
   39   3HG1  VAL   4          3HG1      VAL   4   6.173   1.732  -0.901
   40   1HG2  VAL   4          1HG2      VAL   4   6.366   2.969   1.910
   41   2HG2  VAL   4          2HG2      VAL   4   5.997   1.363   2.537
   42   3HG2  VAL   4          3HG2      VAL   4   5.264   1.909   1.029
   43    H    LYS   5           H        LYS   5   8.008  -1.595  -0.337
   44    HA   LYS   5           HA       LYS   5  10.877  -1.170  -0.782
   45   1HB   LYS   5          1HB       LYS   5  10.016  -3.356   0.596
   46   2HB   LYS   5          2HB       LYS   5  10.021  -3.979  -1.048
   47   1HG   LYS   5          1HG       LYS   5  12.368  -2.670   0.320
   48   2HG   LYS   5          2HG       LYS   5  12.129  -4.412   0.133
   49   1HD   LYS   5          1HD       LYS   5  12.350  -4.281  -2.227
   50   2HD   LYS   5          2HD       LYS   5  12.225  -2.521  -2.215
   51   1HE   LYS   5          1HE       LYS   5  14.485  -4.103  -0.987
   52   2HE   LYS   5          2HE       LYS   5  14.533  -3.329  -2.573
   53   1HZ   LYS   5          1HZ       LYS   5  13.883  -1.740  -0.169
   54   2HZ   LYS   5          2HZ       LYS   5  14.549  -1.230  -1.648
   55   3HZ   LYS   5          3HZ       LYS   5  15.496  -2.102  -0.543
   56    H    TYR   6           H        TYR   6   8.946  -3.736  -2.201
   57    HA   TYR   6           HA       TYR   6   9.681  -3.022  -4.836
   58   1HB   TYR   6          1HB       TYR   6   7.404  -4.848  -4.031
   59   2HB   TYR   6          2HB       TYR   6   8.302  -4.865  -5.549
   60    HD1  TYR   6           HD1      TYR   6  11.079  -4.886  -4.883
   61    HD2  TYR   6           HD2      TYR   6   7.878  -6.755  -2.781
   62    HE1  TYR   6           HE1      TYR   6  12.645  -6.508  -3.936
   63    HE2  TYR   6           HE2      TYR   6   9.444  -8.382  -1.830
   64    HH   TYR   6           HH       TYR   6  11.589  -9.023  -1.657
   65    H    GLY   7           H        GLY   7   8.439  -2.274  -6.546
   66   1HA   GLY   7          1HA       GLY   7   6.250  -1.523  -7.357
   67   2HA   GLY   7          2HA       GLY   7   6.002  -0.758  -5.799
   68    H    ASN   8           H        ASN   8   5.706   1.274  -6.755
   69    HA   ASN   8           HA       ASN   8   8.162   2.402  -7.923
   70   1HB   ASN   8          1HB       ASN   8   6.835   3.902  -9.271
   71   2HB   ASN   8          2HB       ASN   8   6.278   2.256  -9.539
   72   1HD2  ASN   8          1HD2      ASN   8   4.939   4.810  -9.965
   73   2HD2  ASN   8          2HD2      ASN   8   3.484   4.747  -9.033
   74    H    ALA   9           H        ALA   9   6.962   2.314  -5.077
   75    HA   ALA   9           HA       ALA   9   6.847   5.179  -4.516
   76   1HB   ALA   9          1HB       ALA   9   6.504   3.186  -2.359
   77   2HB   ALA   9          2HB       ALA   9   5.231   3.294  -3.581
   78   3HB   ALA   9          3HB       ALA   9   5.666   4.715  -2.629
   79    H    ASP  10           H        ASP  10   9.331   4.754  -5.210
   80    HA   ASP  10           HA       ASP  10  10.986   3.757  -3.095
   81   1HB   ASP  10          1HB       ASP  10  11.563   5.255  -5.645
   82   2HB   ASP  10          2HB       ASP  10  12.829   4.953  -4.458
   83    H    GLY  11           H        GLY  11  11.517   4.766  -1.288
   84   1HA   GLY  11          1HA       GLY  11  12.220   6.543   0.062
   85   2HA   GLY  11          2HA       GLY  11  11.925   7.650  -1.273
   86    H    GLU  12           H        GLU  12   9.231   5.914  -1.248
   87    HA   GLU  12           HA       GLU  12   7.815   7.912   0.316
   88   1HB   GLU  12          1HB       GLU  12   6.982   5.885  -1.741
   89   2HB   GLU  12          2HB       GLU  12   5.790   6.748  -0.773
   90   1HG   GLU  12          1HG       GLU  12   6.382   8.815  -1.671
   91   2HG   GLU  12          2HG       GLU  12   7.903   8.210  -2.309
   92    H    TYR  13           H        TYR  13   6.055   7.284   1.734
   93    HA   TYR  13           HA       TYR  13   6.627   4.817   3.198
   94   1HB   TYR  13          1HB       TYR  13   5.787   6.045   5.152
   95   2HB   TYR  13          2HB       TYR  13   7.214   6.789   4.453
   96    HD1  TYR  13           HD1      TYR  13   6.857   8.754   2.873
   97    HD2  TYR  13           HD2      TYR  13   3.837   7.233   5.451
   98    HE1  TYR  13           HE1      TYR  13   5.610  10.872   2.651
   99    HE2  TYR  13           HE2      TYR  13   2.585   9.346   5.246
  100    HH   TYR  13           HH       TYR  13   2.945  11.452   2.911
  101    H    CYS  14           H        CYS  14   4.707   3.981   4.457
  102    HA   CYS  14           HA       CYS  14   2.420   3.824   2.729
  103   1HB   CYS  14          1HB       CYS  14   2.987   2.629   5.447
  104   2HB   CYS  14          2HB       CYS  14   1.507   2.339   4.545
  105    H    LYS  15           H        LYS  15   0.750   5.172   2.810
  106    HA   LYS  15           HA       LYS  15   0.535   7.074   4.997
  107   1HB   LYS  15          1HB       LYS  15   0.263   7.793   2.620
  108   2HB   LYS  15          2HB       LYS  15  -1.179   6.795   2.512
  109   1HG   LYS  15          1HG       LYS  15  -1.706   9.159   2.836
  110   2HG   LYS  15          2HG       LYS  15  -2.291   8.168   4.171
  111   1HD   LYS  15          1HD       LYS  15  -0.371   8.829   5.522
  112   2HD   LYS  15          2HD       LYS  15   0.257   9.786   4.180
  113   1HE   LYS  15          1HE       LYS  15  -2.428  10.250   5.460
  114   2HE   LYS  15          2HE       LYS  15  -0.957  11.094   5.942
  115   1HZ   LYS  15          1HZ       LYS  15  -2.156  12.457   4.411
  116   2HZ   LYS  15          2HZ       LYS  15  -2.289  11.197   3.282
  117   3HZ   LYS  15          3HZ       LYS  15  -0.773  11.883   3.607
  118    H    PHE  16           H        PHE  16  -0.471   6.412   6.779
  119    HA   PHE  16           HA       PHE  16  -2.805   4.648   6.479
  120   1HB   PHE  16          1HB       PHE  16  -0.858   4.949   8.773
  121   2HB   PHE  16          2HB       PHE  16  -2.334   3.993   8.861
  122    HD1  PHE  16           HD1      PHE  16   0.324   2.833   9.386
  123    HD2  PHE  16           HD2      PHE  16  -1.825   3.259   5.739
  124    HE1  PHE  16           HE1      PHE  16   1.540   0.921   8.450
  125    HE2  PHE  16           HE2      PHE  16  -0.626   1.344   4.796
  126    HZ   PHE  16           HZ       PHE  16   1.085   0.153   6.140
  127    HA   PRO  17           HA       PRO  17  -4.440   4.211   6.830
  128   1HB   PRO  17          1HB       PRO  17  -7.121   4.791   6.656
  129   2HB   PRO  17          2HB       PRO  17  -6.348   4.047   8.060
  130   1HG   PRO  17          1HG       PRO  17  -7.519   6.681   7.848
  131   2HG   PRO  17          2HG       PRO  17  -6.823   5.898   9.276
  132   1HD   PRO  17          1HD       PRO  17  -5.637   7.892   7.466
  133   2HD   PRO  17          2HD       PRO  17  -5.158   7.436   9.114
  134    H    PHE  18           H        PHE  18  -5.042   3.644   4.683
  135    HA   PHE  18           HA       PHE  18  -5.367   5.962   2.907
  136   1HB   PHE  18          1HB       PHE  18  -4.345   4.718   1.102
  137   2HB   PHE  18          2HB       PHE  18  -3.269   4.738   2.488
  138    HD1  PHE  18           HD1      PHE  18  -3.215   2.637   3.961
  139    HD2  PHE  18           HD2      PHE  18  -4.913   2.728   0.062
  140    HE1  PHE  18           HE1      PHE  18  -3.006   0.193   3.814
  141    HE2  PHE  18           HE2      PHE  18  -4.708   0.288  -0.099
  142    HZ   PHE  18           HZ       PHE  18  -3.744  -1.004   1.784
  143    H    LEU  19           H        LEU  19  -6.790   5.793   1.153
  144    HA   LEU  19           HA       LEU  19  -9.104   4.128   1.767
  145   1HB   LEU  19          1HB       LEU  19  -9.225   6.629   1.432
  146   2HB   LEU  19          2HB       LEU  19  -8.868   6.343  -0.259
  147    HG   LEU  19           HG       LEU  19 -10.948   4.887  -0.336
  148   1HD1  LEU  19          1HD1      LEU  19 -12.612   5.641   1.480
  149   2HD1  LEU  19          2HD1      LEU  19 -11.168   6.044   2.411
  150   3HD1  LEU  19          3HD1      LEU  19 -11.443   4.384   1.873
  151   1HD2  LEU  19          1HD2      LEU  19 -11.461   6.791  -1.398
  152   2HD2  LEU  19          2HD2      LEU  19 -10.741   7.801  -0.142
  153   3HD2  LEU  19          3HD2      LEU  19 -12.368   7.158   0.071
  154    H    PHE  20           H        PHE  20  -9.374   2.291   0.739
  155    HA   PHE  20           HA       PHE  20  -8.446   2.035  -2.054
  156   1HB   PHE  20          1HB       PHE  20  -7.188   0.605  -0.339
  157   2HB   PHE  20          2HB       PHE  20  -8.724  -0.200  -0.071
  158    HD1  PHE  20           HD1      PHE  20  -6.991   0.832  -3.217
  159    HD2  PHE  20           HD2      PHE  20  -8.721  -2.255  -0.863
  160    HE1  PHE  20           HE1      PHE  20  -6.588  -0.791  -5.030
  161    HE2  PHE  20           HE2      PHE  20  -8.321  -3.888  -2.665
  162    HZ   PHE  20           HZ       PHE  20  -7.254  -3.144  -4.767
  163    H    ASN  21           H        ASN  21 -10.291   2.293  -3.190
  164    HA   ASN  21           HA       ASN  21 -12.390   1.977  -3.981
  165   1HB   ASN  21          1HB       ASN  21 -11.890  -0.737  -2.765
  166   2HB   ASN  21          2HB       ASN  21 -13.333  -0.364  -3.699
  167   1HD2  ASN  21          1HD2      ASN  21 -13.217  -1.004  -5.698
  168   2HD2  ASN  21          2HD2      ASN  21 -11.804  -1.059  -6.688
  169    H    GLY  22           H        GLY  22 -12.154   3.199  -1.357
  170   1HA   GLY  22          1HA       GLY  22 -13.896   4.140  -0.078
  171   2HA   GLY  22          2HA       GLY  22 -14.914   2.781  -0.513
  172    H    LYS  23           H        LYS  23 -11.893   1.692   0.538
  173    HA   LYS  23           HA       LYS  23 -12.927   1.380   3.282
  174   1HB   LYS  23          1HB       LYS  23 -12.966  -0.723   1.856
  175   2HB   LYS  23          2HB       LYS  23 -11.209  -0.645   1.841
  176   1HG   LYS  23          1HG       LYS  23 -11.248  -0.739   4.327
  177   2HG   LYS  23          2HG       LYS  23 -12.991  -0.997   4.239
  178   1HD   LYS  23          1HD       LYS  23 -10.851  -2.778   3.081
  179   2HD   LYS  23          2HD       LYS  23 -11.832  -3.111   4.511
  180   1HE   LYS  23          1HE       LYS  23 -13.857  -3.011   3.058
  181   2HE   LYS  23          2HE       LYS  23 -12.790  -2.862   1.664
  182   1HZ   LYS  23          1HZ       LYS  23 -11.750  -5.024   2.611
  183   2HZ   LYS  23          2HZ       LYS  23 -13.204  -5.106   1.729
  184   3HZ   LYS  23          3HZ       LYS  23 -13.233  -5.172   3.425
  185    H    GLU  24           H        GLU  24 -11.573   1.970   4.887
  186    HA   GLU  24           HA       GLU  24  -8.944   2.968   4.109
  187   1HB   GLU  24          1HB       GLU  24 -10.452   3.223   6.709
  188   2HB   GLU  24          2HB       GLU  24  -8.918   3.999   6.348
  189   1HG   GLU  24          1HG       GLU  24  -9.952   5.307   4.618
  190   2HG   GLU  24          2HG       GLU  24 -11.485   4.466   4.859
  191    H    TYR  25           H        TYR  25  -7.059   2.073   4.695
  192    HA   TYR  25           HA       TYR  25  -7.169  -0.259   6.487
  193   1HB   TYR  25          1HB       TYR  25  -5.316   0.278   4.179
  194   2HB   TYR  25          2HB       TYR  25  -5.133  -1.077   5.274
  195    HD1  TYR  25           HD1      TYR  25  -7.366   0.445   2.762
  196    HD2  TYR  25           HD2      TYR  25  -6.393  -3.065   4.954
  197    HE1  TYR  25           HE1      TYR  25  -8.916  -0.845   1.346
  198    HE2  TYR  25           HE2      TYR  25  -7.940  -4.374   3.535
  199    HH   TYR  25           HH       TYR  25  -9.174  -4.347   1.627
  200    H    ASN  26           H        ASN  26  -5.906  -0.251   8.250
  201    HA   ASN  26           HA       ASN  26  -4.272   2.135   8.693
  202   1HB   ASN  26          1HB       ASN  26  -5.219  -0.016  10.598
  203   2HB   ASN  26          2HB       ASN  26  -4.184   1.322  11.070
  204   1HD2  ASN  26          1HD2      ASN  26  -6.303   2.353   8.717
  205   2HD2  ASN  26          2HD2      ASN  26  -7.527   3.034   9.730
  206    H    SER  27           H        SER  27  -3.843  -0.731   7.349
  207    HA   SER  27           HA       SER  27  -0.998  -0.747   7.855
  208   1HB   SER  27          1HB       SER  27  -1.024  -3.244   8.315
  209   2HB   SER  27          2HB       SER  27  -1.651  -2.236   9.624
  210    HG   SER  27           HG       SER  27  -3.621  -2.984   9.299
  211    H    CYS  28           H        CYS  28  -0.230  -2.968   6.527
  212    HA   CYS  28           HA       CYS  28  -1.067  -2.368   3.829
  213   1HB   CYS  28          1HB       CYS  28   0.886  -4.474   4.803
  214   2HB   CYS  28          2HB       CYS  28   0.719  -3.884   3.149
  215    H    THR  29           H        THR  29  -2.102  -3.804   2.399
  216    HA   THR  29           HA       THR  29  -3.308  -6.167   3.647
  217    HB   THR  29           HB       THR  29  -4.933  -4.325   3.612
  218    HG1  THR  29           HG1      THR  29  -5.928  -6.240   3.376
  219   1HG2  THR  29          1HG2      THR  29  -4.230  -2.998   1.759
  220   2HG2  THR  29          2HG2      THR  29  -5.872  -3.563   1.450
  221   3HG2  THR  29          3HG2      THR  29  -4.506  -4.328   0.635
  222    H    ASP  30           H        ASP  30  -4.282  -7.665   1.982
  223    HA   ASP  30           HA       ASP  30  -2.465  -7.843  -0.299
  224   1HB   ASP  30          1HB       ASP  30  -4.071 -10.175   0.103
  225   2HB   ASP  30          2HB       ASP  30  -2.345 -10.053  -0.018
  226    H    THR  31           H        THR  31  -5.356  -6.698   0.391
  227    HA   THR  31           HA       THR  31  -7.171  -7.841  -1.410
  228    HB   THR  31           HB       THR  31  -7.077  -4.954  -0.559
  229    HG1  THR  31           HG1      THR  31  -7.000  -6.025   1.340
  230   1HG2  THR  31          1HG2      THR  31  -8.895  -6.169  -2.185
  231   2HG2  THR  31          2HG2      THR  31  -9.183  -4.715  -1.228
  232   3HG2  THR  31          3HG2      THR  31  -9.655  -6.294  -0.600
  233    H    GLY  32           H        GLY  32  -7.635  -7.449  -3.536
  234   1HA   GLY  32          1HA       GLY  32  -7.488  -6.448  -5.627
  235   2HA   GLY  32          2HA       GLY  32  -6.362  -5.287  -4.955
  236    H    ARG  33           H        ARG  33  -4.929  -7.750  -3.797
  237    HA   ARG  33           HA       ARG  33  -3.274  -8.227  -6.170
  238   1HB   ARG  33          1HB       ARG  33  -2.736  -8.621  -3.216
  239   2HB   ARG  33          2HB       ARG  33  -1.616  -9.077  -4.483
  240   1HG   ARG  33          1HG       ARG  33  -2.595  -6.295  -3.904
  241   2HG   ARG  33          2HG       ARG  33  -1.014  -6.940  -3.469
  242   1HD   ARG  33          1HD       ARG  33  -2.096  -6.508  -6.259
  243   2HD   ARG  33          2HD       ARG  33  -0.835  -5.568  -5.464
  244    HE   ARG  33           HE       ARG  33  -0.183  -8.359  -5.657
  245   1HH1  ARG  33          1HH1      ARG  33  -0.194  -5.324  -7.388
  246   2HH1  ARG  33          2HH1      ARG  33   1.042  -5.816  -8.506
  247   1HH2  ARG  33          1HH2      ARG  33   1.380  -9.035  -7.133
  248   2HH2  ARG  33          2HH2      ARG  33   1.947  -7.937  -8.359
  249    H    SER  34           H        SER  34  -3.050 -10.213  -7.028
  250    HA   SER  34           HA       SER  34  -4.825 -12.289  -6.069
  251   1HB   SER  34          1HB       SER  34  -2.930 -12.361  -8.424
  252   2HB   SER  34          2HB       SER  34  -4.315 -13.421  -8.132
  253    HG   SER  34           HG       SER  34  -5.645 -11.509  -8.261
  254    H    ASP  35           H        ASP  35  -1.482 -11.469  -5.840
  255    HA   ASP  35           HA       ASP  35  -0.674 -14.152  -5.225
  256   1HB   ASP  35          1HB       ASP  35   1.262 -12.109  -4.646
  257   2HB   ASP  35          2HB       ASP  35   1.406 -13.494  -5.690
  258    H    GLY  36           H        GLY  36  -2.290 -12.043  -3.463
  259   1HA   GLY  36          1HA       GLY  36  -2.597 -11.705  -1.207
  260   2HA   GLY  36          2HA       GLY  36  -1.750 -13.232  -0.991
  261    H    PHE  37           H        PHE  37  -0.527 -10.207  -2.396
  262    HA   PHE  37           HA       PHE  37   1.662 -10.297  -0.455
  263   1HB   PHE  37          1HB       PHE  37   1.741  -9.978  -3.145
  264   2HB   PHE  37          2HB       PHE  37   1.718  -8.294  -2.629
  265    HD1  PHE  37           HD1      PHE  37   3.360  -8.008  -0.404
  266    HD2  PHE  37           HD2      PHE  37   3.822 -10.755  -3.626
  267    HE1  PHE  37           HE1      PHE  37   5.774  -8.115   0.044
  268    HE2  PHE  37           HE2      PHE  37   6.245 -10.867  -3.185
  269    HZ   PHE  37           HZ       PHE  37   7.225  -9.551  -1.347
  270    H    LEU  38           H        LEU  38   2.116  -8.620   0.916
  271    HA   LEU  38           HA       LEU  38  -0.061  -6.870   1.573
  272   1HB   LEU  38          1HB       LEU  38   2.685  -7.246   2.689
  273   2HB   LEU  38          2HB       LEU  38   1.626  -5.996   3.283
  274    HG   LEU  38           HG       LEU  38   1.577  -7.877   4.783
  275   1HD1  LEU  38          1HD1      LEU  38  -0.791  -8.350   4.833
  276   2HD1  LEU  38          2HD1      LEU  38  -0.957  -7.778   3.173
  277   3HD1  LEU  38          3HD1      LEU  38  -0.499  -6.654   4.456
  278   1HD2  LEU  38          1HD2      LEU  38   2.270  -9.626   3.252
  279   2HD2  LEU  38          2HD2      LEU  38   0.720  -9.524   2.419
  280   3HD2  LEU  38          3HD2      LEU  38   0.783 -10.076   4.091
  281    H    TRP  39           H        TRP  39  -0.370  -4.871   0.781
  282    HA   TRP  39           HA       TRP  39   1.981  -3.340  -0.054
  283   1HB   TRP  39          1HB       TRP  39   0.909  -2.564  -2.084
  284   2HB   TRP  39          2HB       TRP  39   0.984  -4.321  -2.096
  285    HD1  TRP  39           HD1      TRP  39  -1.384  -5.627  -1.684
  286    HE1  TRP  39           HE1      TRP  39  -3.784  -4.903  -2.215
  287    HE3  TRP  39           HE3      TRP  39  -0.622  -0.600  -2.194
  288    HZ2  TRP  39           HZ2      TRP  39  -5.175  -2.508  -2.784
  289    HZ3  TRP  39           HZ3      TRP  39  -2.541   0.830  -2.751
  290    HH2  TRP  39           HH2      TRP  39  -4.765  -0.109  -3.034
  291    H    CYS  40           H        CYS  40   1.338  -1.014  -0.491
  292    HA   CYS  40           HA       CYS  40  -0.967  -0.056   0.985
  293   1HB   CYS  40          1HB       CYS  40   0.261   1.223   2.590
  294   2HB   CYS  40          2HB       CYS  40   0.914  -0.411   2.661
  295    H    SER  41           H        SER  41  -0.858   2.464   0.912
  296    HA   SER  41           HA       SER  41   0.334   3.253  -1.663
  297   1HB   SER  41          1HB       SER  41  -2.172   3.189  -1.703
  298   2HB   SER  41          2HB       SER  41  -2.184   4.397  -0.416
  299    HG   SER  41           HG       SER  41  -0.984   4.735  -2.975
  300    H    THR  42           H        THR  42   0.907   5.556  -1.778
  301    HA   THR  42           HA       THR  42   2.072   6.434   0.757
  302    HB   THR  42           HB       THR  42   2.452   7.726  -1.943
  303    HG1  THR  42           HG1      THR  42   4.167   6.332  -2.288
  304   1HG2  THR  42          1HG2      THR  42   4.115   7.622   0.559
  305   2HG2  THR  42          2HG2      THR  42   3.432   9.038  -0.242
  306   3HG2  THR  42          3HG2      THR  42   4.746   8.143  -1.004
  307    H    THR  43           H        THR  43  -0.652   6.873  -1.062
  308    HA   THR  43           HA       THR  43  -1.166   9.530   0.098
  309    HB   THR  43           HB       THR  43  -2.668   9.877  -1.890
  310    HG1  THR  43           HG1      THR  43  -2.271   7.344  -2.281
  311   1HG2  THR  43          1HG2      THR  43  -0.906  10.246  -3.555
  312   2HG2  THR  43          2HG2      THR  43   0.227   9.372  -2.523
  313   3HG2  THR  43          3HG2      THR  43  -0.483  10.886  -1.966
  314    H    TYR  44           H        TYR  44  -3.677   9.909   0.067
  315    HA   TYR  44           HA       TYR  44  -4.817   7.842   1.698
  316   1HB   TYR  44          1HB       TYR  44  -5.241  10.235   2.147
  317   2HB   TYR  44          2HB       TYR  44  -6.061  10.378   0.594
  318    HD1  TYR  44           HD1      TYR  44  -6.242   8.091   3.575
  319    HD2  TYR  44           HD2      TYR  44  -8.356  10.473   0.752
  320    HE1  TYR  44           HE1      TYR  44  -8.360   7.483   4.657
  321    HE2  TYR  44           HE2      TYR  44 -10.479   9.870   1.826
  322    HH   TYR  44           HH       TYR  44 -10.560   7.804   4.719
  323    H    ASN  45           H        ASN  45  -6.261   9.471  -1.124
  324    HA   ASN  45           HA       ASN  45  -7.747   7.105  -1.789
  325   1HB   ASN  45          1HB       ASN  45  -8.563   9.491  -2.134
  326   2HB   ASN  45          2HB       ASN  45  -7.428   9.611  -3.458
  327   1HD2  ASN  45          1HD2      ASN  45  -8.198   6.625  -3.979
  328   2HD2  ASN  45          2HD2      ASN  45  -9.639   6.862  -4.841
  329    H    PHE  46           H        PHE  46  -6.628   5.431  -2.613
  330    HA   PHE  46           HA       PHE  46  -4.155   5.528  -3.882
  331   1HB   PHE  46          1HB       PHE  46  -5.198   3.485  -2.888
  332   2HB   PHE  46          2HB       PHE  46  -6.294   3.411  -4.288
  333    HD1  PHE  46           HD1      PHE  46  -5.548   1.232  -5.006
  334    HD2  PHE  46           HD2      PHE  46  -2.721   4.386  -4.552
  335    HE1  PHE  46           HE1      PHE  46  -3.877  -0.092  -6.218
  336    HE2  PHE  46           HE2      PHE  46  -1.053   3.062  -5.765
  337    HZ   PHE  46           HZ       PHE  46  -1.630   0.816  -6.599
  338    H    GLU  47           H        GLU  47  -7.379   5.314  -5.346
  339    HA   GLU  47           HA       GLU  47  -6.641   5.094  -8.018
  340   1HB   GLU  47          1HB       GLU  47  -8.941   4.925  -6.848
  341   2HB   GLU  47          2HB       GLU  47  -9.044   6.655  -7.127
  342   1HG   GLU  47          1HG       GLU  47  -8.821   6.290  -9.525
  343   2HG   GLU  47          2HG       GLU  47  -8.702   4.553  -9.251
  344    H    LYS  48           H        LYS  48  -7.135   7.992  -6.073
  345    HA   LYS  48           HA       LYS  48  -7.015   9.871  -8.122
  346   1HB   LYS  48          1HB       LYS  48  -7.887  10.648  -6.102
  347   2HB   LYS  48          2HB       LYS  48  -6.567   9.991  -5.156
  348   1HG   LYS  48          1HG       LYS  48  -5.090  11.767  -5.934
  349   2HG   LYS  48          2HG       LYS  48  -6.372  12.413  -6.965
  350   1HD   LYS  48          1HD       LYS  48  -7.736  12.901  -5.034
  351   2HD   LYS  48          2HD       LYS  48  -6.550  12.149  -3.968
  352   1HE   LYS  48          1HE       LYS  48  -4.919  13.837  -4.503
  353   2HE   LYS  48          2HE       LYS  48  -5.994  14.552  -5.705
  354   1HZ   LYS  48          1HZ       LYS  48  -5.778  15.360  -3.145
  355   2HZ   LYS  48          2HZ       LYS  48  -7.130  14.338  -3.051
  356   3HZ   LYS  48          3HZ       LYS  48  -7.131  15.649  -4.135
  357    H    ASP  49           H        ASP  49  -4.355   8.589  -6.120
  358    HA   ASP  49           HA       ASP  49  -2.513  10.132  -7.782
  359   1HB   ASP  49          1HB       ASP  49  -2.323   8.992  -5.035
  360   2HB   ASP  49          2HB       ASP  49  -0.838   9.286  -5.940
  361    H    GLY  50           H        GLY  50  -2.458   6.856  -6.303
  362   1HA   GLY  50          1HA       GLY  50  -2.339   4.913  -7.706
  363   2HA   GLY  50          2HA       GLY  50  -1.526   5.889  -8.908
  364    H    LYS  51           H        LYS  51  -0.199   6.561  -5.897
  365    HA   LYS  51           HA       LYS  51   2.175   5.036  -6.579
  366   1HB   LYS  51          1HB       LYS  51   1.596   6.976  -4.347
  367   2HB   LYS  51          2HB       LYS  51   3.118   6.119  -4.495
  368   1HG   LYS  51          1HG       LYS  51   3.811   7.814  -5.722
  369   2HG   LYS  51          2HG       LYS  51   2.726   7.234  -6.985
  370   1HD   LYS  51          1HD       LYS  51   2.273   9.555  -6.650
  371   2HD   LYS  51          2HD       LYS  51   0.920   8.639  -5.983
  372   1HE   LYS  51          1HE       LYS  51   1.647  10.505  -4.528
  373   2HE   LYS  51          2HE       LYS  51   1.758   8.927  -3.743
  374   1HZ   LYS  51          1HZ       LYS  51   4.106   8.908  -4.022
  375   2HZ   LYS  51          2HZ       LYS  51   3.708  10.439  -3.397
  376   3HZ   LYS  51          3HZ       LYS  51   4.076  10.268  -5.050
  377    H    TYR  52           H        TYR  52   2.724   3.111  -5.746
  378    HA   TYR  52           HA       TYR  52   1.577   2.266  -3.190
  379   1HB   TYR  52          1HB       TYR  52   0.776   0.178  -4.051
  380   2HB   TYR  52          2HB       TYR  52   0.114   1.444  -5.080
  381    HD1  TYR  52           HD1      TYR  52   1.516   1.983  -7.253
  382    HD2  TYR  52           HD2      TYR  52   1.832  -1.631  -5.027
  383    HE1  TYR  52           HE1      TYR  52   2.508   0.871  -9.205
  384    HE2  TYR  52           HE2      TYR  52   2.825  -2.748  -6.974
  385    HH   TYR  52           HH       TYR  52   2.639  -1.626 -10.027
  386    H    GLY  53           H        GLY  53   2.540   0.210  -2.456
  387   1HA   GLY  53          1HA       GLY  53   4.987  -0.720  -3.577
  388   2HA   GLY  53          2HA       GLY  53   5.253   0.289  -2.160
  389    H    PHE  54           H        PHE  54   5.869  -2.501  -2.377
  390    HA   PHE  54           HA       PHE  54   3.788  -3.775  -0.786
  391   1HB   PHE  54          1HB       PHE  54   6.244  -4.966  -2.049
  392   2HB   PHE  54          2HB       PHE  54   5.012  -5.869  -1.178
  393    HD1  PHE  54           HD1      PHE  54   5.651  -3.824  -4.185
  394    HD2  PHE  54           HD2      PHE  54   2.980  -6.486  -2.214
  395    HE1  PHE  54           HE1      PHE  54   4.350  -4.027  -6.252
  396    HE2  PHE  54           HE2      PHE  54   1.670  -6.701  -4.287
  397    HZ   PHE  54           HZ       PHE  54   2.354  -5.481  -6.309
  398    H    CYS  55           H        CYS  55   4.011  -4.481   1.227
  399    HA   CYS  55           HA       CYS  55   6.352  -3.514   2.708
  400   1HB   CYS  55          1HB       CYS  55   3.902  -4.562   4.059
  401   2HB   CYS  55          2HB       CYS  55   4.965  -3.251   4.540
  402    HA   PRO  56           HA       PRO  56   7.494  -7.755   3.387
  403   1HB   PRO  56          1HB       PRO  56   9.260  -7.459   5.382
  404   2HB   PRO  56          2HB       PRO  56   9.603  -6.898   3.744
  405   1HG   PRO  56          1HG       PRO  56   8.826  -5.335   6.160
  406   2HG   PRO  56          2HG       PRO  56   9.904  -4.888   4.828
  407   1HD   PRO  56          1HD       PRO  56   7.242  -4.088   5.119
  408   2HD   PRO  56          2HD       PRO  56   8.197  -3.993   3.626
  409    H    HIS  57           H        HIS  57   8.277  -7.469   6.595
  410    HA   HIS  57           HA       HIS  57   5.627  -8.319   7.525
  411   1HB   HIS  57          1HB       HIS  57   6.994  -9.887   9.113
  412   2HB   HIS  57          2HB       HIS  57   6.627 -10.411   7.476
  413    HD1  HIS  57           HD1      HIS  57   8.681 -10.092   5.711
  414    HD2  HIS  57           HD2      HIS  57   9.633  -9.940   9.766
  415    HE1  HIS  57           HE1      HIS  57  11.179 -10.422   5.844
  416    H    GLU  58           H        GLU  58   5.634  -6.022   8.120
  417    HA   GLU  58           HA       GLU  58   7.398  -5.006  10.081
  418   1HB   GLU  58          1HB       GLU  58   4.673  -3.895   9.881
  419   2HB   GLU  58          2HB       GLU  58   6.212  -3.069   9.916
  420   1HG   GLU  58          1HG       GLU  58   5.507  -2.621   7.785
  421   2HG   GLU  58          2HG       GLU  58   6.501  -4.054   7.529
  422    H    ALA  59           H        ALA  59   3.925  -5.728  10.390
  423    HA   ALA  59           HA       ALA  59   4.460  -6.634  13.132
  424   1HB   ALA  59          1HB       ALA  59   3.186  -5.027  13.978
  425   2HB   ALA  59          2HB       ALA  59   1.823  -5.587  13.011
  426   3HB   ALA  59          3HB       ALA  59   2.924  -4.374  12.358
  Start of MODEL   36
    1   1H    ARG   1          1H        ARG   1   9.672   7.494   9.374
    2   2H    ARG   1          2H        ARG   1   9.832   7.839   7.694
    3   3H    ARG   1          3H        ARG   1  10.990   6.844   8.486
    4    HA   ARG   1           HA       ARG   1   9.443   5.167   8.815
    5   1HB   ARG   1          1HB       ARG   1   7.112   5.457   7.916
    6   2HB   ARG   1          2HB       ARG   1   7.496   6.411   9.344
    7   1HG   ARG   1          1HG       ARG   1   8.068   8.273   7.737
    8   2HG   ARG   1          2HG       ARG   1   7.258   7.300   6.509
    9   1HD   ARG   1          1HD       ARG   1   6.073   8.410   9.051
   10   2HD   ARG   1          2HD       ARG   1   5.700   8.909   7.405
   11    HE   ARG   1           HE       ARG   1   5.072   6.211   7.550
   12   1HH1  ARG   1          1HH1      ARG   1   4.147   9.190   9.135
   13   2HH1  ARG   1          2HH1      ARG   1   2.528   8.662   9.484
   14   1HH2  ARG   1          1HH2      ARG   1   2.945   5.508   7.992
   15   2HH2  ARG   1          2HH2      ARG   1   1.834   6.559   8.815
   16    H    ILE   2           H        ILE   2   9.645   3.549   7.331
   17    HA   ILE   2           HA       ILE   2   9.400   4.110   4.523
   18    HB   ILE   2           HB       ILE   2  11.668   4.929   4.989
   19   1HG1  ILE   2          1HG1      ILE   2  12.878   3.607   3.271
   20   2HG1  ILE   2          2HG1      ILE   2  11.583   2.418   3.309
   21   1HG2  ILE   2          1HG2      ILE   2  11.866   2.483   6.477
   22   2HG2  ILE   2          2HG2      ILE   2  12.925   3.898   6.489
   23   3HG2  ILE   2          3HG2      ILE   2  13.187   2.610   5.311
   24   1HD1  ILE   2          1HD1      ILE   2  11.637   4.276   1.487
   25   2HD1  ILE   2          2HD1      ILE   2  10.932   5.266   2.767
   26   3HD1  ILE   2          3HD1      ILE   2  10.110   3.799   2.228
   27    HA   PRO   3           HA       PRO   3   8.860  -0.404   5.690
   28   1HB   PRO   3          1HB       PRO   3   6.009  -0.194   5.840
   29   2HB   PRO   3          2HB       PRO   3   7.139  -0.523   7.155
   30   1HG   PRO   3          1HG       PRO   3   5.633   1.767   6.961
   31   2HG   PRO   3          2HG       PRO   3   7.164   1.654   7.849
   32   1HD   PRO   3          1HD       PRO   3   6.665   2.697   5.067
   33   2HD   PRO   3          2HD       PRO   3   7.683   3.381   6.359
   34    H    VAL   4           H        VAL   4   9.074   0.959   3.174
   35    HA   VAL   4           HA       VAL   4   7.192  -0.645   1.556
   36    HB   VAL   4           HB       VAL   4   8.355   2.066   0.771
   37   1HG1  VAL   4          1HG1      VAL   4   6.410   0.212  -0.601
   38   2HG1  VAL   4          2HG1      VAL   4   7.993   0.731  -1.178
   39   3HG1  VAL   4          3HG1      VAL   4   6.671   1.892  -1.077
   40   1HG2  VAL   4          1HG2      VAL   4   6.516   3.120   1.520
   41   2HG2  VAL   4          2HG2      VAL   4   6.312   1.705   2.554
   42   3HG2  VAL   4          3HG2      VAL   4   5.438   1.811   1.026
   43    H    LYS   5           H        LYS   5   8.072  -1.799  -0.138
   44    HA   LYS   5           HA       LYS   5  11.015  -1.718  -0.326
   45   1HB   LYS   5          1HB       LYS   5   9.150  -3.893   0.133
   46   2HB   LYS   5          2HB       LYS   5  10.181  -4.206  -1.254
   47   1HG   LYS   5          1HG       LYS   5  11.141  -3.538   1.529
   48   2HG   LYS   5          2HG       LYS   5  11.096  -5.150   0.796
   49   1HD   LYS   5          1HD       LYS   5  12.691  -4.464  -0.893
   50   2HD   LYS   5          2HD       LYS   5  12.695  -2.817  -0.258
   51   1HE   LYS   5          1HE       LYS   5  13.575  -5.281   1.250
   52   2HE   LYS   5          2HE       LYS   5  14.656  -4.121   0.483
   53   1HZ   LYS   5          1HZ       LYS   5  12.913  -2.708   2.175
   54   2HZ   LYS   5          2HZ       LYS   5  14.591  -2.908   2.316
   55   3HZ   LYS   5          3HZ       LYS   5  13.542  -4.019   3.055
   56    H    TYR   6           H        TYR   6   8.583  -3.379  -2.279
   57    HA   TYR   6           HA       TYR   6   9.865  -2.311  -4.676
   58   1HB   TYR   6          1HB       TYR   6   7.744  -4.460  -4.502
   59   2HB   TYR   6          2HB       TYR   6   8.808  -4.112  -5.864
   60    HD1  TYR   6           HD1      TYR   6  11.449  -4.076  -5.001
   61    HD2  TYR   6           HD2      TYR   6   8.291  -6.441  -3.400
   62    HE1  TYR   6           HE1      TYR   6  13.089  -5.685  -4.152
   63    HE2  TYR   6           HE2      TYR   6   9.929  -8.054  -2.546
   64    HH   TYR   6           HH       TYR   6  12.172  -8.763  -2.915
   65    H    GLY   7           H        GLY   7   8.251  -2.046  -6.585
   66   1HA   GLY   7          1HA       GLY   7   6.064  -1.298  -7.273
   67   2HA   GLY   7          2HA       GLY   7   5.840  -0.572  -5.692
   68    H    ASN   8           H        ASN   8   5.361   1.453  -6.688
   69    HA   ASN   8           HA       ASN   8   7.706   2.647  -7.990
   70   1HB   ASN   8          1HB       ASN   8   6.280   4.212  -9.117
   71   2HB   ASN   8          2HB       ASN   8   5.635   2.593  -9.355
   72   1HD2  ASN   8          1HD2      ASN   8   4.304   5.133  -9.613
   73   2HD2  ASN   8          2HD2      ASN   8   2.987   5.118  -8.495
   74    H    ALA   9           H        ALA   9   6.396   2.546  -5.041
   75    HA   ALA   9           HA       ALA   9   6.660   5.338  -4.302
   76   1HB   ALA   9          1HB       ALA   9   6.473   3.283  -2.202
   77   2HB   ALA   9          2HB       ALA   9   5.102   3.367  -3.313
   78   3HB   ALA   9          3HB       ALA   9   5.577   4.796  -2.391
   79    H    ASP  10           H        ASP  10   8.995   4.967  -5.262
   80    HA   ASP  10           HA       ASP  10  10.864   3.642  -3.552
   81   1HB   ASP  10          1HB       ASP  10  11.236   3.929  -5.993
   82   2HB   ASP  10          2HB       ASP  10  11.407   5.665  -5.734
   83    H    GLY  11           H        GLY  11  11.334   4.374  -1.601
   84   1HA   GLY  11          1HA       GLY  11  12.354   5.851  -0.100
   85   2HA   GLY  11          2HA       GLY  11  12.221   7.130  -1.304
   86    H    GLU  12           H        GLU  12   9.288   5.775  -1.297
   87    HA   GLU  12           HA       GLU  12   8.218   7.839   0.434
   88   1HB   GLU  12          1HB       GLU  12   7.043   6.071  -1.690
   89   2HB   GLU  12          2HB       GLU  12   6.012   7.001  -0.609
   90   1HG   GLU  12          1HG       GLU  12   6.413   8.906  -1.683
   91   2HG   GLU  12          2HG       GLU  12   8.142   8.596  -1.765
   92    H    TYR  13           H        TYR  13   6.464   7.373   1.924
   93    HA   TYR  13           HA       TYR  13   6.844   4.822   3.296
   94   1HB   TYR  13          1HB       TYR  13   6.113   6.068   5.274
   95   2HB   TYR  13          2HB       TYR  13   7.584   6.704   4.540
   96    HD1  TYR  13           HD1      TYR  13   3.915   7.214   4.738
   97    HD2  TYR  13           HD2      TYR  13   7.720   8.907   3.908
   98    HE1  TYR  13           HE1      TYR  13   2.881   9.451   4.624
   99    HE2  TYR  13           HE2      TYR  13   6.709  11.152   3.786
  100    HH   TYR  13           HH       TYR  13   4.512  12.167   3.372
  101    H    CYS  14           H        CYS  14   4.900   4.102   4.621
  102    HA   CYS  14           HA       CYS  14   2.616   4.003   2.882
  103   1HB   CYS  14          1HB       CYS  14   3.084   2.777   5.604
  104   2HB   CYS  14          2HB       CYS  14   1.696   2.448   4.576
  105    H    LYS  15           H        LYS  15   0.810   5.197   3.065
  106    HA   LYS  15           HA       LYS  15   0.649   7.048   5.323
  107   1HB   LYS  15          1HB       LYS  15   0.449   7.973   3.017
  108   2HB   LYS  15          2HB       LYS  15  -0.995   6.997   2.782
  109   1HG   LYS  15          1HG       LYS  15  -2.201   8.231   4.415
  110   2HG   LYS  15          2HG       LYS  15  -0.743   9.073   4.948
  111   1HD   LYS  15          1HD       LYS  15  -0.578  10.150   2.741
  112   2HD   LYS  15          2HD       LYS  15  -2.045   9.311   2.232
  113   1HE   LYS  15          1HE       LYS  15  -3.332  10.464   3.937
  114   2HE   LYS  15          2HE       LYS  15  -1.874  11.242   4.545
  115   1HZ   LYS  15          1HZ       LYS  15  -2.527  11.649   1.717
  116   2HZ   LYS  15          2HZ       LYS  15  -1.826  12.716   2.834
  117   3HZ   LYS  15          3HZ       LYS  15  -3.505  12.439   2.865
  118    H    PHE  16           H        PHE  16  -0.454   6.383   7.013
  119    HA   PHE  16           HA       PHE  16  -2.778   4.630   6.588
  120   1HB   PHE  16          1HB       PHE  16  -0.955   4.899   8.982
  121   2HB   PHE  16          2HB       PHE  16  -2.399   3.892   8.940
  122    HD1  PHE  16           HD1      PHE  16   0.341   2.900   9.571
  123    HD2  PHE  16           HD2      PHE  16  -1.742   3.195   5.874
  124    HE1  PHE  16           HE1      PHE  16   1.683   1.055   8.675
  125    HE2  PHE  16           HE2      PHE  16  -0.408   1.350   4.966
  126    HZ   PHE  16           HZ       PHE  16   1.324   0.249   6.365
  127    HA   PRO  17           HA       PRO  17  -4.498   4.242   6.806
  128   1HB   PRO  17          1HB       PRO  17  -7.092   4.730   6.518
  129   2HB   PRO  17          2HB       PRO  17  -6.427   4.318   8.107
  130   1HG   PRO  17          1HG       PRO  17  -7.262   6.990   7.048
  131   2HG   PRO  17          2HG       PRO  17  -7.407   6.339   8.690
  132   1HD   PRO  17          1HD       PRO  17  -5.391   8.065   7.746
  133   2HD   PRO  17          2HD       PRO  17  -5.377   7.161   9.271
  134    H    PHE  18           H        PHE  18  -5.525   3.823   4.709
  135    HA   PHE  18           HA       PHE  18  -5.532   6.148   2.930
  136   1HB   PHE  18          1HB       PHE  18  -4.433   4.910   1.143
  137   2HB   PHE  18          2HB       PHE  18  -3.400   4.981   2.561
  138    HD1  PHE  18           HD1      PHE  18  -3.281   2.914   4.054
  139    HD2  PHE  18           HD2      PHE  18  -4.978   2.876   0.152
  140    HE1  PHE  18           HE1      PHE  18  -2.974   0.478   3.939
  141    HE2  PHE  18           HE2      PHE  18  -4.669   0.445   0.030
  142    HZ   PHE  18           HZ       PHE  18  -3.664  -0.775   1.926
  143    H    LEU  19           H        LEU  19  -6.890   5.960   1.080
  144    HA   LEU  19           HA       LEU  19  -9.208   4.288   1.612
  145   1HB   LEU  19          1HB       LEU  19  -9.389   6.745   1.199
  146   2HB   LEU  19          2HB       LEU  19  -8.842   6.459  -0.446
  147    HG   LEU  19           HG       LEU  19 -10.869   4.912  -0.666
  148   1HD1  LEU  19          1HD1      LEU  19 -11.873   4.497   1.297
  149   2HD1  LEU  19          2HD1      LEU  19 -12.676   6.042   0.999
  150   3HD1  LEU  19          3HD1      LEU  19 -11.253   5.973   2.040
  151   1HD2  LEU  19          1HD2      LEU  19 -11.397   6.676  -1.911
  152   2HD2  LEU  19          2HD2      LEU  19 -10.658   7.798  -0.771
  153   3HD2  LEU  19          3HD2      LEU  19 -12.317   7.258  -0.516
  154    H    PHE  20           H        PHE  20  -9.492   2.414   0.625
  155    HA   PHE  20           HA       PHE  20  -8.472   2.079  -2.131
  156   1HB   PHE  20          1HB       PHE  20  -7.162   0.767  -0.347
  157   2HB   PHE  20          2HB       PHE  20  -8.662  -0.101  -0.081
  158    HD1  PHE  20           HD1      PHE  20  -6.967   0.934  -3.252
  159    HD2  PHE  20           HD2      PHE  20  -8.533  -2.177  -0.809
  160    HE1  PHE  20           HE1      PHE  20  -6.497  -0.721  -5.027
  161    HE2  PHE  20           HE2      PHE  20  -8.068  -3.829  -2.563
  162    HZ   PHE  20           HZ       PHE  20  -7.049  -3.095  -4.690
  163    H    ASN  21           H        ASN  21 -10.351   2.201  -3.291
  164    HA   ASN  21           HA       ASN  21 -12.420   1.685  -4.095
  165   1HB   ASN  21          1HB       ASN  21 -11.815  -0.880  -2.621
  166   2HB   ASN  21          2HB       ASN  21 -13.261  -0.662  -3.598
  167   1HD2  ASN  21          1HD2      ASN  21 -11.179   1.159  -5.209
  168   2HD2  ASN  21          2HD2      ASN  21 -10.481  -0.009  -6.273
  169    H    GLY  22           H        GLY  22 -12.132   2.975  -1.401
  170   1HA   GLY  22          1HA       GLY  22 -13.908   3.986  -0.202
  171   2HA   GLY  22          2HA       GLY  22 -14.931   2.621  -0.616
  172    H    LYS  23           H        LYS  23 -12.014   1.405   0.376
  173    HA   LYS  23           HA       LYS  23 -12.999   1.108   3.141
  174   1HB   LYS  23          1HB       LYS  23 -12.946  -0.983   1.702
  175   2HB   LYS  23          2HB       LYS  23 -11.200  -0.814   1.644
  176   1HG   LYS  23          1HG       LYS  23 -11.077  -1.080   4.061
  177   2HG   LYS  23          2HG       LYS  23 -12.834  -1.212   4.147
  178   1HD   LYS  23          1HD       LYS  23 -12.735  -3.209   2.714
  179   2HD   LYS  23          2HD       LYS  23 -10.971  -3.093   2.704
  180   1HE   LYS  23          1HE       LYS  23 -10.962  -3.346   5.152
  181   2HE   LYS  23          2HE       LYS  23 -12.719  -3.500   5.138
  182   1HZ   LYS  23          1HZ       LYS  23 -12.469  -5.490   3.738
  183   2HZ   LYS  23          2HZ       LYS  23 -11.708  -5.665   5.249
  184   3HZ   LYS  23          3HZ       LYS  23 -10.778  -5.363   3.860
  185    H    GLU  24           H        GLU  24 -11.702   1.868   4.718
  186    HA   GLU  24           HA       GLU  24  -9.089   2.906   3.942
  187   1HB   GLU  24          1HB       GLU  24 -10.598   3.243   6.539
  188   2HB   GLU  24          2HB       GLU  24  -9.147   4.110   6.065
  189   1HG   GLU  24          1HG       GLU  24 -10.390   5.133   4.214
  190   2HG   GLU  24          2HG       GLU  24 -11.841   4.282   4.748
  191    H    TYR  25           H        TYR  25  -7.192   2.104   4.634
  192    HA   TYR  25           HA       TYR  25  -7.278  -0.200   6.474
  193   1HB   TYR  25          1HB       TYR  25  -5.354   0.385   4.236
  194   2HB   TYR  25          2HB       TYR  25  -5.202  -0.972   5.341
  195    HD1  TYR  25           HD1      TYR  25  -7.447  -2.434   5.499
  196    HD2  TYR  25           HD2      TYR  25  -6.294  -0.005   2.211
  197    HE1  TYR  25           HE1      TYR  25  -8.878  -3.779   4.012
  198    HE2  TYR  25           HE2      TYR  25  -7.719  -1.341   0.711
  199    HH   TYR  25           HH       TYR  25  -8.989  -4.328   1.562
  200    H    ASN  26           H        ASN  26  -5.983  -0.197   8.247
  201    HA   ASN  26           HA       ASN  26  -4.445   2.253   8.735
  202   1HB   ASN  26          1HB       ASN  26  -5.509   0.101  10.554
  203   2HB   ASN  26          2HB       ASN  26  -4.266   1.222  11.095
  204   1HD2  ASN  26          1HD2      ASN  26  -6.451   2.514   8.832
  205   2HD2  ASN  26          2HD2      ASN  26  -7.433   3.400   9.946
  206    H    SER  27           H        SER  27  -3.910  -0.596   7.376
  207    HA   SER  27           HA       SER  27  -1.075  -0.500   7.865
  208   1HB   SER  27          1HB       SER  27  -1.147  -3.080   8.322
  209   2HB   SER  27          2HB       SER  27  -1.428  -1.949   9.655
  210    HG   SER  27           HG       SER  27  -3.273  -3.575   8.261
  211    H    CYS  28           H        CYS  28  -0.267  -2.812   6.702
  212    HA   CYS  28           HA       CYS  28  -0.899  -2.340   3.948
  213   1HB   CYS  28          1HB       CYS  28   0.636  -4.693   5.047
  214   2HB   CYS  28          2HB       CYS  28   0.758  -3.979   3.445
  215    H    THR  29           H        THR  29  -1.918  -3.773   2.482
  216    HA   THR  29           HA       THR  29  -3.351  -6.031   3.651
  217    HB   THR  29           HB       THR  29  -4.855  -4.047   3.602
  218    HG1  THR  29           HG1      THR  29  -6.161  -5.688   3.430
  219   1HG2  THR  29          1HG2      THR  29  -3.870  -3.050   1.498
  220   2HG2  THR  29          2HG2      THR  29  -5.627  -3.037   1.629
  221   3HG2  THR  29          3HG2      THR  29  -4.827  -4.231   0.606
  222    H    ASP  30           H        ASP  30  -4.258  -7.481   1.920
  223    HA   ASP  30           HA       ASP  30  -2.462  -7.474  -0.387
  224   1HB   ASP  30          1HB       ASP  30  -3.820  -9.970   0.005
  225   2HB   ASP  30          2HB       ASP  30  -2.128  -9.673  -0.230
  226    H    THR  31           H        THR  31  -5.355  -6.507   0.372
  227    HA   THR  31           HA       THR  31  -7.144  -7.746  -1.420
  228    HB   THR  31           HB       THR  31  -7.242  -4.884  -0.488
  229    HG1  THR  31           HG1      THR  31  -6.927  -6.023   1.369
  230   1HG2  THR  31          1HG2      THR  31  -9.429  -4.849  -0.960
  231   2HG2  THR  31          2HG2      THR  31  -9.669  -6.521  -0.449
  232   3HG2  THR  31          3HG2      THR  31  -9.029  -6.172  -2.056
  233    H    GLY  32           H        GLY  32  -7.830  -7.132  -3.488
  234   1HA   GLY  32          1HA       GLY  32  -7.781  -5.955  -5.494
  235   2HA   GLY  32          2HA       GLY  32  -6.527  -4.924  -4.821
  236    H    ARG  33           H        ARG  33  -5.087  -7.460  -3.979
  237    HA   ARG  33           HA       ARG  33  -3.685  -7.843  -6.514
  238   1HB   ARG  33          1HB       ARG  33  -2.924  -8.718  -3.713
  239   2HB   ARG  33          2HB       ARG  33  -1.903  -8.810  -5.140
  240   1HG   ARG  33          1HG       ARG  33  -2.958  -6.247  -3.960
  241   2HG   ARG  33          2HG       ARG  33  -1.357  -6.916  -3.644
  242   1HD   ARG  33          1HD       ARG  33  -2.422  -6.160  -6.366
  243   2HD   ARG  33          2HD       ARG  33  -1.354  -5.149  -5.392
  244    HE   ARG  33           HE       ARG  33  -0.269  -7.768  -5.814
  245   1HH1  ARG  33          1HH1      ARG  33  -0.656  -4.594  -7.234
  246   2HH1  ARG  33          2HH1      ARG  33   0.645  -4.801  -8.371
  247   1HH2  ARG  33          1HH2      ARG  33   1.493  -8.018  -7.257
  248   2HH2  ARG  33          2HH2      ARG  33   1.880  -6.742  -8.369
  249    H    SER  34           H        SER  34  -2.898 -10.129  -6.941
  250    HA   SER  34           HA       SER  34  -5.090 -12.001  -6.333
  251   1HB   SER  34          1HB       SER  34  -3.158 -12.123  -8.656
  252   2HB   SER  34          2HB       SER  34  -4.611 -13.097  -8.430
  253    HG   SER  34           HG       SER  34  -4.724 -11.176  -9.870
  254    H    ASP  35           H        ASP  35  -1.679 -11.489  -5.983
  255    HA   ASP  35           HA       ASP  35  -1.264 -14.284  -5.335
  256   1HB   ASP  35          1HB       ASP  35   0.649 -12.090  -5.883
  257   2HB   ASP  35          2HB       ASP  35   1.135 -13.693  -5.409
  258    H    GLY  36           H        GLY  36  -2.478 -12.081  -3.583
  259   1HA   GLY  36          1HA       GLY  36  -2.516 -11.611  -1.343
  260   2HA   GLY  36          2HA       GLY  36  -1.596 -13.090  -1.130
  261    H    PHE  37           H        PHE  37  -0.589 -10.176  -2.866
  262    HA   PHE  37           HA       PHE  37   1.802 -10.097  -1.228
  263   1HB   PHE  37          1HB       PHE  37   0.940  -8.774  -3.750
  264   2HB   PHE  37          2HB       PHE  37   2.160  -7.970  -2.783
  265    HD1  PHE  37           HD1      PHE  37   3.357  -8.337  -5.073
  266    HD2  PHE  37           HD2      PHE  37   2.399 -11.453  -2.341
  267    HE1  PHE  37           HE1      PHE  37   5.069  -9.761  -6.111
  268    HE2  PHE  37           HE2      PHE  37   4.115 -12.886  -3.372
  269    HZ   PHE  37           HZ       PHE  37   5.451 -12.047  -5.253
  270    H    LEU  38           H        LEU  38   2.121  -8.813   0.431
  271    HA   LEU  38           HA       LEU  38  -0.010  -7.107   1.355
  272   1HB   LEU  38          1HB       LEU  38   1.681  -8.607   2.693
  273   2HB   LEU  38          2HB       LEU  38   2.729  -7.206   2.570
  274    HG   LEU  38           HG       LEU  38   1.003  -5.847   3.723
  275   1HD1  LEU  38          1HD1      LEU  38  -0.670  -7.977   3.072
  276   2HD1  LEU  38          2HD1      LEU  38  -1.065  -6.578   4.073
  277   3HD1  LEU  38          3HD1      LEU  38  -0.477  -8.061   4.822
  278   1HD2  LEU  38          1HD2      LEU  38   2.530  -8.052   4.859
  279   2HD2  LEU  38          2HD2      LEU  38   1.156  -7.580   5.857
  280   3HD2  LEU  38          3HD2      LEU  38   2.368  -6.382   5.411
  281    H    TRP  39           H        TRP  39  -0.268  -5.096   0.631
  282    HA   TRP  39           HA       TRP  39   2.138  -3.489   0.086
  283   1HB   TRP  39          1HB       TRP  39   1.078  -2.504  -1.875
  284   2HB   TRP  39          2HB       TRP  39   1.176  -4.247  -2.051
  285    HD1  TRP  39           HD1      TRP  39  -1.171  -5.629  -1.868
  286    HE1  TRP  39           HE1      TRP  39  -3.586  -4.903  -2.311
  287    HE3  TRP  39           HE3      TRP  39  -0.552  -0.553  -1.746
  288    HZ2  TRP  39           HZ2      TRP  39  -5.038  -2.510  -2.590
  289    HZ3  TRP  39           HZ3      TRP  39  -2.512   0.879  -2.131
  290    HH2  TRP  39           HH2      TRP  39  -4.712  -0.092  -2.539
  291    H    CYS  40           H        CYS  40   1.578  -1.127  -0.149
  292    HA   CYS  40           HA       CYS  40  -0.695  -0.263   1.470
  293   1HB   CYS  40          1HB       CYS  40   0.608   0.979   3.021
  294   2HB   CYS  40          2HB       CYS  40   1.380  -0.601   2.937
  295    H    SER  41           H        SER  41  -0.804   2.218   1.365
  296    HA   SER  41           HA       SER  41   0.092   3.041  -1.307
  297   1HB   SER  41          1HB       SER  41  -2.365   2.986  -0.980
  298   2HB   SER  41          2HB       SER  41  -2.201   4.157   0.328
  299    HG   SER  41           HG       SER  41  -2.219   5.653  -1.129
  300    H    THR  42           H        THR  42   0.658   5.316  -1.547
  301    HA   THR  42           HA       THR  42   2.139   6.280   0.805
  302    HB   THR  42           HB       THR  42   2.324   7.267  -2.046
  303    HG1  THR  42           HG1      THR  42   3.050   4.898  -1.166
  304   1HG2  THR  42          1HG2      THR  42   4.514   8.060  -1.449
  305   2HG2  THR  42          2HG2      THR  42   4.339   7.415   0.183
  306   3HG2  THR  42          3HG2      THR  42   3.313   8.746  -0.354
  307    H    THR  43           H        THR  43  -0.396   6.999  -1.418
  308    HA   THR  43           HA       THR  43  -0.893   9.599  -0.137
  309    HB   THR  43           HB       THR  43  -2.341  10.032  -2.122
  310    HG1  THR  43           HG1      THR  43  -2.764   8.502  -3.488
  311   1HG2  THR  43          1HG2      THR  43   0.192  10.517  -2.072
  312   2HG2  THR  43          2HG2      THR  43  -0.670  10.581  -3.611
  313   3HG2  THR  43          3HG2      THR  43   0.301   9.166  -3.202
  314    H    TYR  44           H        TYR  44  -3.334  10.074   0.069
  315    HA   TYR  44           HA       TYR  44  -4.503   7.946   1.584
  316   1HB   TYR  44          1HB       TYR  44  -4.907  10.311   2.193
  317   2HB   TYR  44          2HB       TYR  44  -5.770  10.553   0.673
  318    HD1  TYR  44           HD1      TYR  44  -5.847   8.143   3.553
  319    HD2  TYR  44           HD2      TYR  44  -8.086  10.536   0.834
  320    HE1  TYR  44           HE1      TYR  44  -7.932   7.408   4.624
  321    HE2  TYR  44           HE2      TYR  44 -10.171   9.808   1.904
  322    HH   TYR  44           HH       TYR  44 -10.152   7.473   4.583
  323    H    ASN  45           H        ASN  45  -5.370   9.567  -1.468
  324    HA   ASN  45           HA       ASN  45  -7.284   7.447  -2.000
  325   1HB   ASN  45          1HB       ASN  45  -7.717   9.903  -2.541
  326   2HB   ASN  45          2HB       ASN  45  -6.561   9.734  -3.842
  327   1HD2  ASN  45          1HD2      ASN  45  -7.736   6.856  -4.111
  328   2HD2  ASN  45          2HD2      ASN  45  -9.132   7.199  -5.008
  329    H    PHE  46           H        PHE  46  -6.293   5.580  -2.600
  330    HA   PHE  46           HA       PHE  46  -3.867   5.544  -4.126
  331   1HB   PHE  46          1HB       PHE  46  -4.231   3.771  -2.548
  332   2HB   PHE  46          2HB       PHE  46  -5.781   3.339  -3.310
  333    HD1  PHE  46           HD1      PHE  46  -5.823   1.842  -5.152
  334    HD2  PHE  46           HD2      PHE  46  -2.085   3.388  -3.809
  335    HE1  PHE  46           HE1      PHE  46  -4.648   0.272  -6.626
  336    HE2  PHE  46           HE2      PHE  46  -0.911   1.821  -5.284
  337    HZ   PHE  46           HZ       PHE  46  -2.189   0.255  -6.695
  338    H    GLU  47           H        GLU  47  -7.254   5.198  -4.833
  339    HA   GLU  47           HA       GLU  47  -7.101   4.131  -7.413
  340   1HB   GLU  47          1HB       GLU  47  -9.131   4.478  -5.864
  341   2HB   GLU  47          2HB       GLU  47  -9.188   6.104  -6.516
  342   1HG   GLU  47          1HG       GLU  47  -9.532   5.247  -8.742
  343   2HG   GLU  47          2HG       GLU  47  -9.377   3.588  -8.154
  344    H    LYS  48           H        LYS  48  -7.072   7.493  -6.297
  345    HA   LYS  48           HA       LYS  48  -7.020   8.540  -8.950
  346   1HB   LYS  48          1HB       LYS  48  -8.047   9.992  -7.419
  347   2HB   LYS  48          2HB       LYS  48  -6.806   9.747  -6.204
  348   1HG   LYS  48          1HG       LYS  48  -5.233  11.065  -7.661
  349   2HG   LYS  48          2HG       LYS  48  -6.618  11.448  -8.692
  350   1HD   LYS  48          1HD       LYS  48  -7.743  12.491  -6.784
  351   2HD   LYS  48          2HD       LYS  48  -6.361  12.094  -5.755
  352   1HE   LYS  48          1HE       LYS  48  -4.930  13.439  -7.309
  353   2HE   LYS  48          2HE       LYS  48  -6.405  13.949  -8.130
  354   1HZ   LYS  48          1HZ       LYS  48  -5.727  15.603  -6.538
  355   2HZ   LYS  48          2HZ       LYS  48  -5.705  14.453  -5.286
  356   3HZ   LYS  48          3HZ       LYS  48  -7.182  14.890  -6.017
  357    H    ASP  49           H        ASP  49  -4.614   8.713  -6.303
  358    HA   ASP  49           HA       ASP  49  -2.574   9.663  -8.045
  359   1HB   ASP  49          1HB       ASP  49  -2.447   8.639  -5.200
  360   2HB   ASP  49          2HB       ASP  49  -1.105   9.408  -6.045
  361    H    GLY  50           H        GLY  50  -2.918   6.576  -6.278
  362   1HA   GLY  50          1HA       GLY  50  -2.446   4.452  -7.138
  363   2HA   GLY  50          2HA       GLY  50  -1.701   5.210  -8.526
  364    H    LYS  51           H        LYS  51  -0.583   6.378  -5.481
  365    HA   LYS  51           HA       LYS  51   2.015   5.249  -5.991
  366   1HB   LYS  51          1HB       LYS  51   0.874   7.168  -4.010
  367   2HB   LYS  51          2HB       LYS  51   2.395   6.381  -3.628
  368   1HG   LYS  51          1HG       LYS  51   2.699   8.569  -4.644
  369   2HG   LYS  51          2HG       LYS  51   3.403   7.279  -5.616
  370   1HD   LYS  51          1HD       LYS  51   1.421   7.336  -7.079
  371   2HD   LYS  51          2HD       LYS  51   0.780   8.679  -6.122
  372   1HE   LYS  51          1HE       LYS  51   2.775  10.002  -6.676
  373   2HE   LYS  51          2HE       LYS  51   3.377   8.670  -7.660
  374   1HZ   LYS  51          1HZ       LYS  51   0.959  10.328  -8.142
  375   2HZ   LYS  51          2HZ       LYS  51   1.313   8.916  -9.021
  376   3HZ   LYS  51          3HZ       LYS  51   2.369  10.245  -9.086
  377    H    TYR  52           H        TYR  52   2.472   3.203  -5.436
  378    HA   TYR  52           HA       TYR  52   1.586   2.255  -2.818
  379   1HB   TYR  52          1HB       TYR  52   0.794   0.167  -3.673
  380   2HB   TYR  52          2HB       TYR  52   0.016   1.430  -4.622
  381    HD1  TYR  52           HD1      TYR  52   1.438   2.122  -6.795
  382    HD2  TYR  52           HD2      TYR  52   1.629  -1.645  -4.829
  383    HE1  TYR  52           HE1      TYR  52   2.324   1.106  -8.839
  384    HE2  TYR  52           HE2      TYR  52   2.513  -2.677  -6.876
  385    HH   TYR  52           HH       TYR  52   2.250  -1.814  -9.637
  386    H    GLY  53           H        GLY  53   2.607   0.165  -2.278
  387   1HA   GLY  53          1HA       GLY  53   4.984  -0.674  -3.573
  388   2HA   GLY  53          2HA       GLY  53   5.346   0.294  -2.153
  389    H    PHE  54           H        PHE  54   6.017  -2.446  -2.407
  390    HA   PHE  54           HA       PHE  54   4.043  -3.821  -0.771
  391   1HB   PHE  54          1HB       PHE  54   6.577  -4.826  -2.054
  392   2HB   PHE  54          2HB       PHE  54   5.444  -5.824  -1.150
  393    HD1  PHE  54           HD1      PHE  54   2.940  -5.624  -1.978
  394    HD2  PHE  54           HD2      PHE  54   6.365  -4.762  -4.350
  395    HE1  PHE  54           HE1      PHE  54   1.610  -5.953  -4.023
  396    HE2  PHE  54           HE2      PHE  54   5.044  -5.093  -6.394
  397    HZ   PHE  54           HZ       PHE  54   2.662  -5.690  -6.232
  398    H    CYS  55           H        CYS  55   4.169  -3.773   1.337
  399    HA   CYS  55           HA       CYS  55   6.166  -2.505   2.783
  400   1HB   CYS  55          1HB       CYS  55   4.335  -4.631   3.897
  401   2HB   CYS  55          2HB       CYS  55   5.045  -3.258   4.751
  402    HA   PRO  56           HA       PRO  56   8.375  -6.545   3.719
  403   1HB   PRO  56          1HB       PRO  56   7.363  -8.949   3.218
  404   2HB   PRO  56          2HB       PRO  56   6.785  -7.997   4.586
  405   1HG   PRO  56          1HG       PRO  56   5.488  -8.516   1.962
  406   2HG   PRO  56          2HG       PRO  56   4.750  -8.283   3.556
  407   1HD   PRO  56          1HD       PRO  56   5.022  -6.339   1.516
  408   2HD   PRO  56          2HD       PRO  56   4.512  -6.057   3.192
  409    H    HIS  57           H        HIS  57  10.013  -7.715   2.551
  410    HA   HIS  57           HA       HIS  57   9.818  -7.284  -0.317
  411   1HB   HIS  57          1HB       HIS  57  12.210  -7.943  -0.417
  412   2HB   HIS  57          2HB       HIS  57  11.899  -6.570   0.633
  413    HD1  HIS  57           HD1      HIS  57  11.579  -7.508   3.343
  414    HD2  HIS  57           HD2      HIS  57  13.976  -9.621   0.675
  415    HE1  HIS  57           HE1      HIS  57  13.168  -8.843   4.763
  416    H    GLU  58           H        GLU  58  10.572 -10.046   1.817
  417    HA   GLU  58           HA       GLU  58   9.181 -11.749  -0.069
  418   1HB   GLU  58          1HB       GLU  58  10.960 -13.442   0.049
  419   2HB   GLU  58          2HB       GLU  58  11.483 -11.985  -0.767
  420   1HG   GLU  58          1HG       GLU  58  12.649 -11.285   1.270
  421   2HG   GLU  58          2HG       GLU  58  12.126 -12.773   2.064
  422    H    ALA  59           H        ALA  59  10.542 -11.124   3.068
  423    HA   ALA  59           HA       ALA  59   8.461 -12.662   4.353
  424   1HB   ALA  59          1HB       ALA  59   9.668 -14.369   5.167
  425   2HB   ALA  59          2HB       ALA  59  11.058 -13.345   5.511
  426   3HB   ALA  59          3HB       ALA  59  10.817 -13.979   3.886
  Start of MODEL   37
    1   1H    ARG   1          1H        ARG   1  14.680   5.507   1.319
    2   2H    ARG   1          2H        ARG   1  13.487   4.279   1.153
    3   3H    ARG   1          3H        ARG   1  14.992   3.928   1.913
    4    HA   ARG   1           HA       ARG   1  14.472   5.436   3.674
    5   1HB   ARG   1          1HB       ARG   1  12.936   6.758   2.020
    6   2HB   ARG   1          2HB       ARG   1  11.694   5.622   2.524
    7   1HG   ARG   1          1HG       ARG   1  11.933   6.336   4.825
    8   2HG   ARG   1          2HG       ARG   1  13.244   7.427   4.370
    9   1HD   ARG   1          1HD       ARG   1  11.755   9.020   3.953
   10   2HD   ARG   1          2HD       ARG   1  11.058   8.019   2.681
   11    HE   ARG   1           HE       ARG   1   9.916   7.086   4.992
   12   1HH1  ARG   1          1HH1      ARG   1  10.172  10.232   3.489
   13   2HH1  ARG   1          2HH1      ARG   1   8.628  10.784   4.071
   14   1HH2  ARG   1          1HH2      ARG   1   7.902   7.830   5.806
   15   2HH2  ARG   1          2HH2      ARG   1   7.313   9.396   5.350
   16    H    ILE   2           H        ILE   2  14.849   2.895   3.512
   17    HA   ILE   2           HA       ILE   2  14.285   0.771   3.929
   18    HB   ILE   2           HB       ILE   2  15.121   1.099   5.965
   19   1HG1  ILE   2          1HG1      ILE   2  12.290   0.292   6.599
   20   2HG1  ILE   2          2HG1      ILE   2  13.628  -0.772   6.186
   21   1HG2  ILE   2          1HG2      ILE   2  13.078   3.186   6.316
   22   2HG2  ILE   2          2HG2      ILE   2  14.803   3.194   6.683
   23   3HG2  ILE   2          3HG2      ILE   2  13.672   2.393   7.775
   24   1HD1  ILE   2          1HD1      ILE   2  14.105   0.964   8.505
   25   2HD1  ILE   2          2HD1      ILE   2  14.455  -0.748   8.272
   26   3HD1  ILE   2          3HD1      ILE   2  12.826  -0.240   8.709
   27    HA   PRO   3           HA       PRO   3   9.710  -0.435   4.736
   28   1HB   PRO   3          1HB       PRO   3   8.380   2.214   4.984
   29   2HB   PRO   3          2HB       PRO   3   7.979   0.677   5.754
   30   1HG   PRO   3          1HG       PRO   3   9.189   2.550   7.158
   31   2HG   PRO   3          2HG       PRO   3   9.710   0.856   7.305
   32   1HD   PRO   3          1HD       PRO   3  10.982   3.106   5.768
   33   2HD   PRO   3          2HD       PRO   3  11.754   1.848   6.758
   34    H    VAL   4           H        VAL   4   7.993  -0.595   3.249
   35    HA   VAL   4           HA       VAL   4   7.053  -0.613   1.185
   36    HB   VAL   4           HB       VAL   4   8.162   2.197   0.782
   37   1HG1  VAL   4          1HG1      VAL   4   6.652   2.368  -1.036
   38   2HG1  VAL   4          2HG1      VAL   4   5.848   0.857  -0.608
   39   3HG1  VAL   4          3HG1      VAL   4   7.493   0.829  -1.241
   40   1HG2  VAL   4          1HG2      VAL   4   6.447   1.699   2.717
   41   2HG2  VAL   4          2HG2      VAL   4   5.291   1.629   1.388
   42   3HG2  VAL   4          3HG2      VAL   4   6.231   3.097   1.664
   43    H    LYS   5           H        LYS   5   7.953  -2.055   0.056
   44    HA   LYS   5           HA       LYS   5  10.698  -1.871  -0.797
   45   1HB   LYS   5          1HB       LYS   5   8.573  -3.975  -0.816
   46   2HB   LYS   5          2HB       LYS   5  10.034  -4.193  -1.764
   47   1HG   LYS   5          1HG       LYS   5   9.917  -3.775   1.211
   48   2HG   LYS   5          2HG       LYS   5  10.152  -5.313   0.390
   49   1HD   LYS   5          1HD       LYS   5  12.271  -4.696  -0.429
   50   2HD   LYS   5          2HD       LYS   5  12.011  -2.993  -0.038
   51   1HE   LYS   5          1HE       LYS   5  12.050  -3.537   2.352
   52   2HE   LYS   5          2HE       LYS   5  12.276  -5.239   1.971
   53   1HZ   LYS   5          1HZ       LYS   5  14.332  -4.014   2.607
   54   2HZ   LYS   5          2HZ       LYS   5  14.198  -3.122   1.171
   55   3HZ   LYS   5          3HZ       LYS   5  14.433  -4.806   1.104
   56    H    TYR   6           H        TYR   6   9.361  -3.789  -2.973
   57    HA   TYR   6           HA       TYR   6  10.005  -2.260  -5.210
   58   1HB   TYR   6          1HB       TYR   6   8.088  -4.577  -5.325
   59   2HB   TYR   6          2HB       TYR   6   9.351  -4.121  -6.470
   60    HD1  TYR   6           HD1      TYR   6  11.820  -4.131  -5.407
   61    HD2  TYR   6           HD2      TYR   6   8.521  -6.392  -3.951
   62    HE1  TYR   6           HE1      TYR   6  13.369  -5.673  -4.299
   63    HE2  TYR   6           HE2      TYR   6  10.063  -7.943  -2.846
   64    HH   TYR   6           HH       TYR   6  12.477  -8.675  -3.184
   65    H    GLY   7           H        GLY   7   8.746  -1.457  -6.900
   66   1HA   GLY   7          1HA       GLY   7   6.377  -1.194  -7.676
   67   2HA   GLY   7          2HA       GLY   7   6.074  -0.483  -6.102
   68    H    ASN   8           H        ASN   8   5.380   1.413  -7.179
   69    HA   ASN   8           HA       ASN   8   7.573   3.044  -8.324
   70   1HB   ASN   8          1HB       ASN   8   6.038   4.043  -9.817
   71   2HB   ASN   8          2HB       ASN   8   5.679   2.319  -9.876
   72   1HD2  ASN   8          1HD2      ASN   8   4.120   4.937 -10.215
   73   2HD2  ASN   8          2HD2      ASN   8   2.744   4.718  -9.180
   74    H    ALA   9           H        ALA   9   6.158   2.713  -5.565
   75    HA   ALA   9           HA       ALA   9   4.653   4.688  -4.600
   76   1HB   ALA   9          1HB       ALA   9   5.671   2.906  -3.313
   77   2HB   ALA   9          2HB       ALA   9   5.737   4.482  -2.518
   78   3HB   ALA   9          3HB       ALA   9   7.180   3.820  -3.288
   79    H    ASP  10           H        ASP  10   4.708   6.728  -3.937
   80    HA   ASP  10           HA       ASP  10   6.643   8.485  -5.129
   81   1HB   ASP  10          1HB       ASP  10   4.286   9.121  -5.084
   82   2HB   ASP  10          2HB       ASP  10   4.275   9.047  -3.324
   83    H    GLY  11           H        GLY  11   5.425   8.317  -1.788
   84   1HA   GLY  11          1HA       GLY  11   8.167   8.767  -0.849
   85   2HA   GLY  11          2HA       GLY  11   6.805   9.624  -0.142
   86    H    GLU  12           H        GLU  12   8.680   6.825  -0.149
   87    HA   GLU  12           HA       GLU  12   7.233   4.763   0.706
   88   1HB   GLU  12          1HB       GLU  12   9.996   5.580   1.529
   89   2HB   GLU  12          2HB       GLU  12   9.301   4.013   1.943
   90   1HG   GLU  12          1HG       GLU  12   9.107   3.372  -0.293
   91   2HG   GLU  12          2HG       GLU  12   9.323   5.018  -0.876
   92    H    TYR  13           H        TYR  13   7.617   3.653   2.949
   93    HA   TYR  13           HA       TYR  13   7.024   3.431   5.126
   94   1HB   TYR  13          1HB       TYR  13   7.154   6.401   4.989
   95   2HB   TYR  13          2HB       TYR  13   6.106   5.719   6.229
   96    HD1  TYR  13           HD1      TYR  13   9.565   5.469   4.887
   97    HD2  TYR  13           HD2      TYR  13   7.010   5.108   8.252
   98    HE1  TYR  13           HE1      TYR  13  11.516   5.107   6.311
   99    HE2  TYR  13           HE2      TYR  13   8.944   4.739   9.699
  100    HH   TYR  13           HH       TYR  13  11.620   5.508   9.424
  101    H    CYS  14           H        CYS  14   5.079   2.566   5.619
  102    HA   CYS  14           HA       CYS  14   2.936   2.822   3.863
  103   1HB   CYS  14          1HB       CYS  14   3.201   1.633   6.599
  104   2HB   CYS  14          2HB       CYS  14   1.635   1.691   5.797
  105    H    LYS  15           H        LYS  15   1.311   4.160   3.663
  106    HA   LYS  15           HA       LYS  15   1.036   6.363   5.547
  107   1HB   LYS  15          1HB       LYS  15   0.839   6.202   2.813
  108   2HB   LYS  15          2HB       LYS  15  -0.853   6.161   3.283
  109   1HG   LYS  15          1HG       LYS  15   1.094   8.289   4.152
  110   2HG   LYS  15          2HG       LYS  15   0.022   8.431   2.759
  111   1HD   LYS  15          1HD       LYS  15  -0.879   7.995   5.607
  112   2HD   LYS  15          2HD       LYS  15  -0.866   9.550   4.772
  113   1HE   LYS  15          1HE       LYS  15  -2.457   7.108   3.985
  114   2HE   LYS  15          2HE       LYS  15  -3.094   8.568   4.738
  115   1HZ   LYS  15          1HZ       LYS  15  -1.990   8.261   2.004
  116   2HZ   LYS  15          2HZ       LYS  15  -2.215   9.778   2.714
  117   3HZ   LYS  15          3HZ       LYS  15  -3.550   8.753   2.459
  118    H    PHE  16           H        PHE  16  -0.009   5.651   7.345
  119    HA   PHE  16           HA       PHE  16  -2.524   4.163   6.977
  120   1HB   PHE  16          1HB       PHE  16  -0.647   4.335   9.339
  121   2HB   PHE  16          2HB       PHE  16  -2.221   3.547   9.399
  122    HD1  PHE  16           HD1      PHE  16   0.328   2.172  10.054
  123    HD2  PHE  16           HD2      PHE  16  -1.729   2.602   6.356
  124    HE1  PHE  16           HE1      PHE  16   1.334   0.083   9.258
  125    HE2  PHE  16           HE2      PHE  16  -0.732   0.515   5.550
  126    HZ   PHE  16           HZ       PHE  16   0.814  -0.778   6.993
  127    HA   PRO  17           HA       PRO  17  -4.225   3.971   7.122
  128   1HB   PRO  17          1HB       PRO  17  -6.798   4.870   6.758
  129   2HB   PRO  17          2HB       PRO  17  -6.229   4.039   8.205
  130   1HG   PRO  17          1HG       PRO  17  -7.062   6.791   7.941
  131   2HG   PRO  17          2HG       PRO  17  -6.564   5.930   9.407
  132   1HD   PRO  17          1HD       PRO  17  -5.021   7.762   7.695
  133   2HD   PRO  17          2HD       PRO  17  -4.728   7.270   9.377
  134    H    PHE  18           H        PHE  18  -4.547   3.511   4.922
  135    HA   PHE  18           HA       PHE  18  -4.526   5.871   3.180
  136   1HB   PHE  18          1HB       PHE  18  -3.491   4.563   1.445
  137   2HB   PHE  18          2HB       PHE  18  -2.573   4.367   2.926
  138    HD1  PHE  18           HD1      PHE  18  -2.966   2.224   4.281
  139    HD2  PHE  18           HD2      PHE  18  -4.242   2.742   0.257
  140    HE1  PHE  18           HE1      PHE  18  -3.063  -0.219   3.997
  141    HE2  PHE  18           HE2      PHE  18  -4.343   0.310  -0.043
  142    HZ   PHE  18           HZ       PHE  18  -3.747  -1.196   1.833
  143    H    LEU  19           H        LEU  19  -5.803   5.918   1.326
  144    HA   LEU  19           HA       LEU  19  -8.364   4.616   1.748
  145   1HB   LEU  19          1HB       LEU  19  -8.209   7.068   1.402
  146   2HB   LEU  19          2HB       LEU  19  -7.604   6.773  -0.219
  147    HG   LEU  19           HG       LEU  19  -9.780   5.537  -0.663
  148   1HD1  LEU  19          1HD1      LEU  19 -11.651   6.426   0.845
  149   2HD1  LEU  19          2HD1      LEU  19 -10.368   6.759   2.007
  150   3HD1  LEU  19          3HD1      LEU  19 -10.649   5.107   1.456
  151   1HD2  LEU  19          1HD2      LEU  19 -10.725   8.215  -0.176
  152   2HD2  LEU  19          2HD2      LEU  19 -10.365   7.414  -1.704
  153   3HD2  LEU  19          3HD2      LEU  19  -9.078   8.231  -0.820
  154    H    PHE  20           H        PHE  20  -8.849   2.802   0.755
  155    HA   PHE  20           HA       PHE  20  -7.812   2.370  -1.974
  156   1HB   PHE  20          1HB       PHE  20  -6.911   0.761  -0.240
  157   2HB   PHE  20          2HB       PHE  20  -8.576   0.240   0.000
  158    HD1  PHE  20           HD1      PHE  20  -6.544   0.898  -3.070
  159    HD2  PHE  20           HD2      PHE  20  -8.985  -1.766  -0.832
  160    HE1  PHE  20           HE1      PHE  20  -6.372  -0.786  -4.869
  161    HE2  PHE  20           HE2      PHE  20  -8.819  -3.448  -2.612
  162    HZ   PHE  20           HZ       PHE  20  -7.515  -2.952  -4.647
  163    H    ASN  21           H        ASN  21  -9.524   3.134  -3.093
  164    HA   ASN  21           HA       ASN  21 -11.597   3.293  -4.003
  165   1HB   ASN  21          1HB       ASN  21 -11.440   0.375  -3.307
  166   2HB   ASN  21          2HB       ASN  21 -12.850   1.050  -4.118
  167   1HD2  ASN  21          1HD2      ASN  21 -12.792   0.703  -6.201
  168   2HD2  ASN  21          2HD2      ASN  21 -11.390   0.723  -7.209
  169    H    GLY  22           H        GLY  22 -11.437   3.964  -1.158
  170   1HA   GLY  22          1HA       GLY  22 -13.237   4.938   0.059
  171   2HA   GLY  22          2HA       GLY  22 -14.295   3.692  -0.575
  172    H    LYS  23           H        LYS  23 -11.522   2.169   0.377
  173    HA   LYS  23           HA       LYS  23 -12.660   1.636   3.037
  174   1HB   LYS  23          1HB       LYS  23 -12.689  -0.238   1.304
  175   2HB   LYS  23          2HB       LYS  23 -10.938  -0.260   1.428
  176   1HG   LYS  23          1HG       LYS  23 -11.076  -0.893   3.767
  177   2HG   LYS  23          2HG       LYS  23 -12.836  -0.775   3.722
  178   1HD   LYS  23          1HD       LYS  23 -12.898  -2.548   2.028
  179   2HD   LYS  23          2HD       LYS  23 -11.139  -2.682   2.126
  180   1HE   LYS  23          1HE       LYS  23 -11.304  -3.359   4.458
  181   2HE   LYS  23          2HE       LYS  23 -13.057  -3.144   4.415
  182   1HZ   LYS  23          1HZ       LYS  23 -13.099  -4.873   2.630
  183   2HZ   LYS  23          2HZ       LYS  23 -12.590  -5.461   4.141
  184   3HZ   LYS  23          3HZ       LYS  23 -11.450  -5.158   2.920
  185    H    GLU  24           H        GLU  24 -11.441   2.284   4.690
  186    HA   GLU  24           HA       GLU  24  -8.701   3.115   4.180
  187   1HB   GLU  24          1HB       GLU  24 -10.390   3.362   6.673
  188   2HB   GLU  24          2HB       GLU  24  -8.808   4.085   6.438
  189   1HG   GLU  24          1HG       GLU  24  -9.701   5.454   4.637
  190   2HG   GLU  24          2HG       GLU  24 -11.288   4.720   4.863
  191    H    TYR  25           H        TYR  25  -6.950   2.030   4.797
  192    HA   TYR  25           HA       TYR  25  -7.316  -0.316   6.542
  193   1HB   TYR  25          1HB       TYR  25  -5.277   0.156   4.383
  194   2HB   TYR  25          2HB       TYR  25  -5.280  -1.243   5.435
  195    HD1  TYR  25           HD1      TYR  25  -7.618  -2.545   5.451
  196    HD2  TYR  25           HD2      TYR  25  -6.212  -0.048   2.315
  197    HE1  TYR  25           HE1      TYR  25  -9.128  -3.689   3.865
  198    HE2  TYR  25           HE2      TYR  25  -7.710  -1.182   0.721
  199    HH   TYR  25           HH       TYR  25  -9.400  -4.080   1.563
  200    H    ASN  26           H        ASN  26  -6.223  -0.373   8.409
  201    HA   ASN  26           HA       ASN  26  -4.351   1.825   8.946
  202   1HB   ASN  26          1HB       ASN  26  -5.704  -0.130  10.826
  203   2HB   ASN  26          2HB       ASN  26  -4.517   1.063  11.339
  204   1HD2  ASN  26          1HD2      ASN  26  -6.314   2.305   8.834
  205   2HD2  ASN  26          2HD2      ASN  26  -7.488   3.185   9.748
  206    H    SER  27           H        SER  27  -4.275  -1.178   7.773
  207    HA   SER  27           HA       SER  27  -1.501  -1.586   8.582
  208   1HB   SER  27          1HB       SER  27  -1.976  -4.059   8.831
  209   2HB   SER  27          2HB       SER  27  -2.684  -3.048  10.096
  210    HG   SER  27           HG       SER  27  -4.629  -3.583   9.440
  211    H    CYS  28           H        CYS  28  -0.832  -3.765   7.190
  212    HA   CYS  28           HA       CYS  28  -1.207  -2.893   4.449
  213   1HB   CYS  28          1HB       CYS  28   0.429  -5.172   5.588
  214   2HB   CYS  28          2HB       CYS  28   0.460  -4.635   3.915
  215    H    THR  29           H        THR  29  -2.519  -3.831   2.981
  216    HA   THR  29           HA       THR  29  -3.857  -6.309   3.777
  217    HB   THR  29           HB       THR  29  -5.350  -4.324   3.725
  218    HG1  THR  29           HG1      THR  29  -6.071  -6.496   3.136
  219   1HG2  THR  29          1HG2      THR  29  -5.800  -4.040   0.958
  220   2HG2  THR  29          2HG2      THR  29  -4.079  -3.779   1.231
  221   3HG2  THR  29          3HG2      THR  29  -5.270  -2.820   2.112
  222    H    ASP  30           H        ASP  30  -4.630  -7.640   1.908
  223    HA   ASP  30           HA       ASP  30  -2.589  -7.614  -0.178
  224   1HB   ASP  30          1HB       ASP  30  -4.208  -9.976  -0.134
  225   2HB   ASP  30          2HB       ASP  30  -2.476  -9.844  -0.095
  226    H    THR  31           H        THR  31  -5.585  -6.635   0.378
  227    HA   THR  31           HA       THR  31  -7.207  -7.573  -1.673
  228    HB   THR  31           HB       THR  31  -7.199  -4.786  -0.539
  229    HG1  THR  31           HG1      THR  31  -7.277  -6.072   1.220
  230   1HG2  THR  31          1HG2      THR  31  -8.861  -4.655  -2.067
  231   2HG2  THR  31          2HG2      THR  31  -9.762  -5.326  -0.707
  232   3HG2  THR  31          3HG2      THR  31  -9.207  -6.382  -2.005
  233    H    GLY  32           H        GLY  32  -7.326  -7.174  -3.807
  234   1HA   GLY  32          1HA       GLY  32  -7.109  -5.871  -5.753
  235   2HA   GLY  32          2HA       GLY  32  -5.952  -4.857  -4.905
  236    H    ARG  33           H        ARG  33  -4.580  -7.281  -3.853
  237    HA   ARG  33           HA       ARG  33  -2.893  -7.781  -6.192
  238   1HB   ARG  33          1HB       ARG  33  -2.512  -8.374  -3.249
  239   2HB   ARG  33          2HB       ARG  33  -1.350  -8.791  -4.492
  240   1HG   ARG  33          1HG       ARG  33  -2.246  -6.012  -3.765
  241   2HG   ARG  33          2HG       ARG  33  -0.716  -6.757  -3.308
  242   1HD   ARG  33          1HD       ARG  33  -1.650  -6.077  -6.096
  243   2HD   ARG  33          2HD       ARG  33  -0.378  -5.270  -5.184
  244    HE   ARG  33           HE       ARG  33   0.232  -8.017  -5.480
  245   1HH1  ARG  33          1HH1      ARG  33   0.139  -5.012  -7.264
  246   2HH1  ARG  33          2HH1      ARG  33   1.321  -5.533  -8.430
  247   1HH2  ARG  33          1HH2      ARG  33   1.793  -8.689  -6.992
  248   2HH2  ARG  33          2HH2      ARG  33   2.289  -7.602  -8.256
  249    H    SER  34           H        SER  34  -2.854  -9.688  -7.209
  250    HA   SER  34           HA       SER  34  -4.739 -11.721  -6.451
  251   1HB   SER  34          1HB       SER  34  -2.657 -11.841  -8.638
  252   2HB   SER  34          2HB       SER  34  -4.157 -12.770  -8.530
  253    HG   SER  34           HG       SER  34  -4.181 -10.869  -9.958
  254    H    ASP  35           H        ASP  35  -1.397 -11.122  -5.936
  255    HA   ASP  35           HA       ASP  35  -0.735 -13.857  -5.433
  256   1HB   ASP  35          1HB       ASP  35   1.197 -11.909  -4.558
  257   2HB   ASP  35          2HB       ASP  35   1.399 -13.235  -5.671
  258    H    GLY  36           H        GLY  36  -2.351 -11.690  -3.688
  259   1HA   GLY  36          1HA       GLY  36  -2.888 -11.514  -1.456
  260   2HA   GLY  36          2HA       GLY  36  -2.140 -13.093  -1.258
  261    H    PHE  37           H        PHE  37  -0.610 -10.076  -2.348
  262    HA   PHE  37           HA       PHE  37   1.340 -10.388  -0.191
  263   1HB   PHE  37          1HB       PHE  37   1.412  -9.316  -2.912
  264   2HB   PHE  37          2HB       PHE  37   2.227  -8.292  -1.735
  265    HD1  PHE  37           HD1      PHE  37   1.987 -11.947  -2.511
  266    HD2  PHE  37           HD2      PHE  37   4.473  -8.643  -1.491
  267    HE1  PHE  37           HE1      PHE  37   3.966 -13.413  -2.578
  268    HE2  PHE  37           HE2      PHE  37   6.449 -10.103  -1.554
  269    HZ   PHE  37           HZ       PHE  37   6.193 -12.494  -2.101
  270    H    LEU  38           H        LEU  38   1.763  -8.825   1.315
  271    HA   LEU  38           HA       LEU  38  -0.382  -6.999   1.880
  272   1HB   LEU  38          1HB       LEU  38   2.228  -7.522   3.250
  273   2HB   LEU  38          2HB       LEU  38   1.072  -6.346   3.825
  274    HG   LEU  38           HG       LEU  38  -0.581  -8.321   3.921
  275   1HD1  LEU  38          1HD1      LEU  38   0.596  -9.977   2.688
  276   2HD1  LEU  38          2HD1      LEU  38   0.532 -10.496   4.370
  277   3HD1  LEU  38          3HD1      LEU  38   2.019  -9.809   3.721
  278   1HD2  LEU  38          1HD2      LEU  38   1.427  -7.388   5.743
  279   2HD2  LEU  38          2HD2      LEU  38   1.070  -9.089   6.030
  280   3HD2  LEU  38          3HD2      LEU  38  -0.231  -7.898   6.062
  281    H    TRP  39           H        TRP  39  -0.538  -4.967   1.184
  282    HA   TRP  39           HA       TRP  39   1.946  -3.501   0.645
  283   1HB   TRP  39          1HB       TRP  39   1.038  -2.586  -1.439
  284   2HB   TRP  39          2HB       TRP  39   1.116  -4.338  -1.521
  285    HD1  TRP  39           HD1      TRP  39  -1.263  -5.676  -1.379
  286    HE1  TRP  39           HE1      TRP  39  -3.614  -4.946  -2.067
  287    HE3  TRP  39           HE3      TRP  39  -0.541  -0.612  -1.592
  288    HZ2  TRP  39           HZ2      TRP  39  -4.992  -2.555  -2.633
  289    HZ3  TRP  39           HZ3      TRP  39  -2.442   0.816  -2.217
  290    HH2  TRP  39           HH2      TRP  39  -4.619  -0.144  -2.724
  291    H    CYS  40           H        CYS  40   1.455  -1.140   0.240
  292    HA   CYS  40           HA       CYS  40  -0.919  -0.058   1.480
  293   1HB   CYS  40          1HB       CYS  40   0.292   1.208   3.203
  294   2HB   CYS  40          2HB       CYS  40   0.512  -0.522   3.448
  295    H    SER  41           H        SER  41  -1.315   2.002   0.602
  296    HA   SER  41           HA       SER  41   0.431   2.750  -1.550
  297   1HB   SER  41          1HB       SER  41  -1.162   4.560  -2.001
  298   2HB   SER  41          2HB       SER  41  -2.003   3.027  -1.784
  299    HG   SER  41           HG       SER  41  -1.760   5.144   0.089
  300    H    THR  42           H        THR  42   1.665   4.676  -1.727
  301    HA   THR  42           HA       THR  42   2.593   5.696   0.820
  302    HB   THR  42           HB       THR  42   4.186   6.740  -1.106
  303    HG1  THR  42           HG1      THR  42   3.830   4.213  -2.153
  304   1HG2  THR  42          1HG2      THR  42   4.372   4.125   0.323
  305   2HG2  THR  42          2HG2      THR  42   5.330   5.590   0.541
  306   3HG2  THR  42          3HG2      THR  42   5.584   4.576  -0.877
  307    H    THR  43           H        THR  43   0.473   6.534  -1.654
  308    HA   THR  43           HA       THR  43   0.817   9.410  -1.208
  309    HB   THR  43           HB       THR  43  -0.877   9.444  -3.210
  310    HG1  THR  43           HG1      THR  43  -1.137   7.637  -4.251
  311   1HG2  THR  43          1HG2      THR  43   0.969   9.197  -4.857
  312   2HG2  THR  43          2HG2      THR  43   2.014   8.700  -3.526
  313   3HG2  THR  43          3HG2      THR  43   1.302  10.314  -3.532
  314    H    TYR  44           H        TYR  44  -1.707  10.186  -2.068
  315    HA   TYR  44           HA       TYR  44  -3.214   9.961   0.356
  316   1HB   TYR  44          1HB       TYR  44  -3.066  12.075  -0.864
  317   2HB   TYR  44          2HB       TYR  44  -3.804  11.343  -2.281
  318    HD1  TYR  44           HD1      TYR  44  -6.245  10.378  -1.876
  319    HD2  TYR  44           HD2      TYR  44  -4.375  13.284   0.601
  320    HE1  TYR  44           HE1      TYR  44  -8.450  11.120  -1.103
  321    HE2  TYR  44           HE2      TYR  44  -6.579  14.037   1.388
  322    HH   TYR  44           HH       TYR  44  -9.197  13.774   0.085
  323    H    ASN  45           H        ASN  45  -4.064   9.298  -3.053
  324    HA   ASN  45           HA       ASN  45  -5.927   7.222  -2.091
  325   1HB   ASN  45          1HB       ASN  45  -6.972   9.329  -3.028
  326   2HB   ASN  45          2HB       ASN  45  -6.227   8.948  -4.560
  327   1HD2  ASN  45          1HD2      ASN  45  -6.892   5.998  -3.855
  328   2HD2  ASN  45          2HD2      ASN  45  -8.531   5.968  -4.326
  329    H    PHE  46           H        PHE  46  -5.379   5.204  -2.797
  330    HA   PHE  46           HA       PHE  46  -3.226   4.745  -4.559
  331   1HB   PHE  46          1HB       PHE  46  -3.762   3.050  -2.954
  332   2HB   PHE  46          2HB       PHE  46  -5.419   2.899  -3.583
  333    HD1  PHE  46           HD1      PHE  46  -5.882   1.413  -5.344
  334    HD2  PHE  46           HD2      PHE  46  -1.826   2.359  -4.455
  335    HE1  PHE  46           HE1      PHE  46  -5.146  -0.340  -6.890
  336    HE2  PHE  46           HE2      PHE  46  -1.090   0.600  -5.999
  337    HZ   PHE  46           HZ       PHE  46  -2.740  -0.748  -7.218
  338    H    GLU  47           H        GLU  47  -6.713   4.648  -5.098
  339    HA   GLU  47           HA       GLU  47  -6.632   3.689  -7.744
  340   1HB   GLU  47          1HB       GLU  47  -8.621   3.743  -6.211
  341   2HB   GLU  47          2HB       GLU  47  -8.727   5.469  -6.490
  342   1HG   GLU  47          1HG       GLU  47  -8.999   4.981  -8.923
  343   2HG   GLU  47          2HG       GLU  47  -9.112   3.270  -8.503
  344    H    LYS  48           H        LYS  48  -6.940   6.985  -6.478
  345    HA   LYS  48           HA       LYS  48  -6.967   8.164  -9.055
  346   1HB   LYS  48          1HB       LYS  48  -8.134   9.288  -7.321
  347   2HB   LYS  48          2HB       LYS  48  -6.750   9.251  -6.248
  348   1HG   LYS  48          1HG       LYS  48  -5.626  10.927  -7.711
  349   2HG   LYS  48          2HG       LYS  48  -7.108  11.016  -8.677
  350   1HD   LYS  48          1HD       LYS  48  -7.165  12.810  -7.120
  351   2HD   LYS  48          2HD       LYS  48  -8.337  11.605  -6.582
  352   1HE   LYS  48          1HE       LYS  48  -6.747  10.773  -4.937
  353   2HE   LYS  48          2HE       LYS  48  -5.537  11.930  -5.491
  354   1HZ   LYS  48          1HZ       LYS  48  -6.394  13.072  -3.736
  355   2HZ   LYS  48          2HZ       LYS  48  -7.942  12.371  -3.870
  356   3HZ   LYS  48          3HZ       LYS  48  -7.474  13.612  -4.932
  357    H    ASP  49           H        ASP  49  -4.439   8.016  -6.516
  358    HA   ASP  49           HA       ASP  49  -2.561   9.457  -8.141
  359   1HB   ASP  49          1HB       ASP  49  -2.185   7.908  -5.569
  360   2HB   ASP  49          2HB       ASP  49  -0.910   8.841  -6.350
  361    H    GLY  50           H        GLY  50  -2.860   6.053  -7.144
  362   1HA   GLY  50          1HA       GLY  50  -2.419   4.200  -8.505
  363   2HA   GLY  50          2HA       GLY  50  -1.584   5.260  -9.622
  364    H    LYS  51           H        LYS  51  -0.503   5.844  -6.500
  365    HA   LYS  51           HA       LYS  51   1.954   4.395  -7.080
  366   1HB   LYS  51          1HB       LYS  51   1.248   6.481  -5.029
  367   2HB   LYS  51          2HB       LYS  51   2.769   5.608  -4.984
  368   1HG   LYS  51          1HG       LYS  51   3.215   7.652  -6.045
  369   2HG   LYS  51          2HG       LYS  51   3.166   6.445  -7.326
  370   1HD   LYS  51          1HD       LYS  51   0.855   7.144  -7.843
  371   2HD   LYS  51          2HD       LYS  51   0.974   8.388  -6.596
  372   1HE   LYS  51          1HE       LYS  51   1.368   9.300  -8.837
  373   2HE   LYS  51          2HE       LYS  51   2.789   9.459  -7.802
  374   1HZ   LYS  51          1HZ       LYS  51   2.526   7.129  -9.589
  375   2HZ   LYS  51          2HZ       LYS  51   3.938   7.859  -8.975
  376   3HZ   LYS  51          3HZ       LYS  51   3.054   8.614 -10.218
  377    H    TYR  52           H        TYR  52   2.790   2.752  -5.843
  378    HA   TYR  52           HA       TYR  52   1.440   1.962  -3.411
  379   1HB   TYR  52          1HB       TYR  52   0.930  -0.293  -4.135
  380   2HB   TYR  52          2HB       TYR  52   0.109   0.864  -5.177
  381    HD1  TYR  52           HD1      TYR  52   1.477   1.521  -7.363
  382    HD2  TYR  52           HD2      TYR  52   2.035  -2.044  -5.118
  383    HE1  TYR  52           HE1      TYR  52   2.464   0.442  -9.331
  384    HE2  TYR  52           HE2      TYR  52   3.031  -3.136  -7.079
  385    HH   TYR  52           HH       TYR  52   2.969  -1.641 -10.226
  386    H    GLY  53           H        GLY  53   2.530  -0.048  -2.532
  387   1HA   GLY  53          1HA       GLY  53   5.118  -0.767  -3.423
  388   2HA   GLY  53          2HA       GLY  53   5.210   0.361  -2.077
  389    H    PHE  54           H        PHE  54   5.954  -2.500  -2.208
  390    HA   PHE  54           HA       PHE  54   3.910  -3.714  -0.580
  391   1HB   PHE  54          1HB       PHE  54   6.503  -4.868  -1.560
  392   2HB   PHE  54          2HB       PHE  54   5.262  -5.765  -0.702
  393    HD1  PHE  54           HD1      PHE  54   6.008  -3.946  -3.835
  394    HD2  PHE  54           HD2      PHE  54   3.361  -6.606  -1.823
  395    HE1  PHE  54           HE1      PHE  54   4.867  -4.413  -5.964
  396    HE2  PHE  54           HE2      PHE  54   2.222  -7.081  -3.950
  397    HZ   PHE  54           HZ       PHE  54   2.975  -5.986  -6.022
  398    H    CYS  55           H        CYS  55   3.997  -4.211   1.532
  399    HA   CYS  55           HA       CYS  55   5.747  -2.683   3.147
  400   1HB   CYS  55          1HB       CYS  55   4.064  -5.016   4.082
  401   2HB   CYS  55          2HB       CYS  55   4.608  -3.628   5.026
  402    HA   PRO  56           HA       PRO  56   8.240  -6.582   3.914
  403   1HB   PRO  56          1HB       PRO  56   7.332  -9.030   3.303
  404   2HB   PRO  56          2HB       PRO  56   6.796  -8.180   4.753
  405   1HG   PRO  56          1HG       PRO  56   5.320  -8.771   2.281
  406   2HG   PRO  56          2HG       PRO  56   4.699  -8.341   3.881
  407   1HD   PRO  56          1HD       PRO  56   5.067  -6.641   1.567
  408   2HD   PRO  56          2HD       PRO  56   4.322  -6.243   3.130
  409    H    HIS  57           H        HIS  57   9.563  -8.354   2.690
  410    HA   HIS  57           HA       HIS  57   9.581  -7.585  -0.148
  411   1HB   HIS  57          1HB       HIS  57  11.969  -8.494  -0.122
  412   2HB   HIS  57          2HB       HIS  57  11.684  -6.995   0.747
  413    HD1  HIS  57           HD1      HIS  57  11.157  -7.554   3.491
  414    HD2  HIS  57           HD2      HIS  57  13.537 -10.156   1.287
  415    HE1  HIS  57           HE1      HIS  57  12.482  -8.859   5.181
  416    H    GLU  58           H        GLU  58  10.883 -10.447   1.477
  417    HA   GLU  58           HA       GLU  58   9.009 -12.125   0.038
  418   1HB   GLU  58          1HB       GLU  58  11.015 -13.640  -0.497
  419   2HB   GLU  58          2HB       GLU  58  10.728 -12.241  -1.510
  420   1HG   GLU  58          1HG       GLU  58  12.451 -11.031  -0.132
  421   2HG   GLU  58          2HG       GLU  58  12.831 -12.590   0.603
  422    H    ALA  59           H        ALA  59  10.588 -11.278   2.797
  423    HA   ALA  59           HA       ALA  59  10.010 -13.869   4.048
  424   1HB   ALA  59          1HB       ALA  59  11.903 -13.751   5.413
  425   2HB   ALA  59          2HB       ALA  59  12.160 -12.041   5.063
  426   3HB   ALA  59          3HB       ALA  59  12.492 -13.254   3.826
  Start of MODEL   38
    1   1H    ARG   1          1H        ARG   1   9.193   0.823  10.404
    2   2H    ARG   1          2H        ARG   1   7.569   0.311  10.630
    3   3H    ARG   1          3H        ARG   1   8.138   1.744  11.403
    4    HA   ARG   1           HA       ARG   1   6.976   1.403   8.890
    5   1HB   ARG   1          1HB       ARG   1   6.796   3.163  10.822
    6   2HB   ARG   1          2HB       ARG   1   8.155   3.940  10.023
    7   1HG   ARG   1          1HG       ARG   1   6.035   4.934   9.374
    8   2HG   ARG   1          2HG       ARG   1   6.842   4.186   7.991
    9   1HD   ARG   1          1HD       ARG   1   5.289   2.504   7.818
   10   2HD   ARG   1          2HD       ARG   1   4.889   2.546   9.537
   11    HE   ARG   1           HE       ARG   1   3.662   4.073   7.418
   12   1HH1  ARG   1          1HH1      ARG   1   4.238   3.875  10.861
   13   2HH1  ARG   1          2HH1      ARG   1   2.899   4.890  11.280
   14   1HH2  ARG   1          1HH2      ARG   1   1.918   5.452   7.975
   15   2HH2  ARG   1          2HH2      ARG   1   1.591   5.788   9.650
   16    H    ILE   2           H        ILE   2   8.484   0.326   7.538
   17    HA   ILE   2           HA       ILE   2  11.073   1.463   7.070
   18    HB   ILE   2           HB       ILE   2  11.224  -0.235   5.230
   19   1HG1  ILE   2          1HG1      ILE   2   8.562  -1.193   6.304
   20   2HG1  ILE   2          2HG1      ILE   2   8.768  -0.311   4.797
   21   1HG2  ILE   2          1HG2      ILE   2  11.392  -2.191   6.687
   22   2HG2  ILE   2          2HG2      ILE   2  10.448  -1.377   7.932
   23   3HG2  ILE   2          3HG2      ILE   2  12.047  -0.770   7.491
   24   1HD1  ILE   2          1HD1      ILE   2  10.017  -2.972   5.422
   25   2HD1  ILE   2          2HD1      ILE   2  10.106  -2.098   3.894
   26   3HD1  ILE   2          3HD1      ILE   2   8.558  -2.727   4.463
   27    HA   PRO   3           HA       PRO   3  10.481   4.093   3.612
   28   1HB   PRO   3          1HB       PRO   3  12.584   3.483   2.041
   29   2HB   PRO   3          2HB       PRO   3  12.773   4.291   3.604
   30   1HG   PRO   3          1HG       PRO   3  13.030   1.371   2.949
   31   2HG   PRO   3          2HG       PRO   3  14.152   2.403   3.858
   32   1HD   PRO   3          1HD       PRO   3  12.420   0.804   5.122
   33   2HD   PRO   3          2HD       PRO   3  12.794   2.426   5.750
   34    H    VAL   4           H        VAL   4   9.190   1.311   3.394
   35    HA   VAL   4           HA       VAL   4   7.843   0.272   1.854
   36    HB   VAL   4           HB       VAL   4   8.908   2.296  -0.171
   37   1HG1  VAL   4          1HG1      VAL   4   6.754   0.229  -0.287
   38   2HG1  VAL   4          2HG1      VAL   4   7.941   0.698  -1.508
   39   3HG1  VAL   4          3HG1      VAL   4   6.560   1.741  -1.178
   40   1HG2  VAL   4          1HG2      VAL   4   7.212   3.753   0.382
   41   2HG2  VAL   4          2HG2      VAL   4   7.617   3.094   1.968
   42   3HG2  VAL   4          3HG2      VAL   4   6.206   2.498   1.099
   43    H    LYS   5           H        LYS   5   7.998  -1.343   0.225
   44    HA   LYS   5           HA       LYS   5  10.724  -2.334  -0.040
   45   1HB   LYS   5          1HB       LYS   5   8.018  -3.506  -0.020
   46   2HB   LYS   5          2HB       LYS   5   9.165  -4.276  -1.107
   47   1HG   LYS   5          1HG       LYS   5   9.514  -3.903   1.870
   48   2HG   LYS   5          2HG       LYS   5   9.086  -5.398   1.039
   49   1HD   LYS   5          1HD       LYS   5  11.214  -5.523  -0.029
   50   2HD   LYS   5          2HD       LYS   5  11.652  -3.904   0.526
   51   1HE   LYS   5          1HE       LYS   5  11.706  -4.656   2.822
   52   2HE   LYS   5          2HE       LYS   5  11.096  -6.245   2.354
   53   1HZ   LYS   5          1HZ       LYS   5  13.679  -5.127   1.387
   54   2HZ   LYS   5          2HZ       LYS   5  13.109  -6.721   1.214
   55   3HZ   LYS   5          3HZ       LYS   5  13.542  -6.137   2.748
   56    H    TYR   6           H        TYR   6   8.243  -3.228  -2.311
   57    HA   TYR   6           HA       TYR   6   9.797  -1.920  -4.442
   58   1HB   TYR   6          1HB       TYR   6   8.010  -4.236  -5.061
   59   2HB   TYR   6          2HB       TYR   6   9.508  -3.733  -5.836
   60    HD1  TYR   6           HD1      TYR   6   8.092  -5.596  -2.973
   61    HD2  TYR   6           HD2      TYR   6  11.659  -4.547  -5.056
   62    HE1  TYR   6           HE1      TYR   6   9.321  -7.327  -1.744
   63    HE2  TYR   6           HE2      TYR   6  12.885  -6.279  -3.827
   64    HH   TYR   6           HH       TYR   6  11.813  -8.709  -2.570
   65    H    GLY   7           H        GLY   7   8.303  -1.818  -6.538
   66   1HA   GLY   7          1HA       GLY   7   5.910  -1.533  -7.145
   67   2HA   GLY   7          2HA       GLY   7   5.765  -0.524  -5.716
   68    H    ASN   8           H        ASN   8   5.090   1.249  -6.931
   69    HA   ASN   8           HA       ASN   8   7.134   2.390  -8.725
   70   1HB   ASN   8          1HB       ASN   8   5.411   3.461  -9.956
   71   2HB   ASN   8          2HB       ASN   8   4.886   1.800  -9.714
   72   1HD2  ASN   8          1HD2      ASN   8   3.343   4.182 -10.313
   73   2HD2  ASN   8          2HD2      ASN   8   2.209   4.359  -9.013
   74    H    ALA   9           H        ALA   9   6.414   2.670  -5.670
   75    HA   ALA   9           HA       ALA   9   5.937   5.484  -5.388
   76   1HB   ALA   9          1HB       ALA   9   6.904   3.692  -3.202
   77   2HB   ALA   9          2HB       ALA   9   5.235   3.640  -3.772
   78   3HB   ALA   9          3HB       ALA   9   5.891   5.131  -3.096
   79    H    ASP  10           H        ASP  10   7.365   6.980  -4.389
   80    HA   ASP  10           HA       ASP  10  10.007   6.858  -5.454
   81   1HB   ASP  10          1HB       ASP  10   8.828   8.972  -5.358
   82   2HB   ASP  10          2HB       ASP  10   8.674   8.851  -3.609
   83    H    GLY  11           H        GLY  11   9.117   7.590  -2.076
   84   1HA   GLY  11          1HA       GLY  11  10.606   5.472  -0.957
   85   2HA   GLY  11          2HA       GLY  11  11.612   6.906  -1.035
   86    H    GLU  12           H        GLU  12   8.132   6.786  -0.383
   87    HA   GLU  12           HA       GLU  12   8.612   8.225   2.105
   88   1HB   GLU  12          1HB       GLU  12   6.165   7.704   0.439
   89   2HB   GLU  12          2HB       GLU  12   6.009   8.238   2.105
   90   1HG   GLU  12          1HG       GLU  12   7.610   9.728   0.044
   91   2HG   GLU  12          2HG       GLU  12   5.899  10.041   0.370
   92    H    TYR  13           H        TYR  13   6.033   7.232   3.199
   93    HA   TYR  13           HA       TYR  13   6.868   4.597   4.116
   94   1HB   TYR  13          1HB       TYR  13   5.925   5.190   6.285
   95   2HB   TYR  13          2HB       TYR  13   7.269   6.228   5.852
   96    HD1  TYR  13           HD1      TYR  13   6.509   8.433   4.567
   97    HD2  TYR  13           HD2      TYR  13   4.067   6.130   7.167
   98    HE1  TYR  13           HE1      TYR  13   5.064  10.404   4.940
   99    HE2  TYR  13           HE2      TYR  13   2.609   8.082   7.559
  100    HH   TYR  13           HH       TYR  13   2.458  10.664   5.667
  101    H    CYS  14           H        CYS  14   4.981   3.371   5.135
  102    HA   CYS  14           HA       CYS  14   2.882   3.199   3.247
  103   1HB   CYS  14          1HB       CYS  14   3.358   1.982   5.946
  104   2HB   CYS  14          2HB       CYS  14   1.799   1.785   5.153
  105    H    LYS  15           H        LYS  15   1.060   4.312   3.096
  106    HA   LYS  15           HA       LYS  15   0.498   6.392   5.005
  107   1HB   LYS  15          1HB       LYS  15   0.107   6.201   2.323
  108   2HB   LYS  15          2HB       LYS  15  -1.499   5.787   2.903
  109   1HG   LYS  15          1HG       LYS  15   0.001   8.309   3.606
  110   2HG   LYS  15          2HG       LYS  15  -1.271   8.175   2.390
  111   1HD   LYS  15          1HD       LYS  15  -2.846   7.461   4.143
  112   2HD   LYS  15          2HD       LYS  15  -1.569   7.652   5.348
  113   1HE   LYS  15          1HE       LYS  15  -2.741   9.828   3.616
  114   2HE   LYS  15          2HE       LYS  15  -3.021   9.592   5.342
  115   1HZ   LYS  15          1HZ       LYS  15  -0.958  10.374   5.883
  116   2HZ   LYS  15          2HZ       LYS  15  -1.253  11.287   4.480
  117   3HZ   LYS  15          3HZ       LYS  15  -0.255   9.918   4.406
  118    H    PHE  16           H        PHE  16  -0.427   5.845   6.855
  119    HA   PHE  16           HA       PHE  16  -2.662   3.929   6.768
  120   1HB   PHE  16          1HB       PHE  16  -0.651   4.440   8.973
  121   2HB   PHE  16          2HB       PHE  16  -2.098   3.464   9.179
  122    HD1  PHE  16           HD1      PHE  16   0.682   2.487   9.668
  123    HD2  PHE  16           HD2      PHE  16  -1.739   2.423   6.174
  124    HE1  PHE  16           HE1      PHE  16   1.908   0.520   8.864
  125    HE2  PHE  16           HE2      PHE  16  -0.532   0.460   5.358
  126    HZ   PHE  16           HZ       PHE  16   1.314  -0.520   6.688
  127    HA   PRO  17           HA       PRO  17  -4.323   3.735   6.783
  128   1HB   PRO  17          1HB       PRO  17  -6.949   4.473   6.467
  129   2HB   PRO  17          2HB       PRO  17  -6.316   3.632   7.879
  130   1HG   PRO  17          1HG       PRO  17  -7.333   6.323   7.721
  131   2HG   PRO  17          2HG       PRO  17  -6.757   5.451   9.152
  132   1HD   PRO  17          1HD       PRO  17  -5.361   7.435   7.478
  133   2HD   PRO  17          2HD       PRO  17  -5.023   6.924   9.144
  134    H    PHE  18           H        PHE  18  -4.843   3.308   4.600
  135    HA   PHE  18           HA       PHE  18  -4.845   5.708   2.899
  136   1HB   PHE  18          1HB       PHE  18  -3.906   4.370   1.092
  137   2HB   PHE  18          2HB       PHE  18  -2.884   4.270   2.515
  138    HD1  PHE  18           HD1      PHE  18  -3.054   2.179   3.957
  139    HD2  PHE  18           HD2      PHE  18  -4.707   2.462   0.049
  140    HE1  PHE  18           HE1      PHE  18  -3.095  -0.271   3.797
  141    HE2  PHE  18           HE2      PHE  18  -4.751   0.012  -0.122
  142    HZ   PHE  18           HZ       PHE  18  -3.949  -1.377   1.760
  143    H    LEU  19           H        LEU  19  -6.315   5.864   1.199
  144    HA   LEU  19           HA       LEU  19  -8.780   4.447   1.687
  145   1HB   LEU  19          1HB       LEU  19  -8.657   6.898   1.239
  146   2HB   LEU  19          2HB       LEU  19  -8.156   6.531  -0.399
  147    HG   LEU  19           HG       LEU  19 -10.325   5.283  -0.686
  148   1HD1  LEU  19          1HD1      LEU  19 -11.853   6.666   1.228
  149   2HD1  LEU  19          2HD1      LEU  19 -10.519   5.901   2.098
  150   3HD1  LEU  19          3HD1      LEU  19 -11.599   4.930   1.090
  151   1HD2  LEU  19          1HD2      LEU  19 -11.661   7.367  -0.935
  152   2HD2  LEU  19          2HD2      LEU  19 -10.067   7.443  -1.677
  153   3HD2  LEU  19          3HD2      LEU  19 -10.357   8.245  -0.135
  154    H    PHE  20           H        PHE  20  -9.153   2.526   0.799
  155    HA   PHE  20           HA       PHE  20  -8.250   2.074  -1.972
  156   1HB   PHE  20          1HB       PHE  20  -7.245   0.593  -0.096
  157   2HB   PHE  20          2HB       PHE  20  -8.853  -0.112  -0.003
  158    HD1  PHE  20           HD1      PHE  20  -7.569  -2.184  -0.438
  159    HD2  PHE  20           HD2      PHE  20  -8.025   0.894  -3.335
  160    HE1  PHE  20           HE1      PHE  20  -7.039  -3.807  -2.206
  161    HE2  PHE  20           HE2      PHE  20  -7.496  -0.727  -5.120
  162    HZ   PHE  20           HZ       PHE  20  -7.010  -3.074  -4.562
  163    H    ASN  21           H        ASN  21 -10.032   2.629  -3.074
  164    HA   ASN  21           HA       ASN  21 -12.129   2.614  -3.931
  165   1HB   ASN  21          1HB       ASN  21 -11.981  -0.166  -2.792
  166   2HB   ASN  21          2HB       ASN  21 -13.432   0.413  -3.602
  167   1HD2  ASN  21          1HD2      ASN  21 -13.531  -0.200  -5.630
  168   2HD2  ASN  21          2HD2      ASN  21 -12.196  -0.366  -6.717
  169    H    GLY  22           H        GLY  22 -11.672   3.331  -0.942
  170   1HA   GLY  22          1HA       GLY  22 -13.438   4.682   0.090
  171   2HA   GLY  22          2HA       GLY  22 -14.542   3.368  -0.259
  172    H    LYS  23           H        LYS  23 -11.973   1.722   0.606
  173    HA   LYS  23           HA       LYS  23 -12.730   1.716   3.448
  174   1HB   LYS  23          1HB       LYS  23 -13.045  -0.384   2.036
  175   2HB   LYS  23          2HB       LYS  23 -11.295  -0.480   1.939
  176   1HG   LYS  23          1HG       LYS  23 -11.144  -0.743   4.353
  177   2HG   LYS  23          2HG       LYS  23 -12.900  -0.574   4.495
  178   1HD   LYS  23          1HD       LYS  23 -13.048  -2.560   2.888
  179   2HD   LYS  23          2HD       LYS  23 -11.331  -2.802   3.223
  180   1HE   LYS  23          1HE       LYS  23 -13.474  -2.702   5.345
  181   2HE   LYS  23          2HE       LYS  23 -12.873  -4.191   4.618
  182   1HZ   LYS  23          1HZ       LYS  23 -10.938  -2.325   5.823
  183   2HZ   LYS  23          2HZ       LYS  23 -10.871  -4.016   5.683
  184   3HZ   LYS  23          3HZ       LYS  23 -11.888  -3.303   6.839
  185    H    GLU  24           H        GLU  24 -11.311   2.581   4.818
  186    HA   GLU  24           HA       GLU  24  -8.583   3.078   3.922
  187   1HB   GLU  24          1HB       GLU  24 -10.066   3.924   6.417
  188   2HB   GLU  24          2HB       GLU  24  -8.399   4.353   6.072
  189   1HG   GLU  24          1HG       GLU  24  -9.165   5.489   4.020
  190   2HG   GLU  24          2HG       GLU  24 -10.828   5.141   4.483
  191    H    TYR  25           H        TYR  25  -6.906   1.856   4.465
  192    HA   TYR  25           HA       TYR  25  -7.310  -0.226   6.499
  193   1HB   TYR  25          1HB       TYR  25  -5.296  -0.015   4.281
  194   2HB   TYR  25          2HB       TYR  25  -5.317  -1.318   5.450
  195    HD1  TYR  25           HD1      TYR  25  -7.344   0.329   2.822
  196    HD2  TYR  25           HD2      TYR  25  -6.684  -3.213   5.086
  197    HE1  TYR  25           HE1      TYR  25  -8.965  -0.865   1.395
  198    HE2  TYR  25           HE2      TYR  25  -8.298  -4.421   3.654
  199    HH   TYR  25           HH       TYR  25  -9.757  -4.286   2.002
  200    H    ASN  26           H        ASN  26  -6.252  -0.229   8.344
  201    HA   ASN  26           HA       ASN  26  -4.396   1.940   8.920
  202   1HB   ASN  26          1HB       ASN  26  -5.566  -0.237  10.673
  203   2HB   ASN  26          2HB       ASN  26  -4.391   0.937  11.246
  204   1HD2  ASN  26          1HD2      ASN  26  -6.423   2.282   8.935
  205   2HD2  ASN  26          2HD2      ASN  26  -7.542   3.057   9.999
  206    H    SER  27           H        SER  27  -4.153  -1.027   7.574
  207    HA   SER  27           HA       SER  27  -1.303  -1.168   8.134
  208   1HB   SER  27          1HB       SER  27  -1.441  -3.625   8.567
  209   2HB   SER  27          2HB       SER  27  -2.241  -2.664   9.821
  210    HG   SER  27           HG       SER  27  -4.115  -3.477   9.262
  211    H    CYS  28           H        CYS  28  -0.606  -3.382   6.790
  212    HA   CYS  28           HA       CYS  28  -1.220  -2.652   4.069
  213   1HB   CYS  28          1HB       CYS  28   0.483  -4.915   5.135
  214   2HB   CYS  28          2HB       CYS  28   0.446  -4.335   3.473
  215    H    THR  29           H        THR  29  -2.299  -3.953   2.536
  216    HA   THR  29           HA       THR  29  -3.670  -6.311   3.612
  217    HB   THR  29           HB       THR  29  -5.208  -4.371   3.550
  218    HG1  THR  29           HG1      THR  29  -6.245  -6.263   3.265
  219   1HG2  THR  29          1HG2      THR  29  -4.125  -3.306   1.486
  220   2HG2  THR  29          2HG2      THR  29  -5.879  -3.246   1.627
  221   3HG2  THR  29          3HG2      THR  29  -5.119  -4.416   0.553
  222    H    ASP  30           H        ASP  30  -4.388  -7.852   1.904
  223    HA   ASP  30           HA       ASP  30  -2.550  -7.751  -0.366
  224   1HB   ASP  30          1HB       ASP  30  -3.978 -10.224  -0.088
  225   2HB   ASP  30          2HB       ASP  30  -2.272  -9.961  -0.266
  226    H    THR  31           H        THR  31  -5.423  -6.721   0.309
  227    HA   THR  31           HA       THR  31  -7.228  -7.828  -1.537
  228    HB   THR  31           HB       THR  31  -7.087  -4.997  -0.500
  229    HG1  THR  31           HG1      THR  31  -7.181  -6.260   1.275
  230   1HG2  THR  31          1HG2      THR  31  -9.712  -6.175  -0.842
  231   2HG2  THR  31          2HG2      THR  31  -8.833  -5.972  -2.356
  232   3HG2  THR  31          3HG2      THR  31  -9.103  -4.584  -1.302
  233    H    GLY  32           H        GLY  32  -7.523  -7.515  -3.683
  234   1HA   GLY  32          1HA       GLY  32  -7.372  -6.408  -5.736
  235   2HA   GLY  32          2HA       GLY  32  -6.241  -5.279  -5.012
  236    H    ARG  33           H        ARG  33  -4.817  -7.703  -3.850
  237    HA   ARG  33           HA       ARG  33  -3.107  -8.170  -6.173
  238   1HB   ARG  33          1HB       ARG  33  -2.727  -8.673  -3.221
  239   2HB   ARG  33          2HB       ARG  33  -1.561  -9.140  -4.436
  240   1HG   ARG  33          1HG       ARG  33  -2.456  -6.341  -3.815
  241   2HG   ARG  33          2HG       ARG  33  -0.930  -7.070  -3.340
  242   1HD   ARG  33          1HD       ARG  33  -1.867  -6.426  -6.129
  243   2HD   ARG  33          2HD       ARG  33  -0.553  -5.660  -5.238
  244    HE   ARG  33           HE       ARG  33  -0.172  -8.483  -5.660
  245   1HH1  ARG  33          1HH1      ARG  33   0.243  -5.287  -6.996
  246   2HH1  ARG  33          2HH1      ARG  33   1.503  -5.773  -8.092
  247   1HH2  ARG  33          1HH2      ARG  33   1.416  -9.152  -7.120
  248   2HH2  ARG  33          2HH2      ARG  33   2.184  -7.986  -8.150
  249    H    SER  34           H        SER  34  -2.778 -10.141  -7.034
  250    HA   SER  34           HA       SER  34  -4.631 -12.233  -6.249
  251   1HB   SER  34          1HB       SER  34  -2.624 -12.309  -8.517
  252   2HB   SER  34          2HB       SER  34  -4.090 -13.277  -8.333
  253    HG   SER  34           HG       SER  34  -4.805 -11.721  -9.632
  254    H    ASP  35           H        ASP  35  -1.306 -11.404  -5.938
  255    HA   ASP  35           HA       ASP  35  -0.365 -14.020  -5.436
  256   1HB   ASP  35          1HB       ASP  35   1.322 -11.999  -4.340
  257   2HB   ASP  35          2HB       ASP  35   1.686 -13.128  -5.601
  258    H    GLY  36           H        GLY  36  -2.065 -11.871  -3.627
  259   1HA   GLY  36          1HA       GLY  36  -2.728 -11.904  -1.416
  260   2HA   GLY  36          2HA       GLY  36  -1.844 -13.417  -1.249
  261    H    PHE  37           H        PHE  37  -0.467 -10.423  -2.421
  262    HA   PHE  37           HA       PHE  37   1.456 -10.466  -0.219
  263   1HB   PHE  37          1HB       PHE  37   1.971 -10.235  -2.809
  264   2HB   PHE  37          2HB       PHE  37   1.614  -8.542  -2.506
  265    HD1  PHE  37           HD1      PHE  37   2.830  -7.611  -0.295
  266    HD2  PHE  37           HD2      PHE  37   4.170 -10.854  -2.699
  267    HE1  PHE  37           HE1      PHE  37   5.119  -7.268   0.527
  268    HE2  PHE  37           HE2      PHE  37   6.473 -10.512  -1.885
  269    HZ   PHE  37           HZ       PHE  37   6.946  -8.718  -0.265
  270    H    LEU  38           H        LEU  38   1.555  -8.893   1.312
  271    HA   LEU  38           HA       LEU  38  -0.649  -7.063   1.470
  272   1HB   LEU  38          1HB       LEU  38   0.953  -6.330   3.529
  273   2HB   LEU  38          2HB       LEU  38  -0.289  -7.551   3.618
  274    HG   LEU  38           HG       LEU  38   1.840  -8.166   4.728
  275   1HD1  LEU  38          1HD1      LEU  38   0.888  -9.880   2.464
  276   2HD1  LEU  38          2HD1      LEU  38   0.476  -9.978   4.175
  277   3HD1  LEU  38          3HD1      LEU  38   2.096 -10.419   3.632
  278   1HD2  LEU  38          1HD2      LEU  38   3.578  -7.262   3.500
  279   2HD2  LEU  38          2HD2      LEU  38   2.954  -7.874   1.967
  280   3HD2  LEU  38          3HD2      LEU  38   3.681  -8.981   3.134
  281    H    TRP  39           H        TRP  39  -0.701  -5.060   0.797
  282    HA   TRP  39           HA       TRP  39   1.836  -3.637   0.379
  283   1HB   TRP  39          1HB       TRP  39   0.975  -2.647  -1.687
  284   2HB   TRP  39          2HB       TRP  39   1.011  -4.400  -1.805
  285    HD1  TRP  39           HD1      TRP  39  -1.402  -5.680  -1.725
  286    HE1  TRP  39           HE1      TRP  39  -3.732  -4.878  -2.424
  287    HE3  TRP  39           HE3      TRP  39  -0.566  -0.617  -1.806
  288    HZ2  TRP  39           HZ2      TRP  39  -5.038  -2.440  -2.957
  289    HZ3  TRP  39           HZ3      TRP  39  -2.425   0.870  -2.455
  290    HH2  TRP  39           HH2      TRP  39  -4.613  -0.038  -3.006
  291    H    CYS  40           H        CYS  40   1.412  -1.249   0.018
  292    HA   CYS  40           HA       CYS  40  -0.925  -0.244   1.443
  293   1HB   CYS  40          1HB       CYS  40   0.402   1.081   2.991
  294   2HB   CYS  40          2HB       CYS  40   0.865  -0.611   3.156
  295    H    SER  41           H        SER  41  -1.352   1.968   0.921
  296    HA   SER  41           HA       SER  41  -0.167   2.769  -1.598
  297   1HB   SER  41          1HB       SER  41  -2.613   3.027  -1.212
  298   2HB   SER  41          2HB       SER  41  -2.268   4.175   0.078
  299    HG   SER  41           HG       SER  41  -2.155   5.654  -1.399
  300    H    THR  42           H        THR  42   0.619   4.995  -1.873
  301    HA   THR  42           HA       THR  42   2.205   5.803   0.470
  302    HB   THR  42           HB       THR  42   2.623   6.722  -2.379
  303    HG1  THR  42           HG1      THR  42   3.087   4.278  -1.272
  304   1HG2  THR  42          1HG2      THR  42   4.750   7.381  -1.752
  305   2HG2  THR  42          2HG2      THR  42   4.738   6.383  -0.298
  306   3HG2  THR  42          3HG2      THR  42   3.767   7.853  -0.367
  307    H    THR  43           H        THR  43  -0.116   6.826  -1.908
  308    HA   THR  43           HA       THR  43  -0.246   9.502  -0.742
  309    HB   THR  43           HB       THR  43  -1.792   9.937  -2.700
  310    HG1  THR  43           HG1      THR  43  -2.407   8.309  -3.860
  311   1HG2  THR  43          1HG2      THR  43  -0.103   9.940  -4.427
  312   2HG2  THR  43          2HG2      THR  43   0.907   8.855  -3.473
  313   3HG2  THR  43          3HG2      THR  43   0.586  10.493  -2.898
  314    H    TYR  44           H        TYR  44  -2.620  10.338  -0.562
  315    HA   TYR  44           HA       TYR  44  -3.959   8.579   1.261
  316   1HB   TYR  44          1HB       TYR  44  -3.980  11.014   1.600
  317   2HB   TYR  44          2HB       TYR  44  -4.880  11.220   0.097
  318    HD1  TYR  44           HD1      TYR  44  -5.188   9.063   3.157
  319    HD2  TYR  44           HD2      TYR  44  -7.128  11.712   0.440
  320    HE1  TYR  44           HE1      TYR  44  -7.291   8.800   4.404
  321    HE2  TYR  44           HE2      TYR  44  -9.224  11.457   1.690
  322    HH   TYR  44           HH       TYR  44  -9.622   9.085   4.178
  323    H    ASN  45           H        ASN  45  -4.772   9.926  -1.923
  324    HA   ASN  45           HA       ASN  45  -6.948   7.986  -2.155
  325   1HB   ASN  45          1HB       ASN  45  -7.239  10.449  -2.758
  326   2HB   ASN  45          2HB       ASN  45  -6.203  10.155  -4.135
  327   1HD2  ASN  45          1HD2      ASN  45  -7.531   7.389  -4.336
  328   2HD2  ASN  45          2HD2      ASN  45  -8.982   7.809  -5.102
  329    H    PHE  46           H        PHE  46  -6.200   6.040  -2.769
  330    HA   PHE  46           HA       PHE  46  -3.878   5.724  -4.405
  331   1HB   PHE  46          1HB       PHE  46  -4.397   4.082  -2.688
  332   2HB   PHE  46          2HB       PHE  46  -5.941   3.697  -3.481
  333    HD1  PHE  46           HD1      PHE  46  -6.002   2.040  -5.163
  334    HD2  PHE  46           HD2      PHE  46  -2.227   3.596  -3.937
  335    HE1  PHE  46           HE1      PHE  46  -4.867   0.331  -6.505
  336    HE2  PHE  46           HE2      PHE  46  -1.096   1.885  -5.281
  337    HZ   PHE  46           HZ       PHE  46  -2.411   0.252  -6.570
  338    H    GLU  47           H        GLU  47  -7.319   5.747  -4.990
  339    HA   GLU  47           HA       GLU  47  -7.327   4.557  -7.545
  340   1HB   GLU  47          1HB       GLU  47  -9.263   5.225  -5.903
  341   2HB   GLU  47          2HB       GLU  47  -9.243   6.732  -6.799
  342   1HG   GLU  47          1HG       GLU  47  -9.693   5.561  -8.862
  343   2HG   GLU  47          2HG       GLU  47  -9.628   4.010  -8.016
  344    H    LYS  48           H        LYS  48  -6.709   7.836  -6.480
  345    HA   LYS  48           HA       LYS  48  -6.746   8.871  -9.156
  346   1HB   LYS  48          1HB       LYS  48  -7.436  10.563  -7.784
  347   2HB   LYS  48          2HB       LYS  48  -6.462  10.016  -6.433
  348   1HG   LYS  48          1HG       LYS  48  -5.588  12.106  -7.006
  349   2HG   LYS  48          2HG       LYS  48  -4.455  10.950  -7.697
  350   1HD   LYS  48          1HD       LYS  48  -5.647  11.241  -9.896
  351   2HD   LYS  48          2HD       LYS  48  -6.569  12.547  -9.142
  352   1HE   LYS  48          1HE       LYS  48  -4.616  13.345 -10.435
  353   2HE   LYS  48          2HE       LYS  48  -4.560  13.800  -8.732
  354   1HZ   LYS  48          1HZ       LYS  48  -2.414  12.983  -9.634
  355   2HZ   LYS  48          2HZ       LYS  48  -3.118  11.459  -9.875
  356   3HZ   LYS  48          3HZ       LYS  48  -2.966  12.086  -8.302
  357    H    ASP  49           H        ASP  49  -4.156   8.939  -6.682
  358    HA   ASP  49           HA       ASP  49  -2.166   9.448  -8.642
  359   1HB   ASP  49          1HB       ASP  49  -1.988   8.660  -5.736
  360   2HB   ASP  49          2HB       ASP  49  -0.582   9.066  -6.720
  361    H    GLY  50           H        GLY  50  -2.954   6.573  -6.731
  362   1HA   GLY  50          1HA       GLY  50  -2.707   4.347  -7.299
  363   2HA   GLY  50          2HA       GLY  50  -2.055   4.854  -8.848
  364    H    LYS  51           H        LYS  51  -0.571   6.253  -6.080
  365    HA   LYS  51           HA       LYS  51   1.869   4.823  -6.676
  366   1HB   LYS  51          1HB       LYS  51   1.375   6.832  -4.483
  367   2HB   LYS  51          2HB       LYS  51   2.935   6.292  -5.087
  368   1HG   LYS  51          1HG       LYS  51   0.882   7.795  -6.666
  369   2HG   LYS  51          2HG       LYS  51   2.326   8.493  -5.941
  370   1HD   LYS  51          1HD       LYS  51   2.286   6.369  -8.091
  371   2HD   LYS  51          2HD       LYS  51   2.586   8.086  -8.362
  372   1HE   LYS  51          1HE       LYS  51   4.268   6.268  -6.641
  373   2HE   LYS  51          2HE       LYS  51   4.671   6.786  -8.279
  374   1HZ   LYS  51          1HZ       LYS  51   4.223   9.137  -7.037
  375   2HZ   LYS  51          2HZ       LYS  51   5.757   8.428  -7.227
  376   3HZ   LYS  51          3HZ       LYS  51   4.899   8.219  -5.771
  377    H    TYR  52           H        TYR  52   2.578   3.088  -5.621
  378    HA   TYR  52           HA       TYR  52   1.583   2.516  -2.940
  379   1HB   TYR  52          1HB       TYR  52   0.801   0.301  -3.517
  380   2HB   TYR  52          2HB       TYR  52  -0.016   1.473  -4.543
  381    HD1  TYR  52           HD1      TYR  52   2.379  -1.285  -4.445
  382    HD2  TYR  52           HD2      TYR  52   0.523   1.624  -6.935
  383    HE1  TYR  52           HE1      TYR  52   3.177  -2.486  -6.432
  384    HE2  TYR  52           HE2      TYR  52   1.308   0.424  -8.927
  385    HH   TYR  52           HH       TYR  52   1.976  -2.218  -9.348
  386    H    GLY  53           H        GLY  53   2.532   0.441  -2.147
  387   1HA   GLY  53          1HA       GLY  53   5.021  -0.408  -3.285
  388   2HA   GLY  53          2HA       GLY  53   5.194   0.513  -1.799
  389    H    PHE  54           H        PHE  54   5.946  -2.185  -2.037
  390    HA   PHE  54           HA       PHE  54   3.781  -3.619  -0.747
  391   1HB   PHE  54          1HB       PHE  54   6.416  -4.601  -1.806
  392   2HB   PHE  54          2HB       PHE  54   5.230  -5.628  -1.011
  393    HD1  PHE  54           HD1      PHE  54   5.721  -3.367  -3.902
  394    HD2  PHE  54           HD2      PHE  54   3.444  -6.530  -2.206
  395    HE1  PHE  54           HE1      PHE  54   4.564  -3.662  -6.043
  396    HE2  PHE  54           HE2      PHE  54   2.275  -6.841  -4.343
  397    HZ   PHE  54           HZ       PHE  54   2.821  -5.397  -6.270
  398    H    CYS  55           H        CYS  55   4.118  -4.876   1.134
  399    HA   CYS  55           HA       CYS  55   5.891  -3.507   3.034
  400   1HB   CYS  55          1HB       CYS  55   3.486  -5.258   3.590
  401   2HB   CYS  55          2HB       CYS  55   4.323  -4.211   4.732
  402    HA   PRO  56           HA       PRO  56   8.345  -7.093   3.853
  403   1HB   PRO  56          1HB       PRO  56   8.049  -7.564   6.536
  404   2HB   PRO  56          2HB       PRO  56   9.122  -6.346   5.854
  405   1HG   PRO  56          1HG       PRO  56   6.386  -6.033   7.013
  406   2HG   PRO  56          2HG       PRO  56   7.800  -4.974   7.181
  407   1HD   PRO  56          1HD       PRO  56   5.777  -4.381   5.513
  408   2HD   PRO  56          2HD       PRO  56   7.461  -3.990   5.106
  409    H    HIS  57           H        HIS  57   7.861  -9.068   3.181
  410    HA   HIS  57           HA       HIS  57   5.305 -10.272   3.852
  411   1HB   HIS  57          1HB       HIS  57   6.351 -10.293   1.529
  412   2HB   HIS  57          2HB       HIS  57   7.507 -11.456   2.162
  413    HD1  HIS  57           HD1      HIS  57   3.708 -11.155   1.984
  414    HD2  HIS  57           HD2      HIS  57   6.735 -13.987   1.683
  415    HE1  HIS  57           HE1      HIS  57   2.550 -13.321   1.455
  416    H    GLU  58           H        GLU  58   8.511 -10.361   4.953
  417    HA   GLU  58           HA       GLU  58   8.767 -12.997   5.846
  418   1HB   GLU  58          1HB       GLU  58   9.969 -10.420   6.822
  419   2HB   GLU  58          2HB       GLU  58  10.426 -11.968   7.463
  420   1HG   GLU  58          1HG       GLU  58  12.096 -11.242   5.917
  421   2HG   GLU  58          2HG       GLU  58  11.251 -12.623   5.224
  422    H    ALA  59           H        ALA  59   8.299 -10.176   7.946
  423    HA   ALA  59           HA       ALA  59   6.200 -11.563   9.407
  424   1HB   ALA  59          1HB       ALA  59   7.405 -11.034  11.588
  425   2HB   ALA  59          2HB       ALA  59   8.861 -10.857  10.608
  426   3HB   ALA  59          3HB       ALA  59   8.001 -12.398  10.646
  Start of MODEL   39
    1   1H    ARG   1          1H        ARG   1   5.667   5.485  11.045
    2   2H    ARG   1          2H        ARG   1   7.274   4.987  10.676
    3   3H    ARG   1          3H        ARG   1   6.080   3.820  11.082
    4    HA   ARG   1           HA       ARG   1   4.928   4.130   9.136
    5   1HB   ARG   1          1HB       ARG   1   5.457   6.695   9.367
    6   2HB   ARG   1          2HB       ARG   1   6.787   6.323   8.278
    7   1HG   ARG   1          1HG       ARG   1   5.273   5.560   6.591
    8   2HG   ARG   1          2HG       ARG   1   3.900   5.703   7.693
    9   1HD   ARG   1          1HD       ARG   1   4.165   8.102   7.786
   10   2HD   ARG   1          2HD       ARG   1   5.638   8.013   6.820
   11    HE   ARG   1           HE       ARG   1   3.491   6.859   5.382
   12   1HH1  ARG   1          1HH1      ARG   1   4.673   9.968   6.463
   13   2HH1  ARG   1          2HH1      ARG   1   3.934  10.842   5.157
   14   1HH2  ARG   1          1HH2      ARG   1   2.570   7.999   3.631
   15   2HH2  ARG   1          2HH2      ARG   1   2.748   9.726   3.545
   16    H    ILE   2           H        ILE   2   5.639   2.232   8.284
   17    HA   ILE   2           HA       ILE   2   8.341   1.536   8.057
   18    HB   ILE   2           HB       ILE   2   7.509  -0.324   6.518
   19   1HG1  ILE   2          1HG1      ILE   2   4.859   0.944   7.254
   20   2HG1  ILE   2          2HG1      ILE   2   5.528   0.702   5.643
   21   1HG2  ILE   2          1HG2      ILE   2   6.528  -1.612   8.341
   22   2HG2  ILE   2          2HG2      ILE   2   6.171  -0.143   9.234
   23   3HG2  ILE   2          3HG2      ILE   2   7.845  -0.629   8.972
   24   1HD1  ILE   2          1HD1      ILE   2   4.281  -1.265   7.492
   25   2HD1  ILE   2          2HD1      ILE   2   5.470  -1.822   6.317
   26   3HD1  ILE   2          3HD1      ILE   2   4.004  -1.006   5.768
   27    HA   PRO   3           HA       PRO   3  10.202   3.329   4.621
   28   1HB   PRO   3          1HB       PRO   3  11.622   1.100   3.785
   29   2HB   PRO   3          2HB       PRO   3  12.106   2.216   5.068
   30   1HG   PRO   3          1HG       PRO   3  10.652  -0.399   5.280
   31   2HG   PRO   3          2HG       PRO   3  12.002   0.209   6.261
   32   1HD   PRO   3          1HD       PRO   3   9.563   0.327   7.234
   33   2HD   PRO   3          2HD       PRO   3  10.624   1.744   7.402
   34    H    VAL   4           H        VAL   4   8.540   0.260   3.937
   35    HA   VAL   4           HA       VAL   4   7.394  -0.447   2.064
   36    HB   VAL   4           HB       VAL   4   7.945   2.385   1.080
   37   1HG1  VAL   4          1HG1      VAL   4   6.816   2.003  -0.869
   38   2HG1  VAL   4          2HG1      VAL   4   5.925   0.625  -0.220
   39   3HG1  VAL   4          3HG1      VAL   4   7.622   0.444  -0.676
   40   1HG2  VAL   4          1HG2      VAL   4   5.336   1.106   1.856
   41   2HG2  VAL   4          2HG2      VAL   4   5.674   2.811   1.569
   42   3HG2  VAL   4          3HG2      VAL   4   6.349   2.009   2.985
   43    H    LYS   5           H        LYS   5   7.895  -1.375  -0.007
   44    HA   LYS   5           HA       LYS   5  10.755  -1.183  -0.633
   45   1HB   LYS   5          1HB       LYS   5   9.013  -3.539  -0.179
   46   2HB   LYS   5          2HB       LYS   5  10.240  -3.677  -1.425
   47   1HG   LYS   5          1HG       LYS   5  10.726  -3.009   1.466
   48   2HG   LYS   5          2HG       LYS   5  11.013  -4.570   0.686
   49   1HD   LYS   5          1HD       LYS   5  12.764  -3.686  -0.658
   50   2HD   LYS   5          2HD       LYS   5  12.374  -2.027  -0.199
   51   1HE   LYS   5          1HE       LYS   5  12.976  -2.621   2.154
   52   2HE   LYS   5          2HE       LYS   5  13.505  -4.196   1.563
   53   1HZ   LYS   5          1HZ       LYS   5  14.621  -1.839   0.244
   54   2HZ   LYS   5          2HZ       LYS   5  15.363  -3.319   0.646
   55   3HZ   LYS   5          3HZ       LYS   5  15.124  -2.141   1.835
   56    H    TYR   6           H        TYR   6   9.258  -3.455  -2.496
   57    HA   TYR   6           HA       TYR   6   9.753  -2.095  -4.890
   58   1HB   TYR   6          1HB       TYR   6   8.026  -4.554  -4.613
   59   2HB   TYR   6          2HB       TYR   6   9.017  -4.073  -5.990
   60    HD1  TYR   6           HD1      TYR   6   9.076  -5.548  -2.629
   61    HD2  TYR   6           HD2      TYR   6  11.443  -4.368  -5.962
   62    HE1  TYR   6           HE1      TYR   6  10.975  -6.767  -1.695
   63    HE2  TYR   6           HE2      TYR   6  13.350  -5.596  -5.037
   64    HH   TYR   6           HH       TYR   6  13.336  -7.858  -3.123
   65    H    GLY   7           H        GLY   7   8.364  -1.505  -6.570
   66   1HA   GLY   7          1HA       GLY   7   5.974  -1.208  -7.260
   67   2HA   GLY   7          2HA       GLY   7   5.728  -0.487  -5.680
   68    H    ASN   8           H        ASN   8   5.197   1.572  -6.492
   69    HA   ASN   8           HA       ASN   8   7.471   2.875  -7.817
   70   1HB   ASN   8          1HB       ASN   8   6.003   4.360  -9.001
   71   2HB   ASN   8          2HB       ASN   8   5.510   2.698  -9.304
   72   1HD2  ASN   8          1HD2      ASN   8   4.075   5.270  -9.466
   73   2HD2  ASN   8          2HD2      ASN   8   2.667   5.058  -8.499
   74    H    ALA   9           H        ALA   9   6.560   2.599  -4.934
   75    HA   ALA   9           HA       ALA   9   6.430   5.421  -4.160
   76   1HB   ALA   9          1HB       ALA   9   6.288   3.271  -2.142
   77   2HB   ALA   9          2HB       ALA   9   4.910   3.440  -3.241
   78   3HB   ALA   9          3HB       ALA   9   5.407   4.798  -2.227
   79    H    ASP  10           H        ASP  10   8.849   4.693  -5.181
   80    HA   ASP  10           HA       ASP  10  10.626   3.712  -3.160
   81   1HB   ASP  10          1HB       ASP  10  10.972   3.523  -5.678
   82   2HB   ASP  10          2HB       ASP  10  11.419   5.230  -5.647
   83    H    GLY  11           H        GLY  11  10.776   4.911  -1.374
   84   1HA   GLY  11          1HA       GLY  11  12.250   6.735  -0.529
   85   2HA   GLY  11          2HA       GLY  11  11.432   7.774  -1.690
   86    H    GLU  12           H        GLU  12   8.802   6.637  -1.218
   87    HA   GLU  12           HA       GLU  12   8.200   8.103   1.217
   88   1HB   GLU  12          1HB       GLU  12   6.413   6.922  -0.905
   89   2HB   GLU  12          2HB       GLU  12   5.833   7.805   0.500
   90   1HG   GLU  12          1HG       GLU  12   5.837   9.475  -1.031
   91   2HG   GLU  12          2HG       GLU  12   7.466   9.655  -0.392
   92    H    TYR  13           H        TYR  13   6.369   7.200   2.601
   93    HA   TYR  13           HA       TYR  13   6.864   4.337   3.123
   94   1HB   TYR  13          1HB       TYR  13   5.925   6.240   5.239
   95   2HB   TYR  13          2HB       TYR  13   6.752   4.686   5.414
   96    HD1  TYR  13           HD1      TYR  13   9.180   4.663   4.280
   97    HD2  TYR  13           HD2      TYR  13   7.158   8.116   5.717
   98    HE1  TYR  13           HE1      TYR  13  11.334   5.809   4.536
   99    HE2  TYR  13           HE2      TYR  13   9.306   9.279   5.973
  100    HH   TYR  13           HH       TYR  13  12.369   7.687   5.110
  101    H    CYS  14           H        CYS  14   4.891   3.630   4.755
  102    HA   CYS  14           HA       CYS  14   2.644   3.541   3.005
  103   1HB   CYS  14          1HB       CYS  14   3.081   2.497   5.798
  104   2HB   CYS  14          2HB       CYS  14   1.586   2.250   4.905
  105    H    LYS  15           H        LYS  15   0.700   4.539   3.111
  106    HA   LYS  15           HA       LYS  15   0.461   6.757   5.012
  107   1HB   LYS  15          1HB       LYS  15  -0.299   6.356   2.265
  108   2HB   LYS  15          2HB       LYS  15  -1.728   6.727   3.218
  109   1HG   LYS  15          1HG       LYS  15   0.778   8.391   3.228
  110   2HG   LYS  15          2HG       LYS  15  -0.617   8.705   2.202
  111   1HD   LYS  15          1HD       LYS  15  -0.697   8.597   5.213
  112   2HD   LYS  15          2HD       LYS  15  -0.547  10.080   4.268
  113   1HE   LYS  15          1HE       LYS  15  -2.700   9.190   3.077
  114   2HE   LYS  15          2HE       LYS  15  -2.879   8.234   4.551
  115   1HZ   LYS  15          1HZ       LYS  15  -3.232  11.072   4.140
  116   2HZ   LYS  15          2HZ       LYS  15  -2.332  10.684   5.530
  117   3HZ   LYS  15          3HZ       LYS  15  -3.899  10.060   5.337
  118    H    PHE  16           H        PHE  16  -0.472   6.200   6.845
  119    HA   PHE  16           HA       PHE  16  -2.790   4.385   6.737
  120   1HB   PHE  16          1HB       PHE  16  -0.771   4.798   8.955
  121   2HB   PHE  16          2HB       PHE  16  -2.235   3.841   9.124
  122    HD1  PHE  16           HD1      PHE  16   0.432   2.737   9.668
  123    HD2  PHE  16           HD2      PHE  16  -1.764   2.928   6.031
  124    HE1  PHE  16           HE1      PHE  16   1.633   0.766   8.847
  125    HE2  PHE  16           HE2      PHE  16  -0.570   0.955   5.201
  126    HZ   PHE  16           HZ       PHE  16   1.139  -0.167   6.608
  127    HA   PRO  17           HA       PRO  17  -4.466   4.179   6.829
  128   1HB   PRO  17          1HB       PRO  17  -7.083   4.981   6.524
  129   2HB   PRO  17          2HB       PRO  17  -6.455   4.125   7.938
  130   1HG   PRO  17          1HG       PRO  17  -7.403   6.844   7.779
  131   2HG   PRO  17          2HG       PRO  17  -6.846   5.958   9.204
  132   1HD   PRO  17          1HD       PRO  17  -5.416   7.915   7.534
  133   2HD   PRO  17          2HD       PRO  17  -5.069   7.370   9.190
  134    H    PHE  18           H        PHE  18  -5.276   3.736   4.704
  135    HA   PHE  18           HA       PHE  18  -5.253   6.075   2.928
  136   1HB   PHE  18          1HB       PHE  18  -4.136   4.794   1.204
  137   2HB   PHE  18          2HB       PHE  18  -3.181   4.743   2.677
  138    HD1  PHE  18           HD1      PHE  18  -5.508   2.770   0.568
  139    HD2  PHE  18           HD2      PHE  18  -2.582   2.702   3.657
  140    HE1  PHE  18           HE1      PHE  18  -5.415   0.328   0.400
  141    HE2  PHE  18           HE2      PHE  18  -2.484   0.242   3.499
  142    HZ   PHE  18           HZ       PHE  18  -3.895  -0.963   1.881
  143    H    LEU  19           H        LEU  19  -6.712   6.084   1.230
  144    HA   LEU  19           HA       LEU  19  -9.067   4.474   1.706
  145   1HB   LEU  19          1HB       LEU  19  -9.142   6.940   1.310
  146   2HB   LEU  19          2HB       LEU  19  -8.644   6.639  -0.346
  147    HG   LEU  19           HG       LEU  19 -10.710   5.220  -0.606
  148   1HD1  LEU  19          1HD1      LEU  19 -11.029   4.901   1.850
  149   2HD1  LEU  19          2HD1      LEU  19 -12.477   5.375   0.964
  150   3HD1  LEU  19          3HD1      LEU  19 -11.606   6.567   1.928
  151   1HD2  LEU  19          1HD2      LEU  19 -10.453   8.092  -0.495
  152   2HD2  LEU  19          2HD2      LEU  19 -12.111   7.577  -0.173
  153   3HD2  LEU  19          3HD2      LEU  19 -11.305   7.074  -1.657
  154    H    PHE  20           H        PHE  20  -9.440   2.635   0.741
  155    HA   PHE  20           HA       PHE  20  -8.500   2.242  -2.028
  156   1HB   PHE  20          1HB       PHE  20  -7.265   0.865  -0.193
  157   2HB   PHE  20          2HB       PHE  20  -8.791   0.002  -0.064
  158    HD1  PHE  20           HD1      PHE  20  -6.947   1.216  -3.084
  159    HD2  PHE  20           HD2      PHE  20  -8.580  -2.037  -0.887
  160    HE1  PHE  20           HE1      PHE  20  -6.354  -0.330  -4.911
  161    HE2  PHE  20           HE2      PHE  20  -7.990  -3.587  -2.701
  162    HZ   PHE  20           HZ       PHE  20  -6.880  -2.729  -4.727
  163    H    ASN  21           H        ASN  21 -10.352   2.484  -3.123
  164    HA   ASN  21           HA       ASN  21 -12.452   2.176  -3.900
  165   1HB   ASN  21          1HB       ASN  21 -12.096  -0.530  -2.603
  166   2HB   ASN  21          2HB       ASN  21 -13.363  -0.120  -3.754
  167   1HD2  ASN  21          1HD2      ASN  21 -10.578  -1.682  -3.499
  168   2HD2  ASN  21          2HD2      ASN  21  -9.945  -1.485  -5.093
  169    H    GLY  22           H        GLY  22 -12.169   3.212  -1.068
  170   1HA   GLY  22          1HA       GLY  22 -14.113   4.206  -0.023
  171   2HA   GLY  22          2HA       GLY  22 -14.976   2.716  -0.347
  172    H    LYS  23           H        LYS  23 -11.941   1.891   0.755
  173    HA   LYS  23           HA       LYS  23 -12.877   1.875   3.551
  174   1HB   LYS  23          1HB       LYS  23 -13.112  -0.372   2.554
  175   2HB   LYS  23          2HB       LYS  23 -11.402  -0.363   2.142
  176   1HG   LYS  23          1HG       LYS  23 -10.839  -0.238   4.523
  177   2HG   LYS  23          2HG       LYS  23 -12.552  -0.282   4.925
  178   1HD   LYS  23          1HD       LYS  23 -11.272  -2.451   3.296
  179   2HD   LYS  23          2HD       LYS  23 -11.187  -2.458   5.059
  180   1HE   LYS  23          1HE       LYS  23 -13.066  -3.735   4.654
  181   2HE   LYS  23          2HE       LYS  23 -13.748  -2.136   4.946
  182   1HZ   LYS  23          1HZ       LYS  23 -14.166  -3.738   2.741
  183   2HZ   LYS  23          2HZ       LYS  23 -13.139  -2.506   2.180
  184   3HZ   LYS  23          3HZ       LYS  23 -14.627  -2.110   2.918
  185    H    GLU  24           H        GLU  24 -11.394   2.416   5.089
  186    HA   GLU  24           HA       GLU  24  -8.801   3.370   4.113
  187   1HB   GLU  24          1HB       GLU  24 -10.271   3.885   6.702
  188   2HB   GLU  24          2HB       GLU  24  -8.735   4.610   6.262
  189   1HG   GLU  24          1HG       GLU  24  -9.775   5.754   4.407
  190   2HG   GLU  24          2HG       GLU  24 -11.312   4.957   4.750
  191    H    TYR  25           H        TYR  25  -7.035   2.154   4.439
  192    HA   TYR  25           HA       TYR  25  -7.128   0.099   6.536
  193   1HB   TYR  25          1HB       TYR  25  -5.278   0.313   4.171
  194   2HB   TYR  25          2HB       TYR  25  -5.260  -0.986   5.351
  195    HD1  TYR  25           HD1      TYR  25  -7.463   0.663   2.859
  196    HD2  TYR  25           HD2      TYR  25  -6.491  -2.911   4.950
  197    HE1  TYR  25           HE1      TYR  25  -9.058  -0.584   1.446
  198    HE2  TYR  25           HE2      TYR  25  -8.084  -4.173   3.540
  199    HH   TYR  25           HH       TYR  25  -9.703  -4.020   1.999
  200    H    ASN  26           H        ASN  26  -5.674   0.000   8.143
  201    HA   ASN  26           HA       ASN  26  -3.653   2.148   8.268
  202   1HB   ASN  26          1HB       ASN  26  -5.264   0.773  10.404
  203   2HB   ASN  26          2HB       ASN  26  -3.743   1.564  10.796
  204   1HD2  ASN  26          1HD2      ASN  26  -7.028   1.942  10.368
  205   2HD2  ASN  26          2HD2      ASN  26  -7.095   3.671  10.396
  206    H    SER  27           H        SER  27  -3.712  -0.660   7.126
  207    HA   SER  27           HA       SER  27  -1.081  -1.449   8.010
  208   1HB   SER  27          1HB       SER  27  -1.913  -3.835   8.442
  209   2HB   SER  27          2HB       SER  27  -2.283  -2.640   9.683
  210    HG   SER  27           HG       SER  27  -4.010  -3.743   7.720
  211    H    CYS  28           H        CYS  28  -0.276  -3.310   6.675
  212    HA   CYS  28           HA       CYS  28  -0.837  -2.873   3.928
  213   1HB   CYS  28          1HB       CYS  28   0.594  -5.181   5.264
  214   2HB   CYS  28          2HB       CYS  28   0.536  -4.925   3.533
  215    H    THR  29           H        THR  29  -2.129  -3.971   2.502
  216    HA   THR  29           HA       THR  29  -3.658  -6.225   3.556
  217    HB   THR  29           HB       THR  29  -5.057  -4.200   3.552
  218    HG1  THR  29           HG1      THR  29  -6.345  -5.847   3.204
  219   1HG2  THR  29          1HG2      THR  29  -4.910  -4.145   0.548
  220   2HG2  THR  29          2HG2      THR  29  -3.947  -3.077   1.568
  221   3HG2  THR  29          3HG2      THR  29  -5.706  -3.008   1.632
  222    H    ASP  30           H        ASP  30  -4.448  -7.719   1.867
  223    HA   ASP  30           HA       ASP  30  -2.594  -7.717  -0.384
  224   1HB   ASP  30          1HB       ASP  30  -4.208 -10.074  -0.209
  225   2HB   ASP  30          2HB       ASP  30  -2.479  -9.945  -0.268
  226    H    THR  31           H        THR  31  -5.448  -6.545   0.264
  227    HA   THR  31           HA       THR  31  -7.261  -7.566  -1.610
  228    HB   THR  31           HB       THR  31  -7.079  -4.724  -0.608
  229    HG1  THR  31           HG1      THR  31  -7.150  -5.863   1.222
  230   1HG2  THR  31          1HG2      THR  31  -9.647  -6.154  -1.044
  231   2HG2  THR  31          2HG2      THR  31  -8.808  -5.445  -2.425
  232   3HG2  THR  31          3HG2      THR  31  -9.289  -4.424  -1.071
  233    H    GLY  32           H        GLY  32  -7.549  -7.251  -3.712
  234   1HA   GLY  32          1HA       GLY  32  -7.389  -6.185  -5.776
  235   2HA   GLY  32          2HA       GLY  32  -6.216  -5.075  -5.087
  236    H    ARG  33           H        ARG  33  -4.826  -7.448  -3.892
  237    HA   ARG  33           HA       ARG  33  -3.226  -8.129  -6.251
  238   1HB   ARG  33          1HB       ARG  33  -2.608  -8.375  -3.298
  239   2HB   ARG  33          2HB       ARG  33  -1.501  -8.776  -4.594
  240   1HG   ARG  33          1HG       ARG  33  -2.599  -6.041  -3.970
  241   2HG   ARG  33          2HG       ARG  33  -0.963  -6.616  -3.641
  242   1HD   ARG  33          1HD       ARG  33  -2.230  -6.300  -6.356
  243   2HD   ARG  33          2HD       ARG  33  -1.037  -5.211  -5.648
  244    HE   ARG  33           HE       ARG  33  -0.229  -7.998  -5.921
  245   1HH1  ARG  33          1HH1      ARG  33  -0.199  -4.774  -7.280
  246   2HH1  ARG  33          2HH1      ARG  33   1.132  -5.105  -8.353
  247   1HH2  ARG  33          1HH2      ARG  33   1.483  -8.443  -7.346
  248   2HH2  ARG  33          2HH2      ARG  33   2.115  -7.181  -8.357
  249    H    SER  34           H        SER  34  -3.769 -10.025  -7.158
  250    HA   SER  34           HA       SER  34  -5.091 -12.085  -5.624
  251   1HB   SER  34          1HB       SER  34  -4.092 -12.177  -8.485
  252   2HB   SER  34          2HB       SER  34  -5.210 -13.314  -7.730
  253    HG   SER  34           HG       SER  34  -5.855 -11.145  -9.010
  254    H    ASP  35           H        ASP  35  -1.984 -11.139  -5.835
  255    HA   ASP  35           HA       ASP  35  -0.793 -13.755  -5.851
  256   1HB   ASP  35          1HB       ASP  35   0.961 -11.570  -5.207
  257   2HB   ASP  35          2HB       ASP  35   1.114 -12.763  -6.463
  258    H    GLY  36           H        GLY  36  -2.195 -11.783  -3.661
  259   1HA   GLY  36          1HA       GLY  36  -2.356 -11.916  -1.363
  260   2HA   GLY  36          2HA       GLY  36  -1.281 -13.307  -1.432
  261    H    PHE  37           H        PHE  37  -0.231 -10.371  -2.909
  262    HA   PHE  37           HA       PHE  37   1.991 -10.212  -1.074
  263   1HB   PHE  37          1HB       PHE  37   1.199  -8.596  -3.492
  264   2HB   PHE  37          2HB       PHE  37   2.587  -8.178  -2.504
  265    HD1  PHE  37           HD1      PHE  37   3.231  -8.445  -5.142
  266    HD2  PHE  37           HD2      PHE  37   2.583 -11.590  -2.353
  267    HE1  PHE  37           HE1      PHE  37   4.637  -9.929  -6.505
  268    HE2  PHE  37           HE2      PHE  37   3.991 -13.084  -3.709
  269    HZ   PHE  37           HZ       PHE  37   5.017 -12.255  -5.790
  270    H    LEU  38           H        LEU  38   2.306  -8.779   0.525
  271    HA   LEU  38           HA       LEU  38   0.075  -7.188   1.419
  272   1HB   LEU  38          1HB       LEU  38   2.835  -7.669   2.466
  273   2HB   LEU  38          2HB       LEU  38   1.758  -6.521   3.221
  274    HG   LEU  38           HG       LEU  38   1.119  -9.455   2.894
  275   1HD1  LEU  38          1HD1      LEU  38   2.215  -9.929   4.779
  276   2HD1  LEU  38          2HD1      LEU  38   1.640  -8.467   5.582
  277   3HD1  LEU  38          3HD1      LEU  38   3.059  -8.399   4.536
  278   1HD2  LEU  38          1HD2      LEU  38  -0.394  -8.654   4.911
  279   2HD2  LEU  38          2HD2      LEU  38  -0.922  -8.498   3.235
  280   3HD2  LEU  38          3HD2      LEU  38  -0.253  -7.103   4.088
  281    H    TRP  39           H        TRP  39  -0.279  -5.118   0.785
  282    HA   TRP  39           HA       TRP  39   2.077  -3.474   0.180
  283   1HB   TRP  39          1HB       TRP  39   1.087  -2.563  -1.828
  284   2HB   TRP  39          2HB       TRP  39   1.147  -4.313  -1.968
  285    HD1  TRP  39           HD1      TRP  39  -1.259  -5.626  -1.735
  286    HE1  TRP  39           HE1      TRP  39  -3.633  -4.837  -2.297
  287    HE3  TRP  39           HE3      TRP  39  -0.454  -0.578  -1.847
  288    HZ2  TRP  39           HZ2      TRP  39  -4.985  -2.409  -2.737
  289    HZ3  TRP  39           HZ3      TRP  39  -2.350   0.902  -2.357
  290    HH2  TRP  39           HH2      TRP  39  -4.566  -0.002  -2.785
  291    H    CYS  40           H        CYS  40   1.422  -1.130  -0.126
  292    HA   CYS  40           HA       CYS  40  -0.929  -0.318   1.373
  293   1HB   CYS  40          1HB       CYS  40   0.288   1.034   2.966
  294   2HB   CYS  40          2HB       CYS  40   0.902  -0.615   3.073
  295    H    SER  41           H        SER  41  -1.404   1.958   1.044
  296    HA   SER  41           HA       SER  41  -0.323   2.881  -1.488
  297   1HB   SER  41          1HB       SER  41  -2.767   2.939  -1.107
  298   2HB   SER  41          2HB       SER  41  -2.520   4.069   0.223
  299    HG   SER  41           HG       SER  41  -2.495   5.602  -1.199
  300    H    THR  42           H        THR  42   0.305   5.137  -1.720
  301    HA   THR  42           HA       THR  42   1.848   6.046   0.609
  302    HB   THR  42           HB       THR  42   2.173   6.571  -2.351
  303    HG1  THR  42           HG1      THR  42   3.860   5.218  -0.514
  304   1HG2  THR  42          1HG2      THR  42   3.467   8.305  -1.944
  305   2HG2  THR  42          2HG2      THR  42   4.484   7.317  -0.896
  306   3HG2  THR  42          3HG2      THR  42   3.099   8.179  -0.226
  307    H    THR  43           H        THR  43  -0.682   6.837  -1.565
  308    HA   THR  43           HA       THR  43  -0.804   9.569  -0.511
  309    HB   THR  43           HB       THR  43  -2.315   9.980  -2.467
  310    HG1  THR  43           HG1      THR  43  -2.929   8.370  -3.662
  311   1HG2  THR  43          1HG2      THR  43   0.492   9.050  -2.868
  312   2HG2  THR  43          2HG2      THR  43  -0.182  10.678  -2.961
  313   3HG2  THR  43          3HG2      THR  43  -0.500   9.519  -4.249
  314    H    TYR  44           H        TYR  44  -3.190  10.374  -0.425
  315    HA   TYR  44           HA       TYR  44  -4.515   8.818   1.533
  316   1HB   TYR  44          1HB       TYR  44  -4.624  11.364   1.216
  317   2HB   TYR  44          2HB       TYR  44  -5.809  11.040  -0.050
  318    HD1  TYR  44           HD1      TYR  44  -5.191   9.841   3.457
  319    HD2  TYR  44           HD2      TYR  44  -8.002  11.348   0.639
  320    HE1  TYR  44           HE1      TYR  44  -6.949   9.749   5.169
  321    HE2  TYR  44           HE2      TYR  44  -9.767  11.261   2.348
  322    HH   TYR  44           HH       TYR  44  -9.390   9.625   5.308
  323    H    ASN  45           H        ASN  45  -5.264   9.513  -1.886
  324    HA   ASN  45           HA       ASN  45  -7.117   7.230  -1.808
  325   1HB   ASN  45          1HB       ASN  45  -8.067   9.509  -2.403
  326   2HB   ASN  45          2HB       ASN  45  -7.087   9.456  -3.847
  327   1HD2  ASN  45          1HD2      ASN  45  -7.771   6.397  -3.810
  328   2HD2  ASN  45          2HD2      ASN  45  -9.301   6.459  -4.539
  329    H    PHE  46           H        PHE  46  -6.189   5.468  -2.642
  330    HA   PHE  46           HA       PHE  46  -3.849   5.513  -4.239
  331   1HB   PHE  46          1HB       PHE  46  -4.304   3.683  -2.705
  332   2HB   PHE  46          2HB       PHE  46  -5.782   3.261  -3.608
  333    HD1  PHE  46           HD1      PHE  46  -2.093   3.741  -4.218
  334    HD2  PHE  46           HD2      PHE  46  -5.606   1.493  -5.093
  335    HE1  PHE  46           HE1      PHE  46  -0.785   2.250  -5.656
  336    HE2  PHE  46           HE2      PHE  46  -4.296  -0.008  -6.530
  337    HZ   PHE  46           HZ       PHE  46  -1.882   0.368  -6.816
  338    H    GLU  47           H        GLU  47  -7.238   5.262  -5.005
  339    HA   GLU  47           HA       GLU  47  -7.126   4.195  -7.565
  340   1HB   GLU  47          1HB       GLU  47  -9.141   4.641  -6.079
  341   2HB   GLU  47          2HB       GLU  47  -9.096   6.291  -6.682
  342   1HG   GLU  47          1HG       GLU  47  -9.549   5.576  -8.903
  343   2HG   GLU  47          2HG       GLU  47  -9.337   3.880  -8.461
  344    H    LYS  48           H        LYS  48  -7.208   7.640  -6.658
  345    HA   LYS  48           HA       LYS  48  -6.975   8.516  -9.350
  346   1HB   LYS  48          1HB       LYS  48  -6.706  10.774  -8.353
  347   2HB   LYS  48          2HB       LYS  48  -8.129   9.909  -7.790
  348   1HG   LYS  48          1HG       LYS  48  -6.995   9.352  -5.710
  349   2HG   LYS  48          2HG       LYS  48  -5.530  10.158  -6.282
  350   1HD   LYS  48          1HD       LYS  48  -6.780  11.600  -4.757
  351   2HD   LYS  48          2HD       LYS  48  -6.743  12.284  -6.384
  352   1HE   LYS  48          1HE       LYS  48  -8.997  11.481  -6.803
  353   2HE   LYS  48          2HE       LYS  48  -9.036  10.700  -5.222
  354   1HZ   LYS  48          1HZ       LYS  48 -10.153  12.967  -5.480
  355   2HZ   LYS  48          2HZ       LYS  48  -8.579  13.612  -5.477
  356   3HZ   LYS  48          3HZ       LYS  48  -9.141  12.737  -4.133
  357    H    ASP  49           H        ASP  49  -4.590   8.047  -6.781
  358    HA   ASP  49           HA       ASP  49  -2.573   9.307  -8.462
  359   1HB   ASP  49          1HB       ASP  49  -2.548   8.431  -5.582
  360   2HB   ASP  49          2HB       ASP  49  -1.102   8.997  -6.421
  361    H    GLY  50           H        GLY  50  -2.673   6.279  -6.551
  362   1HA   GLY  50          1HA       GLY  50  -2.222   4.163  -7.483
  363   2HA   GLY  50          2HA       GLY  50  -1.478   4.962  -8.849
  364    H    LYS  51           H        LYS  51  -0.362   6.230  -5.900
  365    HA   LYS  51           HA       LYS  51   2.192   4.928  -6.321
  366   1HB   LYS  51          1HB       LYS  51   1.279   7.081  -4.427
  367   2HB   LYS  51          2HB       LYS  51   2.856   6.339  -4.281
  368   1HG   LYS  51          1HG       LYS  51   3.383   8.159  -5.517
  369   2HG   LYS  51          2HG       LYS  51   3.035   7.015  -6.813
  370   1HD   LYS  51          1HD       LYS  51   0.762   7.939  -7.004
  371   2HD   LYS  51          2HD       LYS  51   1.133   9.091  -5.713
  372   1HE   LYS  51          1HE       LYS  51   3.098   9.814  -7.198
  373   2HE   LYS  51          2HE       LYS  51   2.271   8.947  -8.490
  374   1HZ   LYS  51          1HZ       LYS  51   1.822  11.414  -8.279
  375   2HZ   LYS  51          2HZ       LYS  51   0.919  11.046  -6.891
  376   3HZ   LYS  51          3HZ       LYS  51   0.455  10.411  -8.399
  377    H    TYR  52           H        TYR  52   2.666   3.037  -5.466
  378    HA   TYR  52           HA       TYR  52   1.740   2.376  -2.775
  379   1HB   TYR  52          1HB       TYR  52   0.821   0.253  -3.451
  380   2HB   TYR  52          2HB       TYR  52   0.068   1.501  -4.444
  381    HD1  TYR  52           HD1      TYR  52   2.213  -1.441  -4.432
  382    HD2  TYR  52           HD2      TYR  52   0.751   1.768  -6.818
  383    HE1  TYR  52           HE1      TYR  52   2.978  -2.606  -6.458
  384    HE2  TYR  52           HE2      TYR  52   1.505   0.613  -8.845
  385    HH   TYR  52           HH       TYR  52   3.614  -2.033  -8.795
  386    H    GLY  53           H        GLY  53   2.702   0.333  -2.019
  387   1HA   GLY  53          1HA       GLY  53   5.033  -0.685  -3.330
  388   2HA   GLY  53          2HA       GLY  53   5.404   0.294  -1.921
  389    H    PHE  54           H        PHE  54   5.975  -2.473  -2.179
  390    HA   PHE  54           HA       PHE  54   3.972  -3.812  -0.540
  391   1HB   PHE  54          1HB       PHE  54   6.487  -4.867  -1.821
  392   2HB   PHE  54          2HB       PHE  54   5.301  -5.844  -0.963
  393    HD1  PHE  54           HD1      PHE  54   2.816  -5.502  -1.846
  394    HD2  PHE  54           HD2      PHE  54   6.347  -4.808  -4.114
  395    HE1  PHE  54           HE1      PHE  54   1.519  -5.756  -3.921
  396    HE2  PHE  54           HE2      PHE  54   5.061  -5.064  -6.198
  397    HZ   PHE  54           HZ       PHE  54   2.653  -5.534  -6.109
  398    H    CYS  55           H        CYS  55   4.393  -4.673   1.509
  399    HA   CYS  55           HA       CYS  55   6.775  -3.526   2.806
  400   1HB   CYS  55          1HB       CYS  55   5.520  -3.851   4.951
  401   2HB   CYS  55          2HB       CYS  55   4.720  -2.749   3.833
  402    HA   PRO  56           HA       PRO  56   8.220  -7.740   2.927
  403   1HB   PRO  56          1HB       PRO  56  10.514  -7.260   4.260
  404   2HB   PRO  56          2HB       PRO  56  10.299  -6.889   2.549
  405   1HG   PRO  56          1HG       PRO  56  10.200  -5.063   4.910
  406   2HG   PRO  56          2HG       PRO  56  10.889  -4.781   3.303
  407   1HD   PRO  56          1HD       PRO  56   8.453  -3.829   4.102
  408   2HD   PRO  56          2HD       PRO  56   8.869  -4.171   2.411
  409    H    HIS  57           H        HIS  57   6.265  -7.853   4.524
  410    HA   HIS  57           HA       HIS  57   7.255  -8.304   7.259
  411   1HB   HIS  57          1HB       HIS  57   5.297  -6.755   6.939
  412   2HB   HIS  57          2HB       HIS  57   4.380  -8.125   6.324
  413    HD1  HIS  57           HD1      HIS  57   6.496  -7.568   9.453
  414    HD2  HIS  57           HD2      HIS  57   2.793  -9.072   8.285
  415    HE1  HIS  57           HE1      HIS  57   5.356  -8.308  11.579
  416    H    GLU  58           H        GLU  58   5.143  -9.720   4.793
  417    HA   GLU  58           HA       GLU  58   4.880 -12.243   6.039
  418   1HB   GLU  58          1HB       GLU  58   4.045 -13.021   3.829
  419   2HB   GLU  58          2HB       GLU  58   3.247 -11.563   4.400
  420   1HG   GLU  58          1HG       GLU  58   4.523 -10.211   2.864
  421   2HG   GLU  58          2HG       GLU  58   5.484 -11.606   2.376
  422    H    ALA  59           H        ALA  59   7.103 -10.991   3.610
  423    HA   ALA  59           HA       ALA  59   9.006 -13.075   4.236
  424   1HB   ALA  59          1HB       ALA  59   8.197 -12.807   1.352
  425   2HB   ALA  59          2HB       ALA  59   7.464 -13.998   2.422
  426   3HB   ALA  59          3HB       ALA  59   9.196 -14.050   2.108
  Start of MODEL   40
    1   1H    ARG   1          1H        ARG   1  10.943   7.049   7.511
    2   2H    ARG   1          2H        ARG   1  12.278   6.020   7.179
    3   3H    ARG   1          3H        ARG   1  12.018   6.610   8.771
    4    HA   ARG   1           HA       ARG   1  10.878   4.860   9.216
    5   1HB   ARG   1          1HB       ARG   1   9.203   6.109   7.123
    6   2HB   ARG   1          2HB       ARG   1   8.708   4.564   7.776
    7   1HG   ARG   1          1HG       ARG   1   9.281   6.916   9.549
    8   2HG   ARG   1          2HG       ARG   1   7.703   6.700   8.787
    9   1HD   ARG   1          1HD       ARG   1   9.076   4.685  10.564
   10   2HD   ARG   1          2HD       ARG   1   7.791   5.780  11.069
   11    HE   ARG   1           HE       ARG   1   6.749   4.392   8.920
   12   1HH1  ARG   1          1HH1      ARG   1   8.079   3.593  12.049
   13   2HH1  ARG   1          2HH1      ARG   1   7.083   2.185  12.254
   14   1HH2  ARG   1          1HH2      ARG   1   5.444   2.531   9.185
   15   2HH2  ARG   1          2HH2      ARG   1   5.626   1.559  10.617
   16    H    ILE   2           H        ILE   2  10.981   5.089   5.691
   17    HA   ILE   2           HA       ILE   2  11.127   3.532   4.034
   18    HB   ILE   2           HB       ILE   2  13.491   3.861   4.584
   19   1HG1  ILE   2          1HG1      ILE   2  12.799   1.021   3.819
   20   2HG1  ILE   2          2HG1      ILE   2  12.942   2.400   2.732
   21   1HG2  ILE   2          1HG2      ILE   2  12.896   2.251   6.839
   22   2HG2  ILE   2          2HG2      ILE   2  14.389   3.119   6.457
   23   3HG2  ILE   2          3HG2      ILE   2  14.169   1.458   5.905
   24   1HD1  ILE   2          1HD1      ILE   2  15.095   1.974   2.465
   25   2HD1  ILE   2          2HD1      ILE   2  14.954   0.588   3.547
   26   3HD1  ILE   2          3HD1      ILE   2  15.361   2.176   4.197
   27    HA   PRO   3           HA       PRO   3   9.107  -0.086   6.137
   28   1HB   PRO   3          1HB       PRO   3   6.491   0.947   6.054
   29   2HB   PRO   3          2HB       PRO   3   7.537   0.865   7.474
   30   1HG   PRO   3          1HG       PRO   3   6.650   3.219   6.261
   31   2HG   PRO   3          2HG       PRO   3   8.028   3.082   7.370
   32   1HD   PRO   3          1HD       PRO   3   8.028   3.100   4.352
   33   2HD   PRO   3          2HD       PRO   3   9.123   3.940   5.482
   34    H    VAL   4           H        VAL   4   9.364   1.174   3.275
   35    HA   VAL   4           HA       VAL   4   7.371  -0.594   1.982
   36    HB   VAL   4           HB       VAL   4   8.513   2.012   0.865
   37   1HG1  VAL   4          1HG1      VAL   4   7.928   0.270  -0.802
   38   2HG1  VAL   4          2HG1      VAL   4   6.973   1.746  -0.942
   39   3HG1  VAL   4          3HG1      VAL   4   6.272   0.304  -0.204
   40   1HG2  VAL   4          1HG2      VAL   4   6.976   3.055   2.111
   41   2HG2  VAL   4          2HG2      VAL   4   6.199   1.543   2.582
   42   3HG2  VAL   4          3HG2      VAL   4   5.768   2.318   1.057
   43    H    LYS   5           H        LYS   5   8.137  -1.996   0.475
   44    HA   LYS   5           HA       LYS   5  11.009  -2.294   0.276
   45   1HB   LYS   5          1HB       LYS   5   8.700  -3.980  -0.085
   46   2HB   LYS   5          2HB       LYS   5   9.730  -4.071  -1.510
   47   1HG   LYS   5          1HG       LYS   5  10.613  -4.563   1.334
   48   2HG   LYS   5          2HG       LYS   5  10.273  -5.807   0.124
   49   1HD   LYS   5          1HD       LYS   5  12.109  -5.075  -1.236
   50   2HD   LYS   5          2HD       LYS   5  12.376  -3.666  -0.205
   51   1HE   LYS   5          1HE       LYS   5  12.716  -6.558   0.609
   52   2HE   LYS   5          2HE       LYS   5  14.020  -5.426   0.241
   53   1HZ   LYS   5          1HZ       LYS   5  12.725  -4.062   2.115
   54   2HZ   LYS   5          2HZ       LYS   5  13.972  -5.167   2.472
   55   3HZ   LYS   5          3HZ       LYS   5  12.344  -5.645   2.613
   56    H    TYR   6           H        TYR   6   8.823  -2.778  -2.456
   57    HA   TYR   6           HA       TYR   6  10.044  -0.511  -3.791
   58   1HB   TYR   6          1HB       TYR   6  10.056  -2.179  -5.914
   59   2HB   TYR   6          2HB       TYR   6  11.455  -1.811  -4.922
   60    HD1  TYR   6           HD1      TYR   6  12.741  -3.717  -5.124
   61    HD2  TYR   6           HD2      TYR   6   8.635  -4.145  -4.090
   62    HE1  TYR   6           HE1      TYR   6  13.100  -6.105  -4.739
   63    HE2  TYR   6           HE2      TYR   6   8.989  -6.535  -3.687
   64    HH   TYR   6           HH       TYR   6  11.392  -8.263  -4.797
   65    H    GLY   7           H        GLY   7   9.029  -0.911  -6.320
   66   1HA   GLY   7          1HA       GLY   7   6.746  -1.365  -7.241
   67   2HA   GLY   7          2HA       GLY   7   6.148  -0.517  -5.826
   68    H    ASN   8           H        ASN   8   5.261   1.241  -6.863
   69    HA   ASN   8           HA       ASN   8   7.137   2.832  -8.486
   70   1HB   ASN   8          1HB       ASN   8   5.334   3.702  -9.721
   71   2HB   ASN   8          2HB       ASN   8   4.968   1.990  -9.535
   72   1HD2  ASN   8          1HD2      ASN   8   3.218   4.358  -9.998
   73   2HD2  ASN   8          2HD2      ASN   8   2.073   4.303  -8.697
   74    H    ALA   9           H        ALA   9   6.165   2.689  -5.446
   75    HA   ALA   9           HA       ALA   9   5.182   5.213  -4.719
   76   1HB   ALA   9          1HB       ALA   9   6.963   3.464  -3.067
   77   2HB   ALA   9          2HB       ALA   9   5.232   3.200  -3.287
   78   3HB   ALA   9          3HB       ALA   9   5.811   4.672  -2.503
   79    H    ASP  10           H        ASP  10   6.243   7.027  -3.813
   80    HA   ASP  10           HA       ASP  10   8.719   7.663  -5.146
   81   1HB   ASP  10          1HB       ASP  10   6.892   9.271  -3.354
   82   2HB   ASP  10          2HB       ASP  10   8.353   9.919  -4.096
   83    H    GLY  11           H        GLY  11   8.703   5.694  -2.876
   84   1HA   GLY  11          1HA       GLY  11  10.331   5.083  -1.359
   85   2HA   GLY  11          2HA       GLY  11  11.144   6.602  -1.684
   86    H    GLU  12           H        GLU  12   7.832   6.738  -0.711
   87    HA   GLU  12           HA       GLU  12   8.659   8.001   1.772
   88   1HB   GLU  12          1HB       GLU  12   5.917   7.742   0.531
   89   2HB   GLU  12          2HB       GLU  12   6.317   8.712   1.938
   90   1HG   GLU  12          1HG       GLU  12   7.607   9.153  -0.734
   91   2HG   GLU  12          2HG       GLU  12   6.089   9.923  -0.274
   92    H    TYR  13           H        TYR  13   6.537   7.551   3.424
   93    HA   TYR  13           HA       TYR  13   6.952   4.790   4.222
   94   1HB   TYR  13          1HB       TYR  13   6.340   5.484   6.380
   95   2HB   TYR  13          2HB       TYR  13   7.378   6.749   5.743
   96    HD1  TYR  13           HD1      TYR  13   6.047   8.656   4.475
   97    HD2  TYR  13           HD2      TYR  13   4.439   6.098   7.459
   98    HE1  TYR  13           HE1      TYR  13   4.292  10.325   4.943
   99    HE2  TYR  13           HE2      TYR  13   2.679   7.755   7.949
  100    HH   TYR  13           HH       TYR  13   2.183  10.039   7.691
  101    H    CYS  14           H        CYS  14   5.077   3.597   5.165
  102    HA   CYS  14           HA       CYS  14   2.866   3.623   3.366
  103   1HB   CYS  14          1HB       CYS  14   3.560   2.029   5.810
  104   2HB   CYS  14          2HB       CYS  14   1.916   1.989   5.192
  105    H    LYS  15           H        LYS  15   1.221   4.978   3.470
  106    HA   LYS  15           HA       LYS  15   0.782   6.606   5.813
  107   1HB   LYS  15          1HB       LYS  15   0.656   7.464   3.455
  108   2HB   LYS  15          2HB       LYS  15  -0.825   6.536   3.258
  109   1HG   LYS  15          1HG       LYS  15  -1.959   7.855   4.894
  110   2HG   LYS  15          2HG       LYS  15  -0.461   8.672   5.356
  111   1HD   LYS  15          1HD       LYS  15  -1.764   8.825   2.636
  112   2HD   LYS  15          2HD       LYS  15  -1.912  10.049   3.900
  113   1HE   LYS  15          1HE       LYS  15   0.545  10.341   3.857
  114   2HE   LYS  15          2HE       LYS  15   0.638   9.182   2.531
  115   1HZ   LYS  15          1HZ       LYS  15   0.675  11.302   1.543
  116   2HZ   LYS  15          2HZ       LYS  15  -0.591  11.883   2.519
  117   3HZ   LYS  15          3HZ       LYS  15  -0.908  10.747   1.305
  118    H    PHE  16           H        PHE  16  -0.307   5.806   7.462
  119    HA   PHE  16           HA       PHE  16  -2.649   4.100   6.910
  120   1HB   PHE  16          1HB       PHE  16  -0.847   4.145   9.339
  121   2HB   PHE  16          2HB       PHE  16  -2.295   3.158   9.182
  122    HD1  PHE  16           HD1      PHE  16   0.383   2.058   9.802
  123    HD2  PHE  16           HD2      PHE  16  -1.542   2.755   6.077
  124    HE1  PHE  16           HE1      PHE  16   1.717   0.272   8.789
  125    HE2  PHE  16           HE2      PHE  16  -0.212   0.979   5.052
  126    HZ   PHE  16           HZ       PHE  16   1.441  -0.286   6.391
  127    HA   PRO  17           HA       PRO  17  -4.359   3.658   7.209
  128   1HB   PRO  17          1HB       PRO  17  -6.986   4.451   6.876
  129   2HB   PRO  17          2HB       PRO  17  -6.380   3.499   8.232
  130   1HG   PRO  17          1HG       PRO  17  -7.361   6.208   8.260
  131   2HG   PRO  17          2HG       PRO  17  -6.824   5.219   9.627
  132   1HD   PRO  17          1HD       PRO  17  -5.396   7.338   8.189
  133   2HD   PRO  17          2HD       PRO  17  -5.053   6.619   9.776
  134    H    PHE  18           H        PHE  18  -4.735   3.306   4.993
  135    HA   PHE  18           HA       PHE  18  -4.724   5.764   3.392
  136   1HB   PHE  18          1HB       PHE  18  -3.667   4.556   1.594
  137   2HB   PHE  18          2HB       PHE  18  -2.735   4.352   3.067
  138    HD1  PHE  18           HD1      PHE  18  -2.978   2.161   4.328
  139    HD2  PHE  18           HD2      PHE  18  -4.389   2.742   0.360
  140    HE1  PHE  18           HE1      PHE  18  -2.965  -0.271   3.974
  141    HE2  PHE  18           HE2      PHE  18  -4.395   0.317  -0.010
  142    HZ   PHE  18           HZ       PHE  18  -3.672  -1.215   1.790
  143    H    LEU  19           H        LEU  19  -5.986   5.902   1.500
  144    HA   LEU  19           HA       LEU  19  -8.531   4.541   1.807
  145   1HB   LEU  19          1HB       LEU  19  -8.343   7.001   1.507
  146   2HB   LEU  19          2HB       LEU  19  -7.766   6.718  -0.124
  147    HG   LEU  19           HG       LEU  19  -9.927   5.551  -0.603
  148   1HD1  LEU  19          1HD1      LEU  19 -10.438   6.415   2.207
  149   2HD1  LEU  19          2HD1      LEU  19 -10.832   4.893   1.407
  150   3HD1  LEU  19          3HD1      LEU  19 -11.773   6.345   1.056
  151   1HD2  LEU  19          1HD2      LEU  19 -10.892   8.167   0.178
  152   2HD2  LEU  19          2HD2      LEU  19 -10.635   7.493  -1.432
  153   3HD2  LEU  19          3HD2      LEU  19  -9.293   8.242  -0.567
  154    H    PHE  20           H        PHE  20  -9.024   2.792   0.786
  155    HA   PHE  20           HA       PHE  20  -8.112   2.370  -1.988
  156   1HB   PHE  20          1HB       PHE  20  -6.928   0.854  -0.230
  157   2HB   PHE  20          2HB       PHE  20  -8.522   0.158  -0.017
  158    HD1  PHE  20           HD1      PHE  20  -6.968   1.194  -3.223
  159    HD2  PHE  20           HD2      PHE  20  -8.340  -1.966  -0.727
  160    HE1  PHE  20           HE1      PHE  20  -6.642  -0.417  -5.061
  161    HE2  PHE  20           HE2      PHE  20  -8.017  -3.576  -2.555
  162    HZ   PHE  20           HZ       PHE  20  -7.171  -2.795  -4.736
  163    H    ASN  21           H        ASN  21  -9.979   2.552  -3.158
  164    HA   ASN  21           HA       ASN  21 -12.151   2.308  -3.818
  165   1HB   ASN  21          1HB       ASN  21 -11.682  -0.248  -2.307
  166   2HB   ASN  21          2HB       ASN  21 -13.255   0.102  -3.012
  167   1HD2  ASN  21          1HD2      ASN  21 -10.343  -1.347  -3.547
  168   2HD2  ASN  21          2HD2      ASN  21 -10.370  -1.398  -5.273
  169    H    GLY  22           H        GLY  22 -11.669   3.787  -1.303
  170   1HA   GLY  22          1HA       GLY  22 -13.218   5.005  -0.034
  171   2HA   GLY  22          2HA       GLY  22 -14.441   3.802  -0.410
  172    H    LYS  23           H        LYS  23 -11.648   2.250   0.595
  173    HA   LYS  23           HA       LYS  23 -12.668   2.106   3.359
  174   1HB   LYS  23          1HB       LYS  23 -12.974   0.012   2.071
  175   2HB   LYS  23          2HB       LYS  23 -11.247  -0.045   1.769
  176   1HG   LYS  23          1HG       LYS  23 -10.838  -0.271   4.174
  177   2HG   LYS  23          2HG       LYS  23 -12.580  -0.237   4.465
  178   1HD   LYS  23          1HD       LYS  23 -12.883  -2.285   3.240
  179   2HD   LYS  23          2HD       LYS  23 -11.198  -2.274   2.716
  180   1HE   LYS  23          1HE       LYS  23 -11.538  -3.856   4.536
  181   2HE   LYS  23          2HE       LYS  23 -10.472  -2.541   5.030
  182   1HZ   LYS  23          1HZ       LYS  23 -13.377  -2.444   5.580
  183   2HZ   LYS  23          2HZ       LYS  23 -12.121  -1.597   6.354
  184   3HZ   LYS  23          3HZ       LYS  23 -12.313  -3.262   6.621
  185    H    GLU  24           H        GLU  24 -11.217   2.430   5.001
  186    HA   GLU  24           HA       GLU  24  -8.513   3.232   4.180
  187   1HB   GLU  24          1HB       GLU  24  -9.976   3.733   6.780
  188   2HB   GLU  24          2HB       GLU  24  -8.407   4.393   6.338
  189   1HG   GLU  24          1HG       GLU  24  -9.463   5.577   4.464
  190   2HG   GLU  24          2HG       GLU  24 -11.027   4.946   4.971
  191    H    TYR  25           H        TYR  25  -6.772   2.063   4.681
  192    HA   TYR  25           HA       TYR  25  -7.096  -0.165   6.591
  193   1HB   TYR  25          1HB       TYR  25  -5.178   0.065   4.282
  194   2HB   TYR  25          2HB       TYR  25  -5.252  -1.291   5.386
  195    HD1  TYR  25           HD1      TYR  25  -7.277   0.589   2.918
  196    HD2  TYR  25           HD2      TYR  25  -6.606  -3.116   4.888
  197    HE1  TYR  25           HE1      TYR  25  -8.901  -0.489   1.409
  198    HE2  TYR  25           HE2      TYR  25  -8.229  -4.216   3.382
  199    HH   TYR  25           HH       TYR  25  -9.695  -3.943   1.725
  200    H    ASN  26           H        ASN  26  -5.751  -0.308   8.311
  201    HA   ASN  26           HA       ASN  26  -3.730   1.795   8.590
  202   1HB   ASN  26          1HB       ASN  26  -5.212   0.099  10.577
  203   2HB   ASN  26          2HB       ASN  26  -3.727   0.933  11.033
  204   1HD2  ASN  26          1HD2      ASN  26  -7.027   1.172  10.829
  205   2HD2  ASN  26          2HD2      ASN  26  -7.186   2.891  10.938
  206    H    SER  27           H        SER  27  -3.517  -0.815   7.088
  207    HA   SER  27           HA       SER  27  -0.814  -1.377   7.752
  208   1HB   SER  27          1HB       SER  27  -1.135  -3.794   8.297
  209   2HB   SER  27          2HB       SER  27  -1.793  -2.717   9.536
  210    HG   SER  27           HG       SER  27  -3.869  -3.017   8.478
  211    H    CYS  28           H        CYS  28  -0.049  -3.335   6.356
  212    HA   CYS  28           HA       CYS  28  -0.926  -2.811   3.678
  213   1HB   CYS  28          1HB       CYS  28   1.095  -4.739   4.833
  214   2HB   CYS  28          2HB       CYS  28   0.657  -4.778   3.128
  215    H    THR  29           H        THR  29  -2.295  -3.907   2.406
  216    HA   THR  29           HA       THR  29  -3.499  -6.342   3.502
  217    HB   THR  29           HB       THR  29  -5.044  -4.436   3.566
  218    HG1  THR  29           HG1      THR  29  -6.260  -6.148   3.220
  219   1HG2  THR  29          1HG2      THR  29  -3.946  -3.678   1.118
  220   2HG2  THR  29          2HG2      THR  29  -5.319  -2.945   1.949
  221   3HG2  THR  29          3HG2      THR  29  -5.590  -4.201   0.743
  222    H    ASP  30           H        ASP  30  -4.365  -7.857   1.840
  223    HA   ASP  30           HA       ASP  30  -2.657  -7.795  -0.532
  224   1HB   ASP  30          1HB       ASP  30  -4.182 -10.216  -0.190
  225   2HB   ASP  30          2HB       ASP  30  -2.484 -10.020  -0.487
  226    H    THR  31           H        THR  31  -5.392  -6.528   0.172
  227    HA   THR  31           HA       THR  31  -7.315  -7.635  -1.573
  228    HB   THR  31           HB       THR  31  -7.072  -4.766  -0.658
  229    HG1  THR  31           HG1      THR  31  -7.048  -6.073   1.152
  230   1HG2  THR  31          1HG2      THR  31  -8.791  -5.106  -2.367
  231   2HG2  THR  31          2HG2      THR  31  -9.465  -4.640  -0.802
  232   3HG2  THR  31          3HG2      THR  31  -9.551  -6.323  -1.342
  233    H    GLY  32           H        GLY  32  -7.782  -7.209  -3.702
  234   1HA   GLY  32          1HA       GLY  32  -7.602  -6.178  -5.776
  235   2HA   GLY  32          2HA       GLY  32  -6.383  -5.107  -5.102
  236    H    ARG  33           H        ARG  33  -5.088  -7.668  -4.011
  237    HA   ARG  33           HA       ARG  33  -3.416  -8.147  -6.352
  238   1HB   ARG  33          1HB       ARG  33  -3.085  -9.139  -3.508
  239   2HB   ARG  33          2HB       ARG  33  -1.882  -9.202  -4.783
  240   1HG   ARG  33          1HG       ARG  33  -2.999  -6.683  -3.579
  241   2HG   ARG  33          2HG       ARG  33  -1.459  -7.423  -3.142
  242   1HD   ARG  33          1HD       ARG  33  -2.219  -6.346  -5.862
  243   2HD   ARG  33          2HD       ARG  33  -1.145  -5.565  -4.701
  244    HE   ARG  33           HE       ARG  33  -0.272  -8.206  -5.422
  245   1HH1  ARG  33          1HH1      ARG  33  -0.267  -4.843  -6.362
  246   2HH1  ARG  33          2HH1      ARG  33   1.137  -4.997  -7.378
  247   1HH2  ARG  33          1HH2      ARG  33   1.541  -8.425  -6.785
  248   2HH2  ARG  33          2HH2      ARG  33   2.180  -7.030  -7.595
  249    H    SER  34           H        SER  34  -2.843 -10.367  -6.951
  250    HA   SER  34           HA       SER  34  -5.087 -12.205  -6.434
  251   1HB   SER  34          1HB       SER  34  -3.191 -12.160  -8.795
  252   2HB   SER  34          2HB       SER  34  -4.599 -13.210  -8.603
  253    HG   SER  34           HG       SER  34  -5.858 -11.206  -8.486
  254    H    ASP  35           H        ASP  35  -1.791 -11.745  -5.792
  255    HA   ASP  35           HA       ASP  35  -1.375 -14.590  -5.424
  256   1HB   ASP  35          1HB       ASP  35   0.550 -12.360  -5.717
  257   2HB   ASP  35          2HB       ASP  35   1.035 -13.978  -5.304
  258    H    GLY  36           H        GLY  36  -2.625 -12.432  -3.596
  259   1HA   GLY  36          1HA       GLY  36  -2.803 -12.122  -1.335
  260   2HA   GLY  36          2HA       GLY  36  -1.929 -13.634  -1.169
  261    H    PHE  37           H        PHE  37  -0.915 -10.461  -2.460
  262    HA   PHE  37           HA       PHE  37   1.235 -10.511  -0.458
  263   1HB   PHE  37          1HB       PHE  37   1.197  -9.458  -3.268
  264   2HB   PHE  37          2HB       PHE  37   2.364  -8.855  -2.093
  265    HD1  PHE  37           HD1      PHE  37   3.344 -10.998  -0.628
  266    HD2  PHE  37           HD2      PHE  37   2.106 -11.018  -4.704
  267    HE1  PHE  37           HE1      PHE  37   4.790 -12.945  -1.057
  268    HE2  PHE  37           HE2      PHE  37   3.542 -12.963  -5.130
  269    HZ   PHE  37           HZ       PHE  37   4.885 -13.929  -3.313
  270    H    LEU  38           H        LEU  38   1.335  -8.967   0.993
  271    HA   LEU  38           HA       LEU  38  -0.767  -7.034   1.115
  272   1HB   LEU  38          1HB       LEU  38   0.812  -6.410   3.198
  273   2HB   LEU  38          2HB       LEU  38  -0.390  -7.681   3.232
  274    HG   LEU  38           HG       LEU  38   1.552  -9.230   2.491
  275   1HD1  LEU  38          1HD1      LEU  38   3.733  -8.573   2.830
  276   2HD1  LEU  38          2HD1      LEU  38   3.275  -7.211   3.860
  277   3HD1  LEU  38          3HD1      LEU  38   3.024  -7.129   2.112
  278   1HD2  LEU  38          1HD2      LEU  38   0.393  -8.786   4.845
  279   2HD2  LEU  38          2HD2      LEU  38   2.030  -8.262   5.245
  280   3HD2  LEU  38          3HD2      LEU  38   1.749  -9.896   4.646
  281    H    TRP  39           H        TRP  39  -0.734  -4.927   0.741
  282    HA   TRP  39           HA       TRP  39   1.804  -3.543   0.273
  283   1HB   TRP  39          1HB       TRP  39   0.952  -2.558  -1.815
  284   2HB   TRP  39          2HB       TRP  39   1.006  -4.312  -1.934
  285    HD1  TRP  39           HD1      TRP  39  -1.388  -5.620  -1.812
  286    HE1  TRP  39           HE1      TRP  39  -3.747  -4.839  -2.443
  287    HE3  TRP  39           HE3      TRP  39  -0.615  -0.565  -1.889
  288    HZ2  TRP  39           HZ2      TRP  39  -5.095  -2.425  -2.933
  289    HZ3  TRP  39           HZ3      TRP  39  -2.501   0.904  -2.454
  290    HH2  TRP  39           HH2      TRP  39  -4.698  -0.019  -2.960
  291    H    CYS  40           H        CYS  40   1.317  -1.131  -0.121
  292    HA   CYS  40           HA       CYS  40  -1.063  -0.143   1.265
  293   1HB   CYS  40          1HB       CYS  40   0.092   1.038   2.945
  294   2HB   CYS  40          2HB       CYS  40   0.925  -0.511   2.910
  295    H    SER  41           H        SER  41  -1.386   2.196   0.814
  296    HA   SER  41           HA       SER  41   0.006   2.931  -1.649
  297   1HB   SER  41          1HB       SER  41  -1.719   4.579  -2.024
  298   2HB   SER  41          2HB       SER  41  -2.503   3.056  -1.605
  299    HG   SER  41           HG       SER  41  -2.423   5.458  -0.228
  300    H    THR  42           H        THR  42   0.910   5.077  -1.855
  301    HA   THR  42           HA       THR  42   2.036   5.962   0.701
  302    HB   THR  42           HB       THR  42   3.092   7.116  -1.794
  303    HG1  THR  42           HG1      THR  42   3.070   4.323  -1.345
  304   1HG2  THR  42          1HG2      THR  42   5.226   6.158  -0.832
  305   2HG2  THR  42          2HG2      THR  42   4.270   5.740   0.593
  306   3HG2  THR  42          3HG2      THR  42   4.427   7.427   0.095
  307    H    THR  43           H        THR  43  -0.111   6.868  -1.778
  308    HA   THR  43           HA       THR  43  -0.061   9.678  -0.984
  309    HB   THR  43           HB       THR  43  -1.546   9.825  -3.105
  310    HG1  THR  43           HG1      THR  43  -1.716   8.078  -4.261
  311   1HG2  THR  43          1HG2      THR  43   0.271  10.273  -4.397
  312   2HG2  THR  43          2HG2      THR  43   1.182   8.887  -3.802
  313   3HG2  THR  43          3HG2      THR  43   1.011  10.326  -2.800
  314    H    TYR  44           H        TYR  44  -2.518  10.468  -1.792
  315    HA   TYR  44           HA       TYR  44  -4.124   9.965   0.453
  316   1HB   TYR  44          1HB       TYR  44  -4.114  12.067  -0.880
  317   2HB   TYR  44          2HB       TYR  44  -4.906  11.209  -2.198
  318    HD1  TYR  44           HD1      TYR  44  -7.250  10.154  -1.611
  319    HD2  TYR  44           HD2      TYR  44  -5.366  13.181   0.714
  320    HE1  TYR  44           HE1      TYR  44  -9.429  10.768  -0.655
  321    HE2  TYR  44           HE2      TYR  44  -7.540  13.800   1.672
  322    HH   TYR  44           HH       TYR  44  -9.723  13.442   1.676
  323    H    ASN  45           H        ASN  45  -5.001   9.317  -2.939
  324    HA   ASN  45           HA       ASN  45  -6.447   6.944  -1.971
  325   1HB   ASN  45          1HB       ASN  45  -7.900   8.887  -2.725
  326   2HB   ASN  45          2HB       ASN  45  -7.246   8.661  -4.328
  327   1HD2  ASN  45          1HD2      ASN  45  -7.364   5.620  -3.629
  328   2HD2  ASN  45          2HD2      ASN  45  -9.000   5.329  -3.971
  329    H    PHE  46           H        PHE  46  -5.818   5.071  -2.896
  330    HA   PHE  46           HA       PHE  46  -3.637   4.904  -4.632
  331   1HB   PHE  46          1HB       PHE  46  -4.305   3.073  -3.138
  332   2HB   PHE  46          2HB       PHE  46  -5.783   2.826  -4.100
  333    HD1  PHE  46           HD1      PHE  46  -2.080   3.135  -4.746
  334    HD2  PHE  46           HD2      PHE  46  -5.691   1.006  -5.505
  335    HE1  PHE  46           HE1      PHE  46  -0.861   1.596  -6.205
  336    HE2  PHE  46           HE2      PHE  46  -4.468  -0.542  -6.970
  337    HZ   PHE  46           HZ       PHE  46  -2.054  -0.254  -7.324
  338    H    GLU  47           H        GLU  47  -7.088   4.895  -5.336
  339    HA   GLU  47           HA       GLU  47  -6.993   4.021  -7.955
  340   1HB   GLU  47          1HB       GLU  47  -8.895   5.454  -6.204
  341   2HB   GLU  47          2HB       GLU  47  -9.176   5.511  -7.916
  342   1HG   GLU  47          1HG       GLU  47 -10.422   3.699  -7.186
  343   2HG   GLU  47          2HG       GLU  47  -8.985   2.981  -7.895
  344    H    LYS  48           H        LYS  48  -7.132   7.389  -6.746
  345    HA   LYS  48           HA       LYS  48  -6.893   8.406  -9.414
  346   1HB   LYS  48          1HB       LYS  48  -6.826  10.636  -8.321
  347   2HB   LYS  48          2HB       LYS  48  -8.235   9.670  -7.911
  348   1HG   LYS  48          1HG       LYS  48  -7.280   9.113  -5.761
  349   2HG   LYS  48          2HG       LYS  48  -5.790   9.965  -6.177
  350   1HD   LYS  48          1HD       LYS  48  -8.506  11.276  -6.047
  351   2HD   LYS  48          2HD       LYS  48  -7.375  11.232  -4.694
  352   1HE   LYS  48          1HE       LYS  48  -6.752  12.412  -7.400
  353   2HE   LYS  48          2HE       LYS  48  -7.301  13.348  -6.010
  354   1HZ   LYS  48          1HZ       LYS  48  -4.914  11.624  -5.762
  355   2HZ   LYS  48          2HZ       LYS  48  -5.332  13.023  -4.898
  356   3HZ   LYS  48          3HZ       LYS  48  -4.785  13.154  -6.496
  357    H    ASP  49           H        ASP  49  -4.656   7.936  -6.732
  358    HA   ASP  49           HA       ASP  49  -2.620   9.447  -8.151
  359   1HB   ASP  49          1HB       ASP  49  -2.549   8.058  -5.470
  360   2HB   ASP  49          2HB       ASP  49  -1.187   8.927  -6.170
  361    H    GLY  50           H        GLY  50  -2.774   6.138  -6.781
  362   1HA   GLY  50          1HA       GLY  50  -2.271   4.201  -8.031
  363   2HA   GLY  50          2HA       GLY  50  -1.399   5.207  -9.166
  364    H    LYS  51           H        LYS  51  -0.426   6.114  -6.093
  365    HA   LYS  51           HA       LYS  51   2.085   4.733  -6.458
  366   1HB   LYS  51          1HB       LYS  51   1.102   6.823  -4.555
  367   2HB   LYS  51          2HB       LYS  51   2.588   5.958  -4.214
  368   1HG   LYS  51          1HG       LYS  51   3.119   8.020  -5.283
  369   2HG   LYS  51          2HG       LYS  51   3.473   6.701  -6.394
  370   1HD   LYS  51          1HD       LYS  51   1.242   7.128  -7.463
  371   2HD   LYS  51          2HD       LYS  51   1.114   8.570  -6.453
  372   1HE   LYS  51          1HE       LYS  51   3.309   8.009  -8.451
  373   2HE   LYS  51          2HE       LYS  51   1.942   9.096  -8.701
  374   1HZ   LYS  51          1HZ       LYS  51   4.361   9.805  -7.707
  375   2HZ   LYS  51          2HZ       LYS  51   3.414   9.678  -6.301
  376   3HZ   LYS  51          3HZ       LYS  51   2.933  10.708  -7.557
  377    H    TYR  52           H        TYR  52   2.737   2.923  -5.475
  378    HA   TYR  52           HA       TYR  52   1.501   2.118  -2.973
  379   1HB   TYR  52          1HB       TYR  52   0.835  -0.061  -3.782
  380   2HB   TYR  52          2HB       TYR  52   0.096   1.154  -4.816
  381    HD1  TYR  52           HD1      TYR  52   2.719  -1.425  -4.619
  382    HD2  TYR  52           HD2      TYR  52   0.696   1.343  -7.141
  383    HE1  TYR  52           HE1      TYR  52   3.724  -2.501  -6.587
  384    HE2  TYR  52           HE2      TYR  52   1.693   0.276  -9.114
  385    HH   TYR  52           HH       TYR  52   4.274  -1.715  -9.053
  386    H    GLY  53           H        GLY  53   2.535   0.186  -2.085
  387   1HA   GLY  53          1HA       GLY  53   5.025  -0.748  -3.114
  388   2HA   GLY  53          2HA       GLY  53   5.232   0.320  -1.735
  389    H    PHE  54           H        PHE  54   5.952  -2.409  -1.674
  390    HA   PHE  54           HA       PHE  54   3.765  -3.654  -0.193
  391   1HB   PHE  54          1HB       PHE  54   6.337  -4.873  -1.152
  392   2HB   PHE  54          2HB       PHE  54   4.978  -5.737  -0.449
  393    HD1  PHE  54           HD1      PHE  54   5.881  -3.544  -3.321
  394    HD2  PHE  54           HD2      PHE  54   3.304  -6.584  -1.815
  395    HE1  PHE  54           HE1      PHE  54   4.891  -3.799  -5.552
  396    HE2  PHE  54           HE2      PHE  54   2.319  -6.847  -4.045
  397    HZ   PHE  54           HZ       PHE  54   3.107  -5.454  -5.922
  398    H    CYS  55           H        CYS  55   4.011  -4.467   1.883
  399    HA   CYS  55           HA       CYS  55   5.836  -3.060   3.581
  400   1HB   CYS  55          1HB       CYS  55   3.762  -5.189   3.994
  401   2HB   CYS  55          2HB       CYS  55   4.939  -4.894   5.261
  402    HA   PRO  56           HA       PRO  56   9.353  -5.713   3.466
  403   1HB   PRO  56          1HB       PRO  56   9.950  -6.007   6.127
  404   2HB   PRO  56          2HB       PRO  56  10.435  -4.632   5.136
  405   1HG   PRO  56          1HG       PRO  56   8.160  -4.882   7.053
  406   2HG   PRO  56          2HG       PRO  56   9.218  -3.493   6.733
  407   1HD   PRO  56          1HD       PRO  56   6.713  -3.627   5.754
  408   2HD   PRO  56          2HD       PRO  56   8.032  -2.863   4.844
  409    H    HIS  57           H        HIS  57   8.328  -7.585   2.687
  410    HA   HIS  57           HA       HIS  57   7.611  -9.579   4.720
  411   1HB   HIS  57          1HB       HIS  57   6.501 -10.795   2.782
  412   2HB   HIS  57          2HB       HIS  57   5.745  -9.285   3.269
  413    HD1  HIS  57           HD1      HIS  57   8.420 -10.232   0.692
  414    HD2  HIS  57           HD2      HIS  57   4.988  -7.913   1.071
  415    HE1  HIS  57           HE1      HIS  57   8.063  -9.182  -1.561
  416    H    GLU  58           H        GLU  58   7.872 -11.701   2.598
  417    HA   GLU  58           HA       GLU  58  10.701 -12.177   3.025
  418   1HB   GLU  58          1HB       GLU  58  10.248 -14.419   2.138
  419   2HB   GLU  58          2HB       GLU  58   9.141 -14.008   3.433
  420   1HG   GLU  58          1HG       GLU  58   7.418 -13.477   1.741
  421   2HG   GLU  58          2HG       GLU  58   8.533 -14.013   0.480
  422    H    ALA  59           H        ALA  59  10.974 -13.827   0.603
  423    HA   ALA  59           HA       ALA  59  11.622 -11.652  -1.231
  424   1HB   ALA  59          1HB       ALA  59  12.885 -13.513  -2.439
  425   2HB   ALA  59          2HB       ALA  59  12.547 -14.500  -1.020
  426   3HB   ALA  59          3HB       ALA  59  13.486 -13.020  -0.859
  Start of MODEL   41
    1   1H    ARG   1          1H        ARG   1   8.358   1.486  11.423
    2   2H    ARG   1          2H        ARG   1   7.843   2.972  12.125
    3   3H    ARG   1          3H        ARG   1   9.352   2.880  11.301
    4    HA   ARG   1           HA       ARG   1   6.750   2.390  10.020
    5   1HB   ARG   1          1HB       ARG   1   7.136   4.718  11.025
    6   2HB   ARG   1          2HB       ARG   1   8.429   4.892   9.845
    7   1HG   ARG   1          1HG       ARG   1   6.276   5.918   9.173
    8   2HG   ARG   1          2HG       ARG   1   6.902   4.731   8.029
    9   1HD   ARG   1          1HD       ARG   1   5.330   3.099   8.713
   10   2HD   ARG   1          2HD       ARG   1   4.889   4.023  10.148
   11    HE   ARG   1           HE       ARG   1   3.925   4.423   7.442
   12   1HH1  ARG   1          1HH1      ARG   1   4.254   5.754  10.661
   13   2HH1  ARG   1          2HH1      ARG   1   2.925   6.857  10.477
   14   1HH2  ARG   1          1HH2      ARG   1   2.190   5.897   7.192
   15   2HH2  ARG   1          2HH2      ARG   1   1.753   6.946   8.508
   16    H    ILE   2           H        ILE   2   7.253   1.008   8.442
   17    HA   ILE   2           HA       ILE   2   9.841   0.697   7.374
   18    HB   ILE   2           HB       ILE   2   8.699  -0.697   5.587
   19   1HG1  ILE   2          1HG1      ILE   2   6.239   0.155   7.115
   20   2HG1  ILE   2          2HG1      ILE   2   6.605   0.446   5.419
   21   1HG2  ILE   2          1HG2      ILE   2   9.305  -2.192   7.267
   22   2HG2  ILE   2          2HG2      ILE   2   7.555  -2.294   7.438
   23   3HG2  ILE   2          3HG2      ILE   2   8.478  -1.254   8.516
   24   1HD1  ILE   2          1HD1      ILE   2   5.213  -1.306   5.153
   25   2HD1  ILE   2          2HD1      ILE   2   5.569  -1.968   6.749
   26   3HD1  ILE   2          3HD1      ILE   2   6.697  -2.217   5.418
   27    HA   PRO   3           HA       PRO   3   9.949   3.685   4.192
   28   1HB   PRO   3          1HB       PRO   3  12.187   2.463   2.974
   29   2HB   PRO   3          2HB       PRO   3  12.201   3.696   4.231
   30   1HG   PRO   3          1HG       PRO   3  13.083   1.063   4.525
   31   2HG   PRO   3          2HG       PRO   3  12.713   2.189   5.846
   32   1HD   PRO   3          1HD       PRO   3  11.033   0.009   4.681
   33   2HD   PRO   3          2HD       PRO   3  11.176   0.543   6.369
   34    H    VAL   4           H        VAL   4   8.796   0.688   3.558
   35    HA   VAL   4           HA       VAL   4   7.652  -0.201   1.776
   36    HB   VAL   4           HB       VAL   4   8.461   2.347   0.310
   37   1HG1  VAL   4          1HG1      VAL   4   7.902   0.432  -1.175
   38   2HG1  VAL   4          2HG1      VAL   4   6.823   1.818  -1.330
   39   3HG1  VAL   4          3HG1      VAL   4   6.298   0.390  -0.436
   40   1HG2  VAL   4          1HG2      VAL   4   7.071   3.037   2.056
   41   2HG2  VAL   4          2HG2      VAL   4   6.038   1.612   1.933
   42   3HG2  VAL   4          3HG2      VAL   4   5.972   2.856   0.685
   43    H    LYS   5           H        LYS   5   8.093  -1.526   0.038
   44    HA   LYS   5           HA       LYS   5  10.932  -1.959  -0.375
   45   1HB   LYS   5          1HB       LYS   5   8.482  -3.611  -0.541
   46   2HB   LYS   5          2HB       LYS   5   9.784  -4.044  -1.634
   47   1HG   LYS   5          1HG       LYS   5   9.944  -3.903   1.371
   48   2HG   LYS   5          2HG       LYS   5   9.868  -5.369   0.380
   49   1HD   LYS   5          1HD       LYS   5  12.026  -4.938  -0.560
   50   2HD   LYS   5          2HD       LYS   5  12.102  -3.344   0.199
   51   1HE   LYS   5          1HE       LYS   5  12.148  -4.373   2.407
   52   2HE   LYS   5          2HE       LYS   5  11.985  -5.974   1.681
   53   1HZ   LYS   5          1HZ       LYS   5  14.177  -4.929   0.442
   54   2HZ   LYS   5          2HZ       LYS   5  14.204  -6.011   1.749
   55   3HZ   LYS   5          3HZ       LYS   5  14.330  -4.341   2.029
   56    H    TYR   6           H        TYR   6   8.818  -3.178  -2.776
   57    HA   TYR   6           HA       TYR   6  10.131  -1.462  -4.754
   58   1HB   TYR   6          1HB       TYR   6   8.519  -3.915  -5.419
   59   2HB   TYR   6          2HB       TYR   6   9.846  -3.178  -6.322
   60    HD1  TYR   6           HD1      TYR   6   8.993  -5.357  -3.482
   61    HD2  TYR   6           HD2      TYR   6  12.167  -3.615  -5.721
   62    HE1  TYR   6           HE1      TYR   6  10.583  -6.865  -2.381
   63    HE2  TYR   6           HE2      TYR   6  13.759  -5.123  -4.631
   64    HH   TYR   6           HH       TYR   6  13.721  -6.409  -2.222
   65    H    GLY   7           H        GLY   7   8.771  -1.077  -6.789
   66   1HA   GLY   7          1HA       GLY   7   6.415  -0.866  -7.540
   67   2HA   GLY   7          2HA       GLY   7   6.083  -0.151  -5.975
   68    H    ASN   8           H        ASN   8   5.350   1.761  -6.884
   69    HA   ASN   8           HA       ASN   8   7.447   3.409  -8.149
   70   1HB   ASN   8          1HB       ASN   8   5.785   4.474  -9.506
   71   2HB   ASN   8          2HB       ASN   8   5.563   2.735  -9.669
   72   1HD2  ASN   8          1HD2      ASN   8   3.726   5.070  -9.999
   73   2HD2  ASN   8          2HD2      ASN   8   2.389   4.712  -8.964
   74    H    ALA   9           H        ALA   9   6.735   3.105  -5.323
   75    HA   ALA   9           HA       ALA   9   5.520   5.640  -4.588
   76   1HB   ALA   9          1HB       ALA   9   6.552   3.635  -2.650
   77   2HB   ALA   9          2HB       ALA   9   5.046   3.357  -3.529
   78   3HB   ALA   9          3HB       ALA   9   5.214   4.769  -2.484
   79    H    ASP  10           H        ASP  10   8.539   4.714  -5.415
   80    HA   ASP  10           HA       ASP  10  10.613   5.581  -5.199
   81   1HB   ASP  10          1HB       ASP  10   9.341   7.699  -5.606
   82   2HB   ASP  10          2HB       ASP  10   9.281   7.939  -3.864
   83    H    GLY  11           H        GLY  11   9.822   7.406  -2.341
   84   1HA   GLY  11          1HA       GLY  11  11.027   5.350  -0.661
   85   2HA   GLY  11          2HA       GLY  11  11.782   6.925  -0.721
   86    H    GLU  12           H        GLU  12   8.315   6.726  -0.872
   87    HA   GLU  12           HA       GLU  12   8.112   8.173   1.622
   88   1HB   GLU  12          1HB       GLU  12   6.207   7.343  -0.521
   89   2HB   GLU  12          2HB       GLU  12   5.558   7.731   1.065
   90   1HG   GLU  12          1HG       GLU  12   5.385   9.719  -0.108
   91   2HG   GLU  12          2HG       GLU  12   6.854   9.929   0.835
   92    H    TYR  13           H        TYR  13   6.226   7.377   3.133
   93    HA   TYR  13           HA       TYR  13   6.816   4.612   3.785
   94   1HB   TYR  13          1HB       TYR  13   6.036   5.136   6.008
   95   2HB   TYR  13          2HB       TYR  13   7.324   6.209   5.524
   96    HD1  TYR  13           HD1      TYR  13   6.262   7.221   7.679
   97    HD2  TYR  13           HD2      TYR  13   4.418   7.259   3.858
   98    HE1  TYR  13           HE1      TYR  13   4.867   9.133   8.394
   99    HE2  TYR  13           HE2      TYR  13   3.021   9.176   4.539
  100    HH   TYR  13           HH       TYR  13   3.521  11.165   6.742
  101    H    CYS  14           H        CYS  14   4.921   3.416   4.873
  102    HA   CYS  14           HA       CYS  14   2.796   3.284   3.005
  103   1HB   CYS  14          1HB       CYS  14   3.164   2.066   5.744
  104   2HB   CYS  14          2HB       CYS  14   1.729   1.782   4.768
  105    H    LYS  15           H        LYS  15   0.991   4.485   2.908
  106    HA   LYS  15           HA       LYS  15   0.575   6.482   4.953
  107   1HB   LYS  15          1HB       LYS  15   0.309   6.861   2.430
  108   2HB   LYS  15          2HB       LYS  15  -1.224   6.007   2.581
  109   1HG   LYS  15          1HG       LYS  15  -1.402   8.487   2.657
  110   2HG   LYS  15          2HG       LYS  15  -2.084   7.663   4.061
  111   1HD   LYS  15          1HD       LYS  15  -0.076   8.147   5.346
  112   2HD   LYS  15          2HD       LYS  15   0.661   8.915   3.937
  113   1HE   LYS  15          1HE       LYS  15  -1.099  10.621   3.950
  114   2HE   LYS  15          2HE       LYS  15  -1.838   9.846   5.355
  115   1HZ   LYS  15          1HZ       LYS  15   0.135  10.319   6.633
  116   2HZ   LYS  15          2HZ       LYS  15  -0.444  11.758   5.954
  117   3HZ   LYS  15          3HZ       LYS  15   0.910  10.986   5.276
  118    H    PHE  16           H        PHE  16  -0.465   6.040   6.716
  119    HA   PHE  16           HA       PHE  16  -2.792   4.237   6.604
  120   1HB   PHE  16          1HB       PHE  16  -0.812   4.637   8.866
  121   2HB   PHE  16          2HB       PHE  16  -2.279   3.672   8.980
  122    HD1  PHE  16           HD1      PHE  16   0.501   2.687   9.535
  123    HD2  PHE  16           HD2      PHE  16  -1.838   2.676   5.983
  124    HE1  PHE  16           HE1      PHE  16   1.731   0.726   8.739
  125    HE2  PHE  16           HE2      PHE  16  -0.616   0.715   5.174
  126    HZ   PHE  16           HZ       PHE  16   1.190  -0.286   6.539
  127    HA   PRO  17           HA       PRO  17  -4.516   4.070   6.757
  128   1HB   PRO  17          1HB       PRO  17  -7.110   4.940   6.507
  129   2HB   PRO  17          2HB       PRO  17  -6.470   4.126   7.936
  130   1HG   PRO  17          1HG       PRO  17  -7.330   6.868   7.673
  131   2HG   PRO  17          2HG       PRO  17  -6.795   6.021   9.131
  132   1HD   PRO  17          1HD       PRO  17  -5.304   7.854   7.384
  133   2HD   PRO  17          2HD       PRO  17  -4.951   7.345   9.048
  134    H    PHE  18           H        PHE  18  -5.076   3.608   4.604
  135    HA   PHE  18           HA       PHE  18  -5.169   5.964   2.851
  136   1HB   PHE  18          1HB       PHE  18  -4.045   4.731   1.108
  137   2HB   PHE  18          2HB       PHE  18  -3.091   4.638   2.579
  138    HD1  PHE  18           HD1      PHE  18  -5.295   2.749   0.304
  139    HD2  PHE  18           HD2      PHE  18  -2.605   2.558   3.596
  140    HE1  PHE  18           HE1      PHE  18  -5.166   0.311   0.042
  141    HE2  PHE  18           HE2      PHE  18  -2.477   0.111   3.349
  142    HZ   PHE  18           HZ       PHE  18  -3.758  -1.032   1.578
  143    H    LEU  19           H        LEU  19  -6.655   6.045   1.226
  144    HA   LEU  19           HA       LEU  19  -9.022   4.469   1.653
  145   1HB   LEU  19          1HB       LEU  19  -9.014   6.941   1.258
  146   2HB   LEU  19          2HB       LEU  19  -8.512   6.619  -0.390
  147    HG   LEU  19           HG       LEU  19 -10.623   5.270  -0.662
  148   1HD1  LEU  19          1HD1      LEU  19 -12.075   4.994   0.996
  149   2HD1  LEU  19          2HD1      LEU  19 -12.040   6.707   1.411
  150   3HD1  LEU  19          3HD1      LEU  19 -10.829   5.609   2.082
  151   1HD2  LEU  19          1HD2      LEU  19 -10.109   7.937  -0.997
  152   2HD2  LEU  19          2HD2      LEU  19 -11.615   7.944  -0.078
  153   3HD2  LEU  19          3HD2      LEU  19 -11.518   7.070  -1.608
  154    H    PHE  20           H        PHE  20  -9.317   2.579   0.727
  155    HA   PHE  20           HA       PHE  20  -8.433   2.194  -2.067
  156   1HB   PHE  20          1HB       PHE  20  -7.187   0.816  -0.247
  157   2HB   PHE  20          2HB       PHE  20  -8.727  -0.017  -0.065
  158    HD1  PHE  20           HD1      PHE  20  -6.814   1.083  -3.081
  159    HD2  PHE  20           HD2      PHE  20  -8.672  -2.063  -0.910
  160    HE1  PHE  20           HE1      PHE  20  -6.257  -0.503  -4.886
  161    HE2  PHE  20           HE2      PHE  20  -8.126  -3.652  -2.702
  162    HZ   PHE  20           HZ       PHE  20  -6.922  -2.865  -4.706
  163    H    ASN  21           H        ASN  21 -10.310   2.459  -3.136
  164    HA   ASN  21           HA       ASN  21 -12.435   2.162  -3.867
  165   1HB   ASN  21          1HB       ASN  21 -11.889  -0.525  -2.637
  166   2HB   ASN  21          2HB       ASN  21 -13.411  -0.172  -3.448
  167   1HD2  ASN  21          1HD2      ASN  21 -13.459  -0.842  -5.446
  168   2HD2  ASN  21          2HD2      ASN  21 -12.124  -0.909  -6.543
  169    H    GLY  22           H        GLY  22 -12.025   3.247  -1.077
  170   1HA   GLY  22          1HA       GLY  22 -13.888   4.305   0.032
  171   2HA   GLY  22          2HA       GLY  22 -14.814   2.842  -0.231
  172    H    LYS  23           H        LYS  23 -12.010   1.600   0.665
  173    HA   LYS  23           HA       LYS  23 -12.744   1.674   3.512
  174   1HB   LYS  23          1HB       LYS  23 -12.792  -0.554   2.203
  175   2HB   LYS  23          2HB       LYS  23 -11.034  -0.460   2.234
  176   1HG   LYS  23          1HG       LYS  23 -12.635  -0.306   4.773
  177   2HG   LYS  23          2HG       LYS  23 -12.232  -1.850   4.037
  178   1HD   LYS  23          1HD       LYS  23  -9.845  -1.267   4.150
  179   2HD   LYS  23          2HD       LYS  23 -10.274   0.259   4.929
  180   1HE   LYS  23          1HE       LYS  23  -9.608  -1.268   6.634
  181   2HE   LYS  23          2HE       LYS  23 -11.358  -1.060   6.752
  182   1HZ   LYS  23          1HZ       LYS  23  -9.859  -3.435   6.331
  183   2HZ   LYS  23          2HZ       LYS  23 -10.974  -3.219   5.062
  184   3HZ   LYS  23          3HZ       LYS  23 -11.514  -3.263   6.663
  185    H    GLU  24           H        GLU  24 -11.314   2.256   5.014
  186    HA   GLU  24           HA       GLU  24  -8.723   3.263   4.057
  187   1HB   GLU  24          1HB       GLU  24 -10.204   3.885   6.619
  188   2HB   GLU  24          2HB       GLU  24  -8.679   4.600   6.126
  189   1HG   GLU  24          1HG       GLU  24  -9.788   5.581   4.186
  190   2HG   GLU  24          2HG       GLU  24 -11.318   4.891   4.722
  191    H    TYR  25           H        TYR  25  -7.083   1.912   4.333
  192    HA   TYR  25           HA       TYR  25  -7.215  -0.120   6.407
  193   1HB   TYR  25          1HB       TYR  25  -5.233   0.351   4.201
  194   2HB   TYR  25          2HB       TYR  25  -5.132  -0.981   5.337
  195    HD1  TYR  25           HD1      TYR  25  -7.075  -2.634   5.411
  196    HD2  TYR  25           HD2      TYR  25  -6.530   0.191   2.283
  197    HE1  TYR  25           HE1      TYR  25  -8.590  -3.948   3.959
  198    HE2  TYR  25           HE2      TYR  25  -8.033  -1.111   0.824
  199    HH   TYR  25           HH       TYR  25  -9.744  -2.747   0.938
  200    H    ASN  26           H        ASN  26  -6.161  -0.087   8.246
  201    HA   ASN  26           HA       ASN  26  -4.368   2.166   8.805
  202   1HB   ASN  26          1HB       ASN  26  -5.617   0.113  10.651
  203   2HB   ASN  26          2HB       ASN  26  -4.510   1.375  11.176
  204   1HD2  ASN  26          1HD2      ASN  26  -6.431   2.511   8.681
  205   2HD2  ASN  26          2HD2      ASN  26  -7.637   3.305   9.629
  206    H    SER  27           H        SER  27  -4.112  -0.683   7.463
  207    HA   SER  27           HA       SER  27  -1.344  -1.057   8.228
  208   1HB   SER  27          1HB       SER  27  -1.741  -3.545   8.527
  209   2HB   SER  27          2HB       SER  27  -2.384  -2.531   9.822
  210    HG   SER  27           HG       SER  27  -4.249  -3.402   9.402
  211    H    CYS  28           H        CYS  28  -0.626  -3.189   6.836
  212    HA   CYS  28           HA       CYS  28  -1.192  -2.446   4.098
  213   1HB   CYS  28          1HB       CYS  28   0.478  -4.704   5.220
  214   2HB   CYS  28          2HB       CYS  28   0.445  -4.193   3.537
  215    H    THR  29           H        THR  29  -2.205  -3.831   2.537
  216    HA   THR  29           HA       THR  29  -3.635  -6.113   3.680
  217    HB   THR  29           HB       THR  29  -5.150  -4.188   3.562
  218    HG1  THR  29           HG1      THR  29  -6.142  -6.143   3.222
  219   1HG2  THR  29          1HG2      THR  29  -5.255  -4.212   0.604
  220   2HG2  THR  29          2HG2      THR  29  -3.931  -3.324   1.358
  221   3HG2  THR  29          3HG2      THR  29  -5.602  -2.917   1.750
  222    H    ASP  30           H        ASP  30  -4.571  -7.536   1.919
  223    HA   ASP  30           HA       ASP  30  -2.573  -7.787  -0.187
  224   1HB   ASP  30          1HB       ASP  30  -4.260 -10.065   0.036
  225   2HB   ASP  30          2HB       ASP  30  -2.531  -9.995   0.147
  226    H    THR  31           H        THR  31  -5.537  -6.682   0.352
  227    HA   THR  31           HA       THR  31  -7.237  -7.677  -1.609
  228    HB   THR  31           HB       THR  31  -7.103  -4.831  -0.622
  229    HG1  THR  31           HG1      THR  31  -7.272  -5.817   1.251
  230   1HG2  THR  31          1HG2      THR  31  -8.947  -4.555  -1.802
  231   2HG2  THR  31          2HG2      THR  31  -9.737  -5.654  -0.669
  232   3HG2  THR  31          3HG2      THR  31  -9.053  -6.275  -2.173
  233    H    GLY  32           H        GLY  32  -7.644  -7.118  -3.738
  234   1HA   GLY  32          1HA       GLY  32  -7.341  -5.972  -5.754
  235   2HA   GLY  32          2HA       GLY  32  -6.051  -5.048  -4.999
  236    H    ARG  33           H        ARG  33  -4.548  -7.172  -3.971
  237    HA   ARG  33           HA       ARG  33  -3.151  -8.036  -6.348
  238   1HB   ARG  33          1HB       ARG  33  -2.655  -8.633  -3.415
  239   2HB   ARG  33          2HB       ARG  33  -1.573  -9.055  -4.726
  240   1HG   ARG  33          1HG       ARG  33  -2.350  -6.247  -3.980
  241   2HG   ARG  33          2HG       ARG  33  -0.873  -7.052  -3.464
  242   1HD   ARG  33          1HD       ARG  33  -1.677  -6.432  -6.305
  243   2HD   ARG  33          2HD       ARG  33  -0.449  -5.591  -5.359
  244    HE   ARG  33           HE       ARG  33   0.095  -8.392  -5.581
  245   1HH1  ARG  33          1HH1      ARG  33   0.418  -5.293  -7.126
  246   2HH1  ARG  33          2HH1      ARG  33   1.652  -5.816  -8.232
  247   1HH2  ARG  33          1HH2      ARG  33   1.792  -9.089  -6.971
  248   2HH2  ARG  33          2HH2      ARG  33   2.440  -7.982  -8.141
  249    H    SER  34           H        SER  34  -3.072 -10.117  -7.136
  250    HA   SER  34           HA       SER  34  -5.154 -11.905  -6.180
  251   1HB   SER  34          1HB       SER  34  -3.267 -12.266  -8.521
  252   2HB   SER  34          2HB       SER  34  -4.747 -13.175  -8.208
  253    HG   SER  34           HG       SER  34  -4.413 -10.724  -9.377
  254    H    ASP  35           H        ASP  35  -1.741 -11.518  -5.940
  255    HA   ASP  35           HA       ASP  35  -1.224 -14.244  -5.262
  256   1HB   ASP  35          1HB       ASP  35   0.820 -12.372  -4.499
  257   2HB   ASP  35          2HB       ASP  35   0.942 -13.755  -5.541
  258    H    GLY  36           H        GLY  36  -2.663 -11.865  -3.611
  259   1HA   GLY  36          1HA       GLY  36  -3.146 -11.552  -1.379
  260   2HA   GLY  36          2HA       GLY  36  -2.459 -13.146  -1.102
  261    H    PHE  37           H        PHE  37  -0.674 -10.520  -2.583
  262    HA   PHE  37           HA       PHE  37   1.316 -10.721  -0.494
  263   1HB   PHE  37          1HB       PHE  37   1.647 -10.406  -3.104
  264   2HB   PHE  37          2HB       PHE  37   1.515  -8.701  -2.684
  265    HD1  PHE  37           HD1      PHE  37   3.188 -11.691  -1.209
  266    HD2  PHE  37           HD2      PHE  37   3.558  -7.661  -2.522
  267    HE1  PHE  37           HE1      PHE  37   5.556 -11.699  -0.536
  268    HE2  PHE  37           HE2      PHE  37   5.921  -7.658  -1.856
  269    HZ   PHE  37           HZ       PHE  37   6.929  -9.675  -0.861
  270    H    LEU  38           H        LEU  38   1.878  -9.142   0.922
  271    HA   LEU  38           HA       LEU  38  -0.176  -7.277   1.654
  272   1HB   LEU  38          1HB       LEU  38   1.486  -8.722   3.101
  273   2HB   LEU  38          2HB       LEU  38   2.550  -7.344   2.882
  274    HG   LEU  38           HG       LEU  38   0.713  -5.923   3.865
  275   1HD1  LEU  38          1HD1      LEU  38  -1.107  -6.881   4.967
  276   2HD1  LEU  38          2HD1      LEU  38  -0.414  -8.501   4.889
  277   3HD1  LEU  38          3HD1      LEU  38  -1.030  -7.735   3.426
  278   1HD2  LEU  38          1HD2      LEU  38   1.815  -8.093   5.642
  279   2HD2  LEU  38          2HD2      LEU  38   1.286  -6.485   6.141
  280   3HD2  LEU  38          3HD2      LEU  38   2.708  -6.669   5.115
  281    H    TRP  39           H        TRP  39  -0.353  -5.270   0.848
  282    HA   TRP  39           HA       TRP  39   2.116  -3.794   0.225
  283   1HB   TRP  39          1HB       TRP  39   1.154  -2.886  -1.818
  284   2HB   TRP  39          2HB       TRP  39   1.152  -4.639  -1.898
  285    HD1  TRP  39           HD1      TRP  39  -1.273  -5.863  -1.656
  286    HE1  TRP  39           HE1      TRP  39  -3.621  -5.030  -2.230
  287    HE3  TRP  39           HE3      TRP  39  -0.350  -0.840  -1.848
  288    HZ2  TRP  39           HZ2      TRP  39  -4.921  -2.575  -2.706
  289    HZ3  TRP  39           HZ3      TRP  39  -2.210   0.680  -2.382
  290    HH2  TRP  39           HH2      TRP  39  -4.450  -0.183  -2.792
  291    H    CYS  40           H        CYS  40   1.531  -1.390  -0.198
  292    HA   CYS  40           HA       CYS  40  -0.759  -0.473   1.343
  293   1HB   CYS  40          1HB       CYS  40   0.553   0.918   2.841
  294   2HB   CYS  40          2HB       CYS  40   1.064  -0.758   3.009
  295    H    SER  41           H        SER  41  -1.177   1.828   1.023
  296    HA   SER  41           HA       SER  41  -0.212   2.704  -1.582
  297   1HB   SER  41          1HB       SER  41  -2.641   2.783  -1.114
  298   2HB   SER  41          2HB       SER  41  -2.341   3.911   0.207
  299    HG   SER  41           HG       SER  41  -2.403   5.436  -1.224
  300    H    THR  42           H        THR  42   0.301   5.033  -1.843
  301    HA   THR  42           HA       THR  42   2.123   5.874   0.299
  302    HB   THR  42           HB       THR  42   1.981   6.920  -2.526
  303    HG1  THR  42           HG1      THR  42   2.312   4.653  -2.547
  304   1HG2  THR  42          1HG2      THR  42   3.547   8.298  -1.737
  305   2HG2  THR  42          2HG2      THR  42   4.605   6.888  -1.781
  306   3HG2  THR  42          3HG2      THR  42   3.794   7.334  -0.281
  307    H    THR  43           H        THR  43  -0.514   6.954  -1.747
  308    HA   THR  43           HA       THR  43  -0.634   9.487  -0.283
  309    HB   THR  43           HB       THR  43  -2.080  10.235  -2.131
  310    HG1  THR  43           HG1      THR  43  -2.654   8.901  -3.746
  311   1HG2  THR  43          1HG2      THR  43  -0.070  10.822  -2.936
  312   2HG2  THR  43          2HG2      THR  43  -0.334   9.486  -4.060
  313   3HG2  THR  43          3HG2      THR  43   0.638   9.241  -2.608
  314    H    TYR  44           H        TYR  44  -3.071  10.279  -0.112
  315    HA   TYR  44           HA       TYR  44  -4.332   8.508   1.681
  316   1HB   TYR  44          1HB       TYR  44  -6.183  10.297   1.464
  317   2HB   TYR  44          2HB       TYR  44  -4.661  10.738   2.217
  318    HD1  TYR  44           HD1      TYR  44  -6.381  10.780  -1.123
  319    HD2  TYR  44           HD2      TYR  44  -3.596  12.677   1.484
  320    HE1  TYR  44           HE1      TYR  44  -6.161  12.635  -2.713
  321    HE2  TYR  44           HE2      TYR  44  -3.376  14.538  -0.107
  322    HH   TYR  44           HH       TYR  44  -4.231  14.396  -3.214
  323    H    ASN  45           H        ASN  45  -4.679   9.105  -1.729
  324    HA   ASN  45           HA       ASN  45  -6.865   7.135  -1.772
  325   1HB   ASN  45          1HB       ASN  45  -7.590   9.503  -2.350
  326   2HB   ASN  45          2HB       ASN  45  -6.566   9.390  -3.761
  327   1HD2  ASN  45          1HD2      ASN  45  -7.474   6.417  -3.876
  328   2HD2  ASN  45          2HD2      ASN  45  -8.988   6.615  -4.622
  329    H    PHE  46           H        PHE  46  -5.848   5.335  -2.460
  330    HA   PHE  46           HA       PHE  46  -3.514   5.255  -3.998
  331   1HB   PHE  46          1HB       PHE  46  -4.125   3.381  -2.634
  332   2HB   PHE  46          2HB       PHE  46  -5.634   3.146  -3.546
  333    HD1  PHE  46           HD1      PHE  46  -1.943   3.418  -4.266
  334    HD2  PHE  46           HD2      PHE  46  -5.615   1.402  -5.046
  335    HE1  PHE  46           HE1      PHE  46  -0.791   1.904  -5.822
  336    HE2  PHE  46           HE2      PHE  46  -4.466  -0.111  -6.595
  337    HZ   PHE  46           HZ       PHE  46  -2.048   0.142  -6.995
  338    H    GLU  47           H        GLU  47  -6.879   4.696  -5.044
  339    HA   GLU  47           HA       GLU  47  -6.369   4.009  -7.671
  340   1HB   GLU  47          1HB       GLU  47  -8.586   3.990  -6.399
  341   2HB   GLU  47          2HB       GLU  47  -8.745   5.673  -6.876
  342   1HG   GLU  47          1HG       GLU  47  -8.478   4.936  -9.249
  343   2HG   GLU  47          2HG       GLU  47  -8.587   3.273  -8.670
  344    H    LYS  48           H        LYS  48  -6.960   7.269  -6.383
  345    HA   LYS  48           HA       LYS  48  -6.893   8.557  -8.866
  346   1HB   LYS  48          1HB       LYS  48  -7.935   9.744  -7.119
  347   2HB   LYS  48          2HB       LYS  48  -6.574   9.523  -6.034
  348   1HG   LYS  48          1HG       LYS  48  -5.274  11.163  -7.267
  349   2HG   LYS  48          2HG       LYS  48  -6.570  11.355  -8.452
  350   1HD   LYS  48          1HD       LYS  48  -8.058  12.121  -6.633
  351   2HD   LYS  48          2HD       LYS  48  -6.689  12.024  -5.519
  352   1HE   LYS  48          1HE       LYS  48  -5.481  13.688  -6.760
  353   2HE   LYS  48          2HE       LYS  48  -6.709  13.697  -8.028
  354   1HZ   LYS  48          1HZ       LYS  48  -6.822  14.844  -5.323
  355   2HZ   LYS  48          2HZ       LYS  48  -8.264  14.352  -6.069
  356   3HZ   LYS  48          3HZ       LYS  48  -7.288  15.529  -6.805
  357    H    ASP  49           H        ASP  49  -4.270   8.220  -6.445
  358    HA   ASP  49           HA       ASP  49  -2.436   9.522  -8.267
  359   1HB   ASP  49          1HB       ASP  49  -2.144   8.448  -5.475
  360   2HB   ASP  49          2HB       ASP  49  -0.763   9.051  -6.388
  361    H    GLY  50           H        GLY  50  -2.467   6.330  -6.654
  362   1HA   GLY  50          1HA       GLY  50  -2.154   4.307  -7.851
  363   2HA   GLY  50          2HA       GLY  50  -1.353   5.216  -9.113
  364    H    LYS  51           H        LYS  51  -0.113   6.258  -6.216
  365    HA   LYS  51           HA       LYS  51   2.326   4.810  -6.677
  366   1HB   LYS  51          1HB       LYS  51   1.567   6.967  -4.751
  367   2HB   LYS  51          2HB       LYS  51   3.140   6.173  -4.711
  368   1HG   LYS  51          1HG       LYS  51   3.666   6.922  -6.883
  369   2HG   LYS  51          2HG       LYS  51   2.005   7.454  -7.172
  370   1HD   LYS  51          1HD       LYS  51   3.157   9.398  -6.706
  371   2HD   LYS  51          2HD       LYS  51   2.347   8.984  -5.195
  372   1HE   LYS  51          1HE       LYS  51   4.396   8.078  -4.295
  373   2HE   LYS  51          2HE       LYS  51   5.226   8.334  -5.829
  374   1HZ   LYS  51          1HZ       LYS  51   5.886  10.213  -4.821
  375   2HZ   LYS  51          2HZ       LYS  51   4.580  10.236  -3.728
  376   3HZ   LYS  51          3HZ       LYS  51   4.371  10.803  -5.315
  377    H    TYR  52           H        TYR  52   2.699   2.869  -5.872
  378    HA   TYR  52           HA       TYR  52   1.705   2.251  -3.182
  379   1HB   TYR  52          1HB       TYR  52   0.949   0.074  -3.874
  380   2HB   TYR  52          2HB       TYR  52   0.211   1.260  -4.945
  381    HD1  TYR  52           HD1      TYR  52   2.699  -1.436  -4.702
  382    HD2  TYR  52           HD2      TYR  52   0.830   1.378  -7.295
  383    HE1  TYR  52           HE1      TYR  52   3.651  -2.599  -6.641
  384    HE2  TYR  52           HE2      TYR  52   1.779   0.217  -9.241
  385    HH   TYR  52           HH       TYR  52   3.386  -1.301  -9.884
  386    H    GLY  53           H        GLY  53   2.685   0.155  -2.413
  387   1HA   GLY  53          1HA       GLY  53   5.163  -0.699  -3.514
  388   2HA   GLY  53          2HA       GLY  53   5.388   0.301  -2.093
  389    H    PHE  54           H        PHE  54   6.153  -2.401  -2.218
  390    HA   PHE  54           HA       PHE  54   4.069  -3.837  -0.803
  391   1HB   PHE  54          1HB       PHE  54   6.783  -4.743  -1.726
  392   2HB   PHE  54          2HB       PHE  54   5.597  -5.780  -0.943
  393    HD1  PHE  54           HD1      PHE  54   3.119  -5.291  -2.126
  394    HD2  PHE  54           HD2      PHE  54   6.945  -5.170  -3.981
  395    HE1  PHE  54           HE1      PHE  54   2.072  -5.751  -4.302
  396    HE2  PHE  54           HE2      PHE  54   5.907  -5.625  -6.160
  397    HZ   PHE  54           HZ       PHE  54   3.464  -5.918  -6.324
  398    H    CYS  55           H        CYS  55   4.246  -4.630   1.280
  399    HA   CYS  55           HA       CYS  55   5.936  -2.980   2.949
  400   1HB   CYS  55          1HB       CYS  55   3.851  -4.979   3.843
  401   2HB   CYS  55          2HB       CYS  55   4.560  -3.682   4.800
  402    HA   PRO  56           HA       PRO  56   7.837  -7.021   4.322
  403   1HB   PRO  56          1HB       PRO  56   6.681  -9.386   4.029
  404   2HB   PRO  56          2HB       PRO  56   6.033  -8.198   5.163
  405   1HG   PRO  56          1HG       PRO  56   4.981  -9.063   2.532
  406   2HG   PRO  56          2HG       PRO  56   4.112  -8.425   3.939
  407   1HD   PRO  56          1HD       PRO  56   4.981  -7.002   1.595
  408   2HD   PRO  56          2HD       PRO  56   4.117  -6.359   3.005
  409    H    HIS  57           H        HIS  57   9.143  -8.886   3.688
  410    HA   HIS  57           HA       HIS  57   9.317  -9.413   0.806
  411   1HB   HIS  57          1HB       HIS  57  10.994  -7.626   1.567
  412   2HB   HIS  57          2HB       HIS  57  11.749  -8.887   2.532
  413    HD1  HIS  57           HD1      HIS  57  13.851  -8.207   0.942
  414    HD2  HIS  57           HD2      HIS  57  10.729 -10.302  -0.853
  415    HE1  HIS  57           HE1      HIS  57  14.793  -9.103  -1.212
  416    H    GLU  58           H        GLU  58   8.138 -10.910   2.856
  417    HA   GLU  58           HA       GLU  58   9.814 -13.292   2.860
  418   1HB   GLU  58          1HB       GLU  58   9.036 -13.609   5.296
  419   2HB   GLU  58          2HB       GLU  58  10.341 -12.478   4.989
  420   1HG   GLU  58          1HG       GLU  58   8.500 -10.689   4.944
  421   2HG   GLU  58          2HG       GLU  58   7.491 -11.918   5.707
  422    H    ALA  59           H        ALA  59   7.448 -12.552   1.347
  423    HA   ALA  59           HA       ALA  59   5.675 -14.707   2.256
  424   1HB   ALA  59          1HB       ALA  59   4.012 -12.902   0.953
  425   2HB   ALA  59          2HB       ALA  59   5.026 -11.910   2.001
  426   3HB   ALA  59          3HB       ALA  59   4.073 -13.229   2.682
  Start of MODEL   42
    1   1H    ARG   1          1H        ARG   1  10.145   4.106  10.570
    2   2H    ARG   1          2H        ARG   1   9.083   5.161  11.413
    3   3H    ARG   1          3H        ARG   1   9.976   5.738  10.063
    4    HA   ARG   1           HA       ARG   1   8.239   3.445   9.692
    5   1HB   ARG   1          1HB       ARG   1   6.828   4.897  11.002
    6   2HB   ARG   1          2HB       ARG   1   7.316   6.299  10.059
    7   1HG   ARG   1          1HG       ARG   1   6.101   5.571   8.168
    8   2HG   ARG   1          2HG       ARG   1   5.858   3.962   8.857
    9   1HD   ARG   1          1HD       ARG   1   4.402   4.828  10.535
   10   2HD   ARG   1          2HD       ARG   1   4.778   6.490  10.081
   11    HE   ARG   1           HE       ARG   1   3.744   5.303   7.813
   12   1HH1  ARG   1          1HH1      ARG   1   2.707   5.739  11.102
   13   2HH1  ARG   1          2HH1      ARG   1   1.048   6.043  10.698
   14   1HH2  ARG   1          1HH2      ARG   1   1.520   5.612   7.258
   15   2HH2  ARG   1          2HH2      ARG   1   0.377   5.988   8.508
   16    H    ILE   2           H        ILE   2   8.558   2.885   7.686
   17    HA   ILE   2           HA       ILE   2   8.415   4.684   5.512
   18    HB   ILE   2           HB       ILE   2  11.108   4.114   6.533
   19   1HG1  ILE   2          1HG1      ILE   2  10.093   6.045   4.439
   20   2HG1  ILE   2          2HG1      ILE   2  10.154   6.367   6.170
   21   1HG2  ILE   2          1HG2      ILE   2  10.824   2.517   4.545
   22   2HG2  ILE   2          2HG2      ILE   2  12.230   3.584   4.577
   23   3HG2  ILE   2          3HG2      ILE   2  10.848   3.981   3.556
   24   1HD1  ILE   2          1HD1      ILE   2  12.025   7.411   5.130
   25   2HD1  ILE   2          2HD1      ILE   2  12.475   5.913   4.316
   26   3HD1  ILE   2          3HD1      ILE   2  12.620   6.044   6.070
   27    HA   PRO   3           HA       PRO   3   9.897  -0.382   4.867
   28   1HB   PRO   3          1HB       PRO   3   7.321  -0.396   6.390
   29   2HB   PRO   3          2HB       PRO   3   8.492  -1.710   6.178
   30   1HG   PRO   3          1HG       PRO   3   8.557   0.123   8.271
   31   2HG   PRO   3          2HG       PRO   3   9.956  -0.812   7.706
   32   1HD   PRO   3          1HD       PRO   3   9.685   2.011   7.597
   33   2HD   PRO   3          2HD       PRO   3  10.909   1.044   6.748
   34    H    VAL   4           H        VAL   4   9.275   1.129   2.812
   35    HA   VAL   4           HA       VAL   4   7.134  -0.390   1.475
   36    HB   VAL   4           HB       VAL   4   7.941   2.499   0.900
   37   1HG1  VAL   4          1HG1      VAL   4   7.377   0.796  -1.043
   38   2HG1  VAL   4          2HG1      VAL   4   6.746   2.442  -1.058
   39   3HG1  VAL   4          3HG1      VAL   4   5.719   1.112  -0.526
   40   1HG2  VAL   4          1HG2      VAL   4   5.464   2.870   1.240
   41   2HG2  VAL   4          2HG2      VAL   4   6.406   2.513   2.688
   42   3HG2  VAL   4          3HG2      VAL   4   5.413   1.256   1.948
   43    H    LYS   5           H        LYS   5   7.857  -1.425  -0.387
   44    HA   LYS   5           HA       LYS   5  10.665  -0.867  -1.055
   45   1HB   LYS   5          1HB       LYS   5   9.413  -3.280  -0.237
   46   2HB   LYS   5          2HB       LYS   5   9.969  -3.484  -1.892
   47   1HG   LYS   5          1HG       LYS   5  11.688  -2.558   0.411
   48   2HG   LYS   5          2HG       LYS   5  11.626  -4.205  -0.222
   49   1HD   LYS   5          1HD       LYS   5  13.482  -3.385  -1.310
   50   2HD   LYS   5          2HD       LYS   5  12.214  -3.060  -2.495
   51   1HE   LYS   5          1HE       LYS   5  12.043  -0.750  -1.424
   52   2HE   LYS   5          2HE       LYS   5  13.550  -1.138  -0.604
   53   1HZ   LYS   5          1HZ       LYS   5  14.671  -0.582  -2.402
   54   2HZ   LYS   5          2HZ       LYS   5  13.227  -0.134  -3.183
   55   3HZ   LYS   5          3HZ       LYS   5  13.831  -1.714  -3.350
   56    H    TYR   6           H        TYR   6   8.733  -3.133  -2.839
   57    HA   TYR   6           HA       TYR   6   9.455  -1.903  -5.296
   58   1HB   TYR   6          1HB       TYR   6   7.445  -4.126  -4.902
   59   2HB   TYR   6          2HB       TYR   6   8.382  -3.758  -6.353
   60    HD1  TYR   6           HD1      TYR   6  11.081  -3.599  -5.756
   61    HD2  TYR   6           HD2      TYR   6   8.181  -5.986  -3.750
   62    HE1  TYR   6           HE1      TYR   6  12.863  -5.097  -4.965
   63    HE2  TYR   6           HE2      TYR   6   9.955  -7.482  -2.957
   64    HH   TYR   6           HH       TYR   6  12.276  -7.541  -2.579
   65    H    GLY   7           H        GLY   7   8.383  -0.751  -6.697
   66   1HA   GLY   7          1HA       GLY   7   6.184  -0.178  -7.671
   67   2HA   GLY   7          2HA       GLY   7   5.630   0.153  -6.046
   68    H    ASN   8           H        ASN   8   5.343   1.976  -7.902
   69    HA   ASN   8           HA       ASN   8   7.416   3.763  -8.349
   70   1HB   ASN   8          1HB       ASN   8   5.775   5.407  -9.050
   71   2HB   ASN   8          2HB       ASN   8   5.445   3.819  -9.719
   72   1HD2  ASN   8          1HD2      ASN   8   3.660   5.995  -9.553
   73   2HD2  ASN   8          2HD2      ASN   8   2.338   5.512  -8.555
   74    H    ALA   9           H        ALA   9   6.001   3.257  -5.381
   75    HA   ALA   9           HA       ALA   9   6.253   5.907  -4.324
   76   1HB   ALA   9          1HB       ALA   9   6.407   3.678  -2.435
   77   2HB   ALA   9          2HB       ALA   9   4.975   3.692  -3.465
   78   3HB   ALA   9          3HB       ALA   9   5.342   5.085  -2.449
   79    H    ASP  10           H        ASP  10   8.283   3.163  -4.771
   80    HA   ASP  10           HA       ASP  10  10.486   2.773  -4.565
   81   1HB   ASP  10          1HB       ASP  10  10.574   5.134  -5.566
   82   2HB   ASP  10          2HB       ASP  10  10.968   5.677  -3.937
   83    H    GLY  11           H        GLY  11  10.583   5.449  -2.245
   84   1HA   GLY  11          1HA       GLY  11  10.896   3.449  -0.132
   85   2HA   GLY  11          2HA       GLY  11  12.093   4.715  -0.325
   86    H    GLU  12           H        GLU  12   8.660   5.318  -0.767
   87    HA   GLU  12           HA       GLU  12   8.751   7.300   1.326
   88   1HB   GLU  12          1HB       GLU  12   6.384   6.324  -0.287
   89   2HB   GLU  12          2HB       GLU  12   6.420   7.753   0.732
   90   1HG   GLU  12          1HG       GLU  12   8.081   7.342  -1.738
   91   2HG   GLU  12          2HG       GLU  12   6.600   8.285  -1.646
   92    H    TYR  13           H        TYR  13   6.497   7.195   2.756
   93    HA   TYR  13           HA       TYR  13   6.684   4.635   4.138
   94   1HB   TYR  13          1HB       TYR  13   5.888   5.756   6.075
   95   2HB   TYR  13          2HB       TYR  13   7.218   6.683   5.416
   96    HD1  TYR  13           HD1      TYR  13   6.479   8.582   3.753
   97    HD2  TYR  13           HD2      TYR  13   4.002   6.819   6.711
   98    HE1  TYR  13           HE1      TYR  13   5.054  10.594   3.736
   99    HE2  TYR  13           HE2      TYR  13   2.559   8.820   6.723
  100    HH   TYR  13           HH       TYR  13   2.511  11.070   6.088
  101    H    CYS  14           H        CYS  14   4.799   3.567   4.862
  102    HA   CYS  14           HA       CYS  14   2.693   3.558   2.976
  103   1HB   CYS  14          1HB       CYS  14   3.105   2.238   5.632
  104   2HB   CYS  14          2HB       CYS  14   1.540   2.144   4.837
  105    H    LYS  15           H        LYS  15   0.784   4.625   2.925
  106    HA   LYS  15           HA       LYS  15   0.347   6.678   4.928
  107   1HB   LYS  15          1HB       LYS  15  -0.177   6.497   2.207
  108   2HB   LYS  15          2HB       LYS  15  -1.773   6.347   2.933
  109   1HG   LYS  15          1HG       LYS  15   0.134   8.570   3.622
  110   2HG   LYS  15          2HG       LYS  15  -1.018   8.677   2.295
  111   1HD   LYS  15          1HD       LYS  15  -2.869   8.402   3.833
  112   2HD   LYS  15          2HD       LYS  15  -1.749   8.166   5.180
  113   1HE   LYS  15          1HE       LYS  15  -0.953  10.418   5.005
  114   2HE   LYS  15          2HE       LYS  15  -1.825  10.673   3.497
  115   1HZ   LYS  15          1HZ       LYS  15  -3.696  11.180   4.590
  116   2HZ   LYS  15          2HZ       LYS  15  -2.711  11.364   5.962
  117   3HZ   LYS  15          3HZ       LYS  15  -3.531   9.898   5.696
  118    H    PHE  16           H        PHE  16  -0.517   6.006   6.786
  119    HA   PHE  16           HA       PHE  16  -2.806   4.154   6.642
  120   1HB   PHE  16          1HB       PHE  16  -0.725   4.451   8.812
  121   2HB   PHE  16          2HB       PHE  16  -2.182   3.485   8.979
  122    HD1  PHE  16           HD1      PHE  16   0.480   2.369   9.414
  123    HD2  PHE  16           HD2      PHE  16  -1.786   2.728   5.834
  124    HE1  PHE  16           HE1      PHE  16   1.657   0.433   8.489
  125    HE2  PHE  16           HE2      PHE  16  -0.617   0.792   4.896
  126    HZ   PHE  16           HZ       PHE  16   1.127  -0.381   6.207
  127    HA   PRO  17           HA       PRO  17  -4.505   3.856   6.907
  128   1HB   PRO  17          1HB       PRO  17  -7.131   4.737   6.707
  129   2HB   PRO  17          2HB       PRO  17  -6.482   3.744   8.013
  130   1HG   PRO  17          1HG       PRO  17  -7.408   6.450   8.169
  131   2HG   PRO  17          2HG       PRO  17  -6.719   5.459   9.464
  132   1HD   PRO  17          1HD       PRO  17  -5.448   7.557   7.825
  133   2HD   PRO  17          2HD       PRO  17  -4.990   6.932   9.423
  134    H    PHE  18           H        PHE  18  -5.107   3.485   4.719
  135    HA   PHE  18           HA       PHE  18  -5.233   5.933   3.098
  136   1HB   PHE  18          1HB       PHE  18  -4.165   4.794   1.255
  137   2HB   PHE  18          2HB       PHE  18  -3.161   4.639   2.689
  138    HD1  PHE  18           HD1      PHE  18  -3.295   2.415   3.981
  139    HD2  PHE  18           HD2      PHE  18  -4.772   2.947   0.026
  140    HE1  PHE  18           HE1      PHE  18  -3.207  -0.011   3.624
  141    HE2  PHE  18           HE2      PHE  18  -4.680   0.517  -0.345
  142    HZ   PHE  18           HZ       PHE  18  -3.899  -0.981   1.457
  143    H    LEU  19           H        LEU  19  -6.529   5.842   1.158
  144    HA   LEU  19           HA       LEU  19  -8.949   4.289   1.646
  145   1HB   LEU  19          1HB       LEU  19  -9.014   6.769   1.337
  146   2HB   LEU  19          2HB       LEU  19  -8.508   6.518  -0.325
  147    HG   LEU  19           HG       LEU  19 -10.592   5.053  -0.566
  148   1HD1  LEU  19          1HD1      LEU  19 -11.441   4.605   1.490
  149   2HD1  LEU  19          2HD1      LEU  19 -12.382   6.045   1.104
  150   3HD1  LEU  19          3HD1      LEU  19 -10.970   6.172   2.151
  151   1HD2  LEU  19          1HD2      LEU  19 -12.067   7.160  -0.691
  152   2HD2  LEU  19          2HD2      LEU  19 -10.631   7.060  -1.720
  153   3HD2  LEU  19          3HD2      LEU  19 -10.598   8.025  -0.238
  154    H    PHE  20           H        PHE  20  -9.216   2.454   0.634
  155    HA   PHE  20           HA       PHE  20  -8.135   2.135  -2.095
  156   1HB   PHE  20          1HB       PHE  20  -7.239   0.555  -0.301
  157   2HB   PHE  20          2HB       PHE  20  -8.877  -0.091  -0.192
  158    HD1  PHE  20           HD1      PHE  20  -7.731  -2.205  -0.655
  159    HD2  PHE  20           HD2      PHE  20  -7.994   0.916  -3.528
  160    HE1  PHE  20           HE1      PHE  20  -7.293  -3.845  -2.432
  161    HE2  PHE  20           HE2      PHE  20  -7.564  -0.719  -5.327
  162    HZ   PHE  20           HZ       PHE  20  -7.222  -3.103  -4.784
  163    H    ASN  21           H        ASN  21  -9.837   2.822  -3.265
  164    HA   ASN  21           HA       ASN  21 -11.876   2.899  -4.259
  165   1HB   ASN  21          1HB       ASN  21 -11.734   0.012  -3.455
  166   2HB   ASN  21          2HB       ASN  21 -13.139   0.658  -4.299
  167   1HD2  ASN  21          1HD2      ASN  21 -13.078   0.433  -6.411
  168   2HD2  ASN  21          2HD2      ASN  21 -11.656   0.376  -7.391
  169    H    GLY  22           H        GLY  22 -11.734   3.312  -1.184
  170   1HA   GLY  22          1HA       GLY  22 -13.743   4.444  -0.271
  171   2HA   GLY  22          2HA       GLY  22 -14.644   3.032  -0.785
  172    H    LYS  23           H        LYS  23 -11.810   1.847   0.357
  173    HA   LYS  23           HA       LYS  23 -12.883   1.640   3.093
  174   1HB   LYS  23          1HB       LYS  23 -12.997  -0.467   1.709
  175   2HB   LYS  23          2HB       LYS  23 -11.241  -0.459   1.668
  176   1HG   LYS  23          1HG       LYS  23 -11.154  -0.701   4.079
  177   2HG   LYS  23          2HG       LYS  23 -12.917  -0.628   4.172
  178   1HD   LYS  23          1HD       LYS  23 -13.045  -2.641   2.766
  179   2HD   LYS  23          2HD       LYS  23 -11.281  -2.725   2.757
  180   1HE   LYS  23          1HE       LYS  23 -11.275  -2.985   5.185
  181   2HE   LYS  23          2HE       LYS  23 -13.036  -2.877   5.207
  182   1HZ   LYS  23          1HZ       LYS  23 -11.416  -5.140   4.751
  183   2HZ   LYS  23          2HZ       LYS  23 -12.387  -4.863   3.379
  184   3HZ   LYS  23          3HZ       LYS  23 -13.109  -5.057   4.903
  185    H    GLU  24           H        GLU  24 -11.503   2.007   4.768
  186    HA   GLU  24           HA       GLU  24  -8.836   2.956   4.016
  187   1HB   GLU  24          1HB       GLU  24 -10.392   3.424   6.562
  188   2HB   GLU  24          2HB       GLU  24  -8.834   4.132   6.168
  189   1HG   GLU  24          1HG       GLU  24  -9.838   5.307   4.294
  190   2HG   GLU  24          2HG       GLU  24 -11.400   4.583   4.665
  191    H    TYR  25           H        TYR  25  -7.072   1.921   4.552
  192    HA   TYR  25           HA       TYR  25  -7.266  -0.331   6.431
  193   1HB   TYR  25          1HB       TYR  25  -5.368   0.159   4.155
  194   2HB   TYR  25          2HB       TYR  25  -5.250  -1.211   5.243
  195    HD1  TYR  25           HD1      TYR  25  -7.483  -2.633   5.452
  196    HD2  TYR  25           HD2      TYR  25  -6.505  -0.096   2.179
  197    HE1  TYR  25           HE1      TYR  25  -9.072  -3.865   4.021
  198    HE2  TYR  25           HE2      TYR  25  -8.086  -1.326   0.739
  199    HH   TYR  25           HH       TYR  25  -9.307  -4.292   1.472
  200    H    ASN  26           H        ASN  26  -6.073  -0.357   8.227
  201    HA   ASN  26           HA       ASN  26  -4.373   1.951   8.781
  202   1HB   ASN  26          1HB       ASN  26  -5.320  -0.285  10.601
  203   2HB   ASN  26          2HB       ASN  26  -4.340   1.082  11.117
  204   1HD2  ASN  26          1HD2      ASN  26  -6.378   2.243   8.814
  205   2HD2  ASN  26          2HD2      ASN  26  -7.674   2.787   9.822
  206    H    SER  27           H        SER  27  -3.991  -0.988   7.434
  207    HA   SER  27           HA       SER  27  -1.144  -0.988   7.934
  208   1HB   SER  27          1HB       SER  27  -1.167  -3.454   8.455
  209   2HB   SER  27          2HB       SER  27  -1.865  -2.440   9.719
  210    HG   SER  27           HG       SER  27  -3.439  -3.852   9.518
  211    H    CYS  28           H        CYS  28  -0.350  -3.194   6.685
  212    HA   CYS  28           HA       CYS  28  -0.980  -2.627   3.947
  213   1HB   CYS  28          1HB       CYS  28   0.691  -4.849   5.151
  214   2HB   CYS  28          2HB       CYS  28   0.619  -4.439   3.441
  215    H    THR  29           H        THR  29  -2.358  -3.705   2.603
  216    HA   THR  29           HA       THR  29  -3.690  -6.084   3.689
  217    HB   THR  29           HB       THR  29  -5.153  -4.087   3.572
  218    HG1  THR  29           HG1      THR  29  -6.352  -5.828   3.385
  219   1HG2  THR  29          1HG2      THR  29  -5.776  -2.986   1.648
  220   2HG2  THR  29          2HG2      THR  29  -5.174  -4.261   0.590
  221   3HG2  THR  29          3HG2      THR  29  -4.040  -3.190   1.412
  222    H    ASP  30           H        ASP  30  -4.462  -7.646   2.022
  223    HA   ASP  30           HA       ASP  30  -2.562  -7.731  -0.194
  224   1HB   ASP  30          1HB       ASP  30  -4.156 -10.096   0.088
  225   2HB   ASP  30          2HB       ASP  30  -2.427  -9.957   0.049
  226    H    THR  31           H        THR  31  -5.481  -6.619   0.388
  227    HA   THR  31           HA       THR  31  -7.242  -7.747  -1.472
  228    HB   THR  31           HB       THR  31  -7.157  -4.866  -0.585
  229    HG1  THR  31           HG1      THR  31  -7.215  -5.916   1.306
  230   1HG2  THR  31          1HG2      THR  31  -8.880  -5.892  -2.361
  231   2HG2  THR  31          2HG2      THR  31  -9.298  -4.610  -1.222
  232   3HG2  THR  31          3HG2      THR  31  -9.722  -6.287  -0.865
  233    H    GLY  32           H        GLY  32  -7.644  -7.373  -3.625
  234   1HA   GLY  32          1HA       GLY  32  -7.445  -6.322  -5.705
  235   2HA   GLY  32          2HA       GLY  32  -6.254  -5.234  -5.009
  236    H    ARG  33           H        ARG  33  -4.915  -7.626  -3.804
  237    HA   ARG  33           HA       ARG  33  -3.276  -8.335  -6.123
  238   1HB   ARG  33          1HB       ARG  33  -2.802  -8.641  -3.144
  239   2HB   ARG  33          2HB       ARG  33  -1.667  -9.125  -4.382
  240   1HG   ARG  33          1HG       ARG  33  -2.619  -6.311  -3.930
  241   2HG   ARG  33          2HG       ARG  33  -1.102  -6.975  -3.327
  242   1HD   ARG  33          1HD       ARG  33  -1.911  -6.625  -6.211
  243   2HD   ARG  33          2HD       ARG  33  -0.702  -5.691  -5.338
  244    HE   ARG  33           HE       ARG  33  -0.035  -8.442  -5.292
  245   1HH1  ARG  33          1HH1      ARG  33  -0.077  -5.663  -7.409
  246   2HH1  ARG  33          2HH1      ARG  33   1.173  -6.275  -8.442
  247   1HH2  ARG  33          1HH2      ARG  33   1.570  -9.268  -6.652
  248   2HH2  ARG  33          2HH2      ARG  33   2.123  -8.327  -8.006
  249    H    SER  34           H        SER  34  -2.442 -10.652  -6.097
  250    HA   SER  34           HA       SER  34  -4.507 -12.491  -5.085
  251   1HB   SER  34          1HB       SER  34  -3.167 -12.669  -7.798
  252   2HB   SER  34          2HB       SER  34  -4.354 -13.800  -7.152
  253    HG   SER  34           HG       SER  34  -5.486 -11.476  -6.924
  254    H    ASP  35           H        ASP  35  -1.299 -11.634  -5.131
  255    HA   ASP  35           HA       ASP  35  -0.260 -14.288  -4.802
  256   1HB   ASP  35          1HB       ASP  35   1.597 -12.171  -4.279
  257   2HB   ASP  35          2HB       ASP  35   1.698 -13.430  -5.471
  258    H    GLY  36           H        GLY  36  -1.825 -12.291  -2.870
  259   1HA   GLY  36          1HA       GLY  36  -2.066 -12.146  -0.590
  260   2HA   GLY  36          2HA       GLY  36  -0.961 -13.508  -0.471
  261    H    PHE  37           H        PHE  37  -0.002 -10.604  -2.132
  262    HA   PHE  37           HA       PHE  37   2.065 -10.200  -0.123
  263   1HB   PHE  37          1HB       PHE  37   1.694  -9.180  -2.927
  264   2HB   PHE  37          2HB       PHE  37   2.871  -8.449  -1.844
  265    HD1  PHE  37           HD1      PHE  37   3.897 -10.773  -0.401
  266    HD2  PHE  37           HD2      PHE  37   2.953 -10.298  -4.522
  267    HE1  PHE  37           HE1      PHE  37   5.542 -12.506  -0.967
  268    HE2  PHE  37           HE2      PHE  37   4.595 -12.039  -5.099
  269    HZ   PHE  37           HZ       PHE  37   5.893 -13.145  -3.324
  270    H    LEU  38           H        LEU  38   2.330  -8.452   1.092
  271    HA   LEU  38           HA       LEU  38   0.029  -6.802   1.574
  272   1HB   LEU  38          1HB       LEU  38   2.774  -6.773   2.781
  273   2HB   LEU  38          2HB       LEU  38   1.417  -5.850   3.371
  274    HG   LEU  38           HG       LEU  38   1.518  -8.867   3.304
  275   1HD1  LEU  38          1HD1      LEU  38   2.514  -6.887   5.217
  276   2HD1  LEU  38          2HD1      LEU  38   2.930  -8.588   5.019
  277   3HD1  LEU  38          3HD1      LEU  38   1.481  -8.135   5.916
  278   1HD2  LEU  38          1HD2      LEU  38  -0.727  -8.346   3.307
  279   2HD2  LEU  38          2HD2      LEU  38  -0.488  -6.842   4.198
  280   3HD2  LEU  38          3HD2      LEU  38  -0.373  -8.391   5.035
  281    H    TRP  39           H        TRP  39  -0.336  -4.801   0.822
  282    HA   TRP  39           HA       TRP  39   1.950  -3.198  -0.053
  283   1HB   TRP  39          1HB       TRP  39   0.881  -2.497  -2.100
  284   2HB   TRP  39          2HB       TRP  39   0.963  -4.250  -2.088
  285    HD1  TRP  39           HD1      TRP  39  -1.413  -5.561  -1.627
  286    HE1  TRP  39           HE1      TRP  39  -3.816  -4.859  -2.202
  287    HE3  TRP  39           HE3      TRP  39  -0.675  -0.543  -2.269
  288    HZ2  TRP  39           HZ2      TRP  39  -5.213  -2.490  -2.842
  289    HZ3  TRP  39           HZ3      TRP  39  -2.602   0.866  -2.867
  290    HH2  TRP  39           HH2      TRP  39  -4.821  -0.093  -3.137
  291    H    CYS  40           H        CYS  40   1.181  -0.891  -0.524
  292    HA   CYS  40           HA       CYS  40  -1.149  -0.026   0.956
  293   1HB   CYS  40          1HB       CYS  40   0.048   1.306   2.582
  294   2HB   CYS  40          2HB       CYS  40   0.627  -0.352   2.707
  295    H    SER  41           H        SER  41  -1.443   2.346   0.724
  296    HA   SER  41           HA       SER  41  -0.226   3.236  -1.784
  297   1HB   SER  41          1HB       SER  41  -2.735   3.271  -1.539
  298   2HB   SER  41          2HB       SER  41  -2.537   4.517  -0.308
  299    HG   SER  41           HG       SER  41  -1.498   4.765  -2.937
  300    H    THR  42           H        THR  42   0.344   5.564  -1.913
  301    HA   THR  42           HA       THR  42   1.641   6.420   0.589
  302    HB   THR  42           HB       THR  42   2.477   7.146  -2.221
  303    HG1  THR  42           HG1      THR  42   3.328   4.980  -0.592
  304   1HG2  THR  42          1HG2      THR  42   4.412   6.926  -0.003
  305   2HG2  THR  42          2HG2      THR  42   3.316   8.310   0.022
  306   3HG2  THR  42          3HG2      THR  42   4.362   8.037  -1.373
  307    H    THR  43           H        THR  43  -0.475   7.303  -1.987
  308    HA   THR  43           HA       THR  43  -0.528  10.100  -1.107
  309    HB   THR  43           HB       THR  43  -1.920  10.348  -3.233
  310    HG1  THR  43           HG1      THR  43  -2.505   8.294  -3.709
  311   1HG2  THR  43          1HG2      THR  43   0.862   9.300  -3.674
  312   2HG2  THR  43          2HG2      THR  43   0.495  10.927  -3.099
  313   3HG2  THR  43          3HG2      THR  43  -0.048  10.407  -4.694
  314    H    TYR  44           H        TYR  44  -1.828   7.745   0.264
  315    HA   TYR  44           HA       TYR  44  -3.704   7.359   1.477
  316   1HB   TYR  44          1HB       TYR  44  -3.772   9.727   1.967
  317   2HB   TYR  44          2HB       TYR  44  -4.537  10.073   0.416
  318    HD1  TYR  44           HD1      TYR  44  -5.182   7.808   3.358
  319    HD2  TYR  44           HD2      TYR  44  -6.781  10.568   0.539
  320    HE1  TYR  44           HE1      TYR  44  -7.396   7.587   4.403
  321    HE2  TYR  44           HE2      TYR  44  -8.997  10.353   1.576
  322    HH   TYR  44           HH       TYR  44 -10.207   8.556   2.979
  323    H    ASN  45           H        ASN  45  -5.153   9.105  -1.274
  324    HA   ASN  45           HA       ASN  45  -6.971   6.904  -1.707
  325   1HB   ASN  45          1HB       ASN  45  -7.631   9.349  -1.916
  326   2HB   ASN  45          2HB       ASN  45  -6.660   9.416  -3.365
  327   1HD2  ASN  45          1HD2      ASN  45  -7.722   6.509  -3.828
  328   2HD2  ASN  45          2HD2      ASN  45  -9.238   6.874  -4.496
  329    H    PHE  46           H        PHE  46  -6.206   5.169  -2.782
  330    HA   PHE  46           HA       PHE  46  -3.922   5.198  -4.451
  331   1HB   PHE  46          1HB       PHE  46  -4.736   3.210  -3.193
  332   2HB   PHE  46          2HB       PHE  46  -6.117   3.104  -4.309
  333    HD1  PHE  46           HD1      PHE  46  -2.391   3.546  -4.672
  334    HD2  PHE  46           HD2      PHE  46  -5.877   1.381  -5.824
  335    HE1  PHE  46           HE1      PHE  46  -1.046   2.186  -6.199
  336    HE2  PHE  46           HE2      PHE  46  -4.525   0.020  -7.354
  337    HZ   PHE  46           HZ       PHE  46  -2.115   0.413  -7.548
  338    H    GLU  47           H        GLU  47  -7.353   5.392  -5.108
  339    HA   GLU  47           HA       GLU  47  -7.285   5.009  -7.898
  340   1HB   GLU  47          1HB       GLU  47  -9.291   4.965  -6.363
  341   2HB   GLU  47          2HB       GLU  47  -9.225   6.715  -6.338
  342   1HG   GLU  47          1HG       GLU  47  -9.573   6.752  -8.765
  343   2HG   GLU  47          2HG       GLU  47  -9.697   4.990  -8.756
  344    H    LYS  48           H        LYS  48  -7.007   7.856  -5.871
  345    HA   LYS  48           HA       LYS  48  -7.171   9.816  -7.846
  346   1HB   LYS  48          1HB       LYS  48  -7.454  10.506  -5.608
  347   2HB   LYS  48          2HB       LYS  48  -5.967   9.737  -5.087
  348   1HG   LYS  48          1HG       LYS  48  -4.651  11.488  -6.136
  349   2HG   LYS  48          2HG       LYS  48  -6.111  12.251  -6.776
  350   1HD   LYS  48          1HD       LYS  48  -6.920  12.647  -4.515
  351   2HD   LYS  48          2HD       LYS  48  -5.502  11.835  -3.851
  352   1HE   LYS  48          1HE       LYS  48  -5.401  14.309  -5.574
  353   2HE   LYS  48          2HE       LYS  48  -5.364  14.317  -3.809
  354   1HZ   LYS  48          1HZ       LYS  48  -3.292  13.263  -3.778
  355   2HZ   LYS  48          2HZ       LYS  48  -3.155  14.425  -5.009
  356   3HZ   LYS  48          3HZ       LYS  48  -3.393  12.790  -5.407
  357    H    ASP  49           H        ASP  49  -4.113   8.947  -6.170
  358    HA   ASP  49           HA       ASP  49  -2.647   9.922  -8.492
  359   1HB   ASP  49          1HB       ASP  49  -1.938   9.376  -5.651
  360   2HB   ASP  49          2HB       ASP  49  -0.654   9.317  -6.854
  361    H    GLY  50           H        GLY  50  -2.604   6.973  -6.482
  362   1HA   GLY  50          1HA       GLY  50  -2.614   4.810  -7.495
  363   2HA   GLY  50          2HA       GLY  50  -1.837   5.514  -8.901
  364    H    LYS  51           H        LYS  51  -0.533   6.560  -5.921
  365    HA   LYS  51           HA       LYS  51   1.920   5.164  -6.471
  366   1HB   LYS  51          1HB       LYS  51   1.090   7.188  -4.426
  367   2HB   LYS  51          2HB       LYS  51   2.590   6.302  -4.229
  368   1HG   LYS  51          1HG       LYS  51   3.182   8.310  -5.248
  369   2HG   LYS  51          2HG       LYS  51   3.203   7.118  -6.544
  370   1HD   LYS  51          1HD       LYS  51   1.019   7.895  -7.306
  371   2HD   LYS  51          2HD       LYS  51   0.955   9.048  -5.968
  372   1HE   LYS  51          1HE       LYS  51   3.003  10.130  -6.872
  373   2HE   LYS  51          2HE       LYS  51   2.940   9.021  -8.237
  374   1HZ   LYS  51          1HZ       LYS  51   1.004  10.010  -9.054
  375   2HZ   LYS  51          2HZ       LYS  51   1.943  11.332  -8.536
  376   3HZ   LYS  51          3HZ       LYS  51   0.656  10.789  -7.579
  377    H    TYR  52           H        TYR  52   2.498   3.274  -5.704
  378    HA   TYR  52           HA       TYR  52   1.382   2.333  -3.174
  379   1HB   TYR  52          1HB       TYR  52   0.755   0.193  -4.106
  380   2HB   TYR  52          2HB       TYR  52  -0.051   1.460  -5.022
  381    HD1  TYR  52           HD1      TYR  52   2.688  -1.029  -5.107
  382    HD2  TYR  52           HD2      TYR  52   0.399   1.768  -7.357
  383    HE1  TYR  52           HE1      TYR  52   3.631  -1.941  -7.180
  384    HE2  TYR  52           HE2      TYR  52   1.334   0.858  -9.443
  385    HH   TYR  52           HH       TYR  52   2.462  -1.741  -9.997
  386    H    GLY  53           H        GLY  53   2.486   0.408  -2.392
  387   1HA   GLY  53          1HA       GLY  53   5.005  -0.339  -3.538
  388   2HA   GLY  53          2HA       GLY  53   5.168   0.643  -2.089
  389    H    PHE  54           H        PHE  54   5.863  -2.154  -2.572
  390    HA   PHE  54           HA       PHE  54   3.923  -3.585  -0.978
  391   1HB   PHE  54          1HB       PHE  54   6.436  -4.523  -2.342
  392   2HB   PHE  54          2HB       PHE  54   5.354  -5.572  -1.443
  393    HD1  PHE  54           HD1      PHE  54   5.753  -6.526  -3.973
  394    HD2  PHE  54           HD2      PHE  54   3.245  -3.274  -2.864
  395    HE1  PHE  54           HE1      PHE  54   4.415  -6.860  -6.003
  396    HE2  PHE  54           HE2      PHE  54   1.907  -3.605  -4.890
  397    HZ   PHE  54           HZ       PHE  54   2.489  -5.402  -6.464
  398    H    CYS  55           H        CYS  55   4.138  -4.169   1.058
  399    HA   CYS  55           HA       CYS  55   6.602  -3.400   2.465
  400   1HB   CYS  55          1HB       CYS  55   4.740  -3.696   4.440
  401   2HB   CYS  55          2HB       CYS  55   5.092  -2.169   3.639
  402    HA   PRO  56           HA       PRO  56   6.556  -7.957   2.777
  403   1HB   PRO  56          1HB       PRO  56   9.167  -8.349   2.360
  404   2HB   PRO  56          2HB       PRO  56   8.050  -8.019   1.034
  405   1HG   PRO  56          1HG       PRO  56  10.028  -6.213   2.338
  406   2HG   PRO  56          2HG       PRO  56   9.510  -6.278   0.647
  407   1HD   PRO  56          1HD       PRO  56   8.599  -4.464   2.577
  408   2HD   PRO  56          2HD       PRO  56   7.837  -4.783   1.012
  409    H    HIS  57           H        HIS  57   7.211  -5.663   4.828
  410    HA   HIS  57           HA       HIS  57   8.218  -5.366   6.853
  411   1HB   HIS  57          1HB       HIS  57   7.362  -7.064   8.533
  412   2HB   HIS  57          2HB       HIS  57   6.156  -6.227   7.577
  413    HD1  HIS  57           HD1      HIS  57   5.251  -7.729   5.434
  414    HD2  HIS  57           HD2      HIS  57   7.045  -9.753   8.593
  415    HE1  HIS  57           HE1      HIS  57   4.501 -10.125   5.221
  416    H    GLU  58           H        GLU  58   8.653  -8.031   8.471
  417    HA   GLU  58           HA       GLU  58  11.480  -8.174   7.751
  418   1HB   GLU  58          1HB       GLU  58  11.830  -9.001  10.033
  419   2HB   GLU  58          2HB       GLU  58  11.035  -7.439  10.023
  420   1HG   GLU  58          1HG       GLU  58   8.855  -8.675  10.309
  421   2HG   GLU  58          2HG       GLU  58   9.818 -10.127  10.598
  422    H    ALA  59           H        ALA  59  12.539 -10.090   7.465
  423    HA   ALA  59           HA       ALA  59  10.912 -12.533   7.385
  424   1HB   ALA  59          1HB       ALA  59  12.932 -12.626   5.362
  425   2HB   ALA  59          2HB       ALA  59  11.946 -11.179   5.141
  426   3HB   ALA  59          3HB       ALA  59  11.185 -12.771   5.191
  Start of MODEL   43
    1   1H    ARG   1          1H        ARG   1   5.453  -0.405  11.157
    2   2H    ARG   1          2H        ARG   1   4.924  -1.594  10.038
    3   3H    ARG   1          3H        ARG   1   3.783  -0.552  10.788
    4    HA   ARG   1           HA       ARG   1   4.111   0.165   8.602
    5   1HB   ARG   1          1HB       ARG   1   3.991   1.773  10.595
    6   2HB   ARG   1          2HB       ARG   1   5.723   1.984  10.392
    7   1HG   ARG   1          1HG       ARG   1   5.459   2.997   8.276
    8   2HG   ARG   1          2HG       ARG   1   3.766   2.490   8.163
    9   1HD   ARG   1          1HD       ARG   1   3.399   3.895  10.259
   10   2HD   ARG   1          2HD       ARG   1   4.992   4.576   9.937
   11    HE   ARG   1           HE       ARG   1   3.542   4.815   7.590
   12   1HH1  ARG   1          1HH1      ARG   1   3.411   5.990  10.875
   13   2HH1  ARG   1          2HH1      ARG   1   2.535   7.428  10.463
   14   1HH2  ARG   1          1HH2      ARG   1   2.445   6.711   7.038
   15   2HH2  ARG   1          2HH2      ARG   1   1.979   7.838   8.272
   16    H    ILE   2           H        ILE   2   5.509   0.837   6.921
   17    HA   ILE   2           HA       ILE   2   8.356   0.382   7.248
   18    HB   ILE   2           HB       ILE   2   7.306  -1.828   6.599
   19   1HG1  ILE   2          1HG1      ILE   2   9.224  -0.604   4.614
   20   2HG1  ILE   2          2HG1      ILE   2   9.668  -1.379   6.130
   21   1HG2  ILE   2          1HG2      ILE   2   6.996  -0.796   3.825
   22   2HG2  ILE   2          2HG2      ILE   2   5.680  -0.576   4.977
   23   3HG2  ILE   2          3HG2      ILE   2   6.255  -2.198   4.592
   24   1HD1  ILE   2          1HD1      ILE   2   9.006  -3.511   5.316
   25   2HD1  ILE   2          2HD1      ILE   2  10.009  -2.763   4.075
   26   3HD1  ILE   2          3HD1      ILE   2   8.256  -2.805   3.888
   27    HA   PRO   3           HA       PRO   3   8.461   3.911   4.560
   28   1HB   PRO   3          1HB       PRO   3  10.954   3.687   3.521
   29   2HB   PRO   3          2HB       PRO   3  10.645   4.192   5.189
   30   1HG   PRO   3          1HG       PRO   3  11.365   1.474   4.139
   31   2HG   PRO   3          2HG       PRO   3  12.048   2.359   5.522
   32   1HD   PRO   3          1HD       PRO   3  10.194   0.451   5.898
   33   2HD   PRO   3          2HD       PRO   3  10.203   1.929   6.881
   34    H    VAL   4           H        VAL   4   7.972   0.926   3.459
   35    HA   VAL   4           HA       VAL   4   7.194   0.072   1.494
   36    HB   VAL   4           HB       VAL   4   7.784   2.785   0.233
   37   1HG1  VAL   4          1HG1      VAL   4   7.575   0.965  -1.386
   38   2HG1  VAL   4          2HG1      VAL   4   6.204   2.071  -1.487
   39   3HG1  VAL   4          3HG1      VAL   4   6.023   0.508  -0.686
   40   1HG2  VAL   4          1HG2      VAL   4   4.995   2.279   0.609
   41   2HG2  VAL   4          2HG2      VAL   4   5.980   3.599   1.245
   42   3HG2  VAL   4          3HG2      VAL   4   5.822   2.093   2.156
   43    H    LYS   5           H        LYS   5   8.111  -1.044  -0.251
   44    HA   LYS   5           HA       LYS   5  11.009  -0.610  -0.486
   45   1HB   LYS   5          1HB       LYS   5   9.433  -3.000   0.056
   46   2HB   LYS   5          2HB       LYS   5  10.571  -3.228  -1.264
   47   1HG   LYS   5          1HG       LYS   5  11.242  -2.307   1.529
   48   2HG   LYS   5          2HG       LYS   5  11.530  -3.916   0.845
   49   1HD   LYS   5          1HD       LYS   5  13.155  -3.117  -0.648
   50   2HD   LYS   5          2HD       LYS   5  12.696  -1.433  -0.378
   51   1HE   LYS   5          1HE       LYS   5  13.543  -1.544   1.903
   52   2HE   LYS   5          2HE       LYS   5  13.932  -3.255   1.696
   53   1HZ   LYS   5          1HZ       LYS   5  15.689  -2.781   0.296
   54   2HZ   LYS   5          2HZ       LYS   5  15.785  -1.516   1.421
   55   3HZ   LYS   5          3HZ       LYS   5  15.104  -1.237  -0.114
   56    H    TYR   6           H        TYR   6   9.209  -2.899  -2.404
   57    HA   TYR   6           HA       TYR   6  10.209  -1.600  -4.788
   58   1HB   TYR   6          1HB       TYR   6   8.606  -4.152  -4.669
   59   2HB   TYR   6          2HB       TYR   6   9.694  -3.609  -5.944
   60    HD1  TYR   6           HD1      TYR   6   9.569  -4.989  -2.514
   61    HD2  TYR   6           HD2      TYR   6  12.067  -3.941  -5.799
   62    HE1  TYR   6           HE1      TYR   6  11.428  -6.197  -1.475
   63    HE2  TYR   6           HE2      TYR   6  13.927  -5.153  -4.767
   64    HH   TYR   6           HH       TYR   6  13.635  -6.609  -1.560
   65    H    GLY   7           H        GLY   7   9.012  -0.918  -6.510
   66   1HA   GLY   7          1HA       GLY   7   6.717  -0.897  -7.518
   67   2HA   GLY   7          2HA       GLY   7   6.166  -0.285  -5.976
   68    H    ASN   8           H        ASN   8   5.551   1.168  -8.015
   69    HA   ASN   8           HA       ASN   8   7.390   2.997  -9.011
   70   1HB   ASN   8          1HB       ASN   8   5.576   4.292  -9.848
   71   2HB   ASN   8          2HB       ASN   8   5.173   2.592 -10.010
   72   1HD2  ASN   8          1HD2      ASN   8   3.364   4.660 -10.153
   73   2HD2  ASN   8          2HD2      ASN   8   2.264   4.525  -8.829
   74    H    ALA   9           H        ALA   9   6.395   2.882  -5.841
   75    HA   ALA   9           HA       ALA   9   6.384   5.672  -5.236
   76   1HB   ALA   9          1HB       ALA   9   7.097   3.835  -3.061
   77   2HB   ALA   9          2HB       ALA   9   5.565   3.488  -3.864
   78   3HB   ALA   9          3HB       ALA   9   5.843   5.072  -3.139
   79    H    ASP  10           H        ASP  10   7.989   6.348  -3.365
   80    HA   ASP  10           HA       ASP  10  10.699   5.827  -4.392
   81   1HB   ASP  10          1HB       ASP  10   9.746   8.203  -4.466
   82   2HB   ASP  10          2HB       ASP  10   9.871   8.199  -2.708
   83    H    GLY  11           H        GLY  11  10.062   7.378  -1.342
   84   1HA   GLY  11          1HA       GLY  11  10.730   4.950   0.106
   85   2HA   GLY  11          2HA       GLY  11  11.809   6.323   0.276
   86    H    GLU  12           H        GLU  12   8.358   6.809  -0.058
   87    HA   GLU  12           HA       GLU  12   8.308   7.948   2.628
   88   1HB   GLU  12          1HB       GLU  12   6.058   7.840   0.607
   89   2HB   GLU  12          2HB       GLU  12   6.147   8.849   2.036
   90   1HG   GLU  12          1HG       GLU  12   7.919   9.091  -0.382
   91   2HG   GLU  12          2HG       GLU  12   6.527  10.114  -0.014
   92    H    TYR  13           H        TYR  13   7.318   6.936   4.363
   93    HA   TYR  13           HA       TYR  13   6.685   4.230   4.137
   94   1HB   TYR  13          1HB       TYR  13   5.707   4.561   6.467
   95   2HB   TYR  13          2HB       TYR  13   7.428   4.796   6.229
   96    HD1  TYR  13           HD1      TYR  13   4.415   6.947   5.764
   97    HD2  TYR  13           HD2      TYR  13   8.231   6.424   7.542
   98    HE1  TYR  13           HE1      TYR  13   4.225   9.176   6.798
   99    HE2  TYR  13           HE2      TYR  13   8.070   8.650   8.578
  100    HH   TYR  13           HH       TYR  13   5.517  10.214   9.148
  101    H    CYS  14           H        CYS  14   4.704   3.171   4.712
  102    HA   CYS  14           HA       CYS  14   2.643   3.711   2.983
  103   1HB   CYS  14          1HB       CYS  14   2.469   2.269   5.634
  104   2HB   CYS  14          2HB       CYS  14   1.296   2.150   4.331
  105    H    LYS  15           H        LYS  15   0.719   4.738   3.060
  106    HA   LYS  15           HA       LYS  15   0.429   6.844   5.054
  107   1HB   LYS  15          1HB       LYS  15  -0.018   6.794   2.380
  108   2HB   LYS  15          2HB       LYS  15  -1.632   6.419   2.963
  109   1HG   LYS  15          1HG       LYS  15  -0.011   8.869   3.652
  110   2HG   LYS  15          2HG       LYS  15  -1.404   8.795   2.571
  111   1HD   LYS  15          1HD       LYS  15  -2.801   8.078   4.481
  112   2HD   LYS  15          2HD       LYS  15  -1.400   8.241   5.542
  113   1HE   LYS  15          1HE       LYS  15  -2.741  10.432   3.968
  114   2HE   LYS  15          2HE       LYS  15  -2.784  10.214   5.717
  115   1HZ   LYS  15          1HZ       LYS  15  -0.174  10.492   4.398
  116   2HZ   LYS  15          2HZ       LYS  15  -0.654  10.962   5.958
  117   3HZ   LYS  15          3HZ       LYS  15  -1.125  11.884   4.610
  118    H    PHE  16           H        PHE  16  -0.497   6.219   6.914
  119    HA   PHE  16           HA       PHE  16  -2.796   4.382   6.768
  120   1HB   PHE  16          1HB       PHE  16  -0.744   4.735   8.955
  121   2HB   PHE  16          2HB       PHE  16  -2.220   3.801   9.147
  122    HD1  PHE  16           HD1      PHE  16   0.541   2.718   9.515
  123    HD2  PHE  16           HD2      PHE  16  -1.978   2.886   6.098
  124    HE1  PHE  16           HE1      PHE  16   1.655   0.734   8.614
  125    HE2  PHE  16           HE2      PHE  16  -0.878   0.897   5.178
  126    HZ   PHE  16           HZ       PHE  16   0.963  -0.202   6.425
  127    HA   PRO  17           HA       PRO  17  -4.433   4.045   6.998
  128   1HB   PRO  17          1HB       PRO  17  -7.094   4.696   6.819
  129   2HB   PRO  17          2HB       PRO  17  -6.357   3.888   8.204
  130   1HG   PRO  17          1HG       PRO  17  -7.453   6.563   8.064
  131   2HG   PRO  17          2HG       PRO  17  -6.825   5.707   9.481
  132   1HD   PRO  17          1HD       PRO  17  -5.526   7.733   7.796
  133   2HD   PRO  17          2HD       PRO  17  -5.090   7.178   9.425
  134    H    PHE  18           H        PHE  18  -4.951   3.592   4.826
  135    HA   PHE  18           HA       PHE  18  -5.146   5.992   3.148
  136   1HB   PHE  18          1HB       PHE  18  -4.232   4.703   1.297
  137   2HB   PHE  18          2HB       PHE  18  -3.147   4.662   2.675
  138    HD1  PHE  18           HD1      PHE  18  -3.016   2.579   4.053
  139    HD2  PHE  18           HD2      PHE  18  -5.096   2.751   0.345
  140    HE1  PHE  18           HE1      PHE  18  -2.911   0.131   3.885
  141    HE2  PHE  18           HE2      PHE  18  -4.995   0.305   0.164
  142    HZ   PHE  18           HZ       PHE  18  -3.899  -1.030   1.935
  143    H    LEU  19           H        LEU  19  -6.427   5.804   1.162
  144    HA   LEU  19           HA       LEU  19  -8.945   4.480   1.809
  145   1HB   LEU  19          1HB       LEU  19  -8.800   6.946   1.291
  146   2HB   LEU  19          2HB       LEU  19  -8.413   6.498  -0.358
  147    HG   LEU  19           HG       LEU  19 -10.603   5.257  -0.448
  148   1HD1  LEU  19          1HD1      LEU  19 -10.899   6.581   2.229
  149   2HD1  LEU  19          2HD1      LEU  19 -11.203   4.904   1.784
  150   3HD1  LEU  19          3HD1      LEU  19 -12.294   6.172   1.236
  151   1HD2  LEU  19          1HD2      LEU  19 -11.932   7.335  -0.697
  152   2HD2  LEU  19          2HD2      LEU  19 -10.378   7.374  -1.527
  153   3HD2  LEU  19          3HD2      LEU  19 -10.582   8.231  -0.001
  154    H    PHE  20           H        PHE  20  -9.454   2.632   0.905
  155    HA   PHE  20           HA       PHE  20  -8.690   2.121  -1.896
  156   1HB   PHE  20          1HB       PHE  20  -7.305   0.811  -0.066
  157   2HB   PHE  20          2HB       PHE  20  -8.811  -0.080   0.112
  158    HD1  PHE  20           HD1      PHE  20  -7.133   1.175  -2.968
  159    HD2  PHE  20           HD2      PHE  20  -8.541  -2.135  -0.705
  160    HE1  PHE  20           HE1      PHE  20  -6.562  -0.352  -4.821
  161    HE2  PHE  20           HE2      PHE  20  -7.989  -3.668  -2.542
  162    HZ   PHE  20           HZ       PHE  20  -6.999  -2.763  -4.621
  163    H    ASN  21           H        ASN  21 -10.633   2.197  -2.878
  164    HA   ASN  21           HA       ASN  21 -12.801   1.796  -3.404
  165   1HB   ASN  21          1HB       ASN  21 -12.301  -0.684  -1.747
  166   2HB   ASN  21          2HB       ASN  21 -13.745  -0.416  -2.712
  167   1HD2  ASN  21          1HD2      ASN  21 -10.874  -1.944  -2.694
  168   2HD2  ASN  21          2HD2      ASN  21 -10.575  -2.049  -4.394
  169    H    GLY  22           H        GLY  22 -12.261   3.427  -1.074
  170   1HA   GLY  22          1HA       GLY  22 -13.728   4.609   0.302
  171   2HA   GLY  22          2HA       GLY  22 -14.930   3.354   0.053
  172    H    LYS  23           H        LYS  23 -11.994   1.982   0.952
  173    HA   LYS  23           HA       LYS  23 -12.869   1.885   3.765
  174   1HB   LYS  23          1HB       LYS  23 -13.108  -0.253   2.438
  175   2HB   LYS  23          2HB       LYS  23 -11.357  -0.267   2.273
  176   1HG   LYS  23          1HG       LYS  23 -11.150  -0.378   4.728
  177   2HG   LYS  23          2HG       LYS  23 -12.912  -0.427   4.855
  178   1HD   LYS  23          1HD       LYS  23 -11.174  -2.468   3.456
  179   2HD   LYS  23          2HD       LYS  23 -11.964  -2.671   5.018
  180   1HE   LYS  23          1HE       LYS  23 -14.149  -2.461   3.961
  181   2HE   LYS  23          2HE       LYS  23 -13.381  -2.203   2.395
  182   1HZ   LYS  23          1HZ       LYS  23 -12.632  -4.634   3.826
  183   2HZ   LYS  23          2HZ       LYS  23 -12.899  -4.384   2.169
  184   3HZ   LYS  23          3HZ       LYS  23 -14.220  -4.574   3.221
  185    H    GLU  24           H        GLU  24 -11.409   2.434   5.287
  186    HA   GLU  24           HA       GLU  24  -8.785   3.320   4.377
  187   1HB   GLU  24          1HB       GLU  24 -10.129   3.672   7.057
  188   2HB   GLU  24          2HB       GLU  24  -8.618   4.416   6.563
  189   1HG   GLU  24          1HG       GLU  24  -9.828   5.622   4.799
  190   2HG   GLU  24          2HG       GLU  24 -11.333   4.911   5.380
  191    H    TYR  25           H        TYR  25  -6.945   2.272   4.798
  192    HA   TYR  25           HA       TYR  25  -7.068   0.016   6.697
  193   1HB   TYR  25          1HB       TYR  25  -5.314   0.354   4.279
  194   2HB   TYR  25          2HB       TYR  25  -5.171  -0.973   5.411
  195    HD1  TYR  25           HD1      TYR  25  -7.427   0.608   2.952
  196    HD2  TYR  25           HD2      TYR  25  -6.524  -2.897   5.180
  197    HE1  TYR  25           HE1      TYR  25  -9.054  -0.656   1.591
  198    HE2  TYR  25           HE2      TYR  25  -8.150  -4.178   3.824
  199    HH   TYR  25           HH       TYR  25  -9.325  -4.133   1.827
  200    H    ASN  26           H        ASN  26  -5.712  -0.007   8.381
  201    HA   ASN  26           HA       ASN  26  -3.656   2.093   8.517
  202   1HB   ASN  26          1HB       ASN  26  -5.217   0.627  10.627
  203   2HB   ASN  26          2HB       ASN  26  -3.662   1.343  11.028
  204   1HD2  ASN  26          1HD2      ASN  26  -6.942   1.879  10.822
  205   2HD2  ASN  26          2HD2      ASN  26  -6.936   3.602  10.891
  206    H    SER  27           H        SER  27  -3.756  -0.699   7.302
  207    HA   SER  27           HA       SER  27  -1.076  -1.471   8.070
  208   1HB   SER  27          1HB       SER  27  -1.817  -3.885   8.310
  209   2HB   SER  27          2HB       SER  27  -2.307  -2.822   9.627
  210    HG   SER  27           HG       SER  27  -3.848  -4.198   7.811
  211    H    CYS  28           H        CYS  28  -0.346  -3.346   6.580
  212    HA   CYS  28           HA       CYS  28  -1.146  -2.611   3.896
  213   1HB   CYS  28          1HB       CYS  28   0.928  -4.601   4.857
  214   2HB   CYS  28          2HB       CYS  28   0.671  -4.117   3.176
  215    H    THR  29           H        THR  29  -2.521  -3.698   2.649
  216    HA   THR  29           HA       THR  29  -3.521  -6.268   3.632
  217    HB   THR  29           HB       THR  29  -5.153  -4.420   3.700
  218    HG1  THR  29           HG1      THR  29  -5.962  -6.490   3.320
  219   1HG2  THR  29          1HG2      THR  29  -4.808  -2.899   2.040
  220   2HG2  THR  29          2HG2      THR  29  -6.102  -3.851   1.314
  221   3HG2  THR  29          3HG2      THR  29  -4.428  -4.128   0.832
  222    H    ASP  30           H        ASP  30  -4.442  -7.705   1.884
  223    HA   ASP  30           HA       ASP  30  -2.664  -7.644  -0.439
  224   1HB   ASP  30          1HB       ASP  30  -4.139 -10.099  -0.072
  225   2HB   ASP  30          2HB       ASP  30  -2.440  -9.867  -0.362
  226    H    THR  31           H        THR  31  -5.466  -6.525   0.332
  227    HA   THR  31           HA       THR  31  -7.365  -7.623  -1.427
  228    HB   THR  31           HB       THR  31  -7.163  -4.775  -0.450
  229    HG1  THR  31           HG1      THR  31  -7.175  -5.923   1.398
  230   1HG2  THR  31          1HG2      THR  31  -8.914  -5.098  -2.134
  231   2HG2  THR  31          2HG2      THR  31  -9.565  -4.716  -0.541
  232   3HG2  THR  31          3HG2      THR  31  -9.615  -6.373  -1.141
  233    H    GLY  32           H        GLY  32  -7.778  -7.276  -3.551
  234   1HA   GLY  32          1HA       GLY  32  -7.725  -6.137  -5.592
  235   2HA   GLY  32          2HA       GLY  32  -6.520  -5.051  -4.926
  236    H    ARG  33           H        ARG  33  -5.039  -7.512  -3.923
  237    HA   ARG  33           HA       ARG  33  -3.493  -7.926  -6.362
  238   1HB   ARG  33          1HB       ARG  33  -2.937  -8.850  -3.533
  239   2HB   ARG  33          2HB       ARG  33  -1.821  -8.934  -4.887
  240   1HG   ARG  33          1HG       ARG  33  -2.920  -6.385  -3.729
  241   2HG   ARG  33          2HG       ARG  33  -1.350  -7.077  -3.319
  242   1HD   ARG  33          1HD       ARG  33  -2.231  -6.195  -6.070
  243   2HD   ARG  33          2HD       ARG  33  -1.169  -5.287  -4.993
  244    HE   ARG  33           HE       ARG  33  -0.174  -7.920  -5.518
  245   1HH1  ARG  33          1HH1      ARG  33  -0.386  -4.679  -6.788
  246   2HH1  ARG  33          2HH1      ARG  33   0.979  -4.864  -7.849
  247   1HH2  ARG  33          1HH2      ARG  33   1.600  -8.196  -6.925
  248   2HH2  ARG  33          2HH2      ARG  33   2.091  -6.885  -7.951
  249    H    SER  34           H        SER  34  -2.903 -10.034  -7.087
  250    HA   SER  34           HA       SER  34  -5.011 -12.005  -6.624
  251   1HB   SER  34          1HB       SER  34  -2.754 -12.137  -8.634
  252   2HB   SER  34          2HB       SER  34  -4.258 -13.061  -8.645
  253    HG   SER  34           HG       SER  34  -5.028 -10.583  -8.603
  254    H    ASP  35           H        ASP  35  -1.560 -11.532  -6.156
  255    HA   ASP  35           HA       ASP  35  -1.162 -14.256  -5.356
  256   1HB   ASP  35          1HB       ASP  35   0.685 -11.951  -5.558
  257   2HB   ASP  35          2HB       ASP  35   1.193 -13.539  -5.060
  258    H    GLY  36           H        GLY  36  -2.587 -11.977  -3.728
  259   1HA   GLY  36          1HA       GLY  36  -2.918 -11.545  -1.497
  260   2HA   GLY  36          2HA       GLY  36  -2.164 -13.103  -1.212
  261    H    PHE  37           H        PHE  37  -0.782 -10.094  -2.546
  262    HA   PHE  37           HA       PHE  37   1.325 -10.289  -0.522
  263   1HB   PHE  37          1HB       PHE  37   1.146  -8.950  -3.192
  264   2HB   PHE  37          2HB       PHE  37   2.267  -8.316  -1.997
  265    HD1  PHE  37           HD1      PHE  37   1.305 -11.566  -3.575
  266    HD2  PHE  37           HD2      PHE  37   4.406  -9.145  -1.953
  267    HE1  PHE  37           HE1      PHE  37   2.967 -13.259  -4.221
  268    HE2  PHE  37           HE2      PHE  37   6.070 -10.834  -2.605
  269    HZ   PHE  37           HZ       PHE  37   5.352 -12.893  -3.738
  270    H    LEU  38           H        LEU  38   1.653  -8.772   1.006
  271    HA   LEU  38           HA       LEU  38  -0.503  -6.952   1.544
  272   1HB   LEU  38          1HB       LEU  38   2.114  -7.185   2.982
  273   2HB   LEU  38          2HB       LEU  38   0.668  -6.414   3.578
  274    HG   LEU  38           HG       LEU  38  -0.382  -8.797   3.332
  275   1HD1  LEU  38          1HD1      LEU  38   1.272 -10.044   2.282
  276   2HD1  LEU  38          2HD1      LEU  38   1.434 -10.491   3.978
  277   3HD1  LEU  38          3HD1      LEU  38   2.567  -9.346   3.261
  278   1HD2  LEU  38          1HD2      LEU  38   1.257  -7.589   5.457
  279   2HD2  LEU  38          2HD2      LEU  38   0.899  -9.307   5.633
  280   3HD2  LEU  38          3HD2      LEU  38  -0.417  -8.141   5.482
  281    H    TRP  39           H        TRP  39  -0.635  -4.946   0.790
  282    HA   TRP  39           HA       TRP  39   1.855  -3.504   0.197
  283   1HB   TRP  39          1HB       TRP  39   0.936  -2.647  -1.892
  284   2HB   TRP  39          2HB       TRP  39   0.924  -4.403  -1.918
  285    HD1  TRP  39           HD1      TRP  39  -1.504  -5.617  -1.678
  286    HE1  TRP  39           HE1      TRP  39  -3.863  -4.793  -2.264
  287    HE3  TRP  39           HE3      TRP  39  -0.580  -0.602  -2.033
  288    HZ2  TRP  39           HZ2      TRP  39  -5.152  -2.368  -2.820
  289    HZ3  TRP  39           HZ3      TRP  39  -2.437   0.892  -2.624
  290    HH2  TRP  39           HH2      TRP  39  -4.674   0.025  -2.998
  291    H    CYS  40           H        CYS  40   1.280  -1.126  -0.307
  292    HA   CYS  40           HA       CYS  40  -1.020  -0.091   1.122
  293   1HB   CYS  40          1HB       CYS  40   0.322   1.301   2.630
  294   2HB   CYS  40          2HB       CYS  40   0.677  -0.403   2.900
  295    H    SER  41           H        SER  41  -1.091   2.358   0.812
  296    HA   SER  41           HA       SER  41   0.169   2.988  -1.762
  297   1HB   SER  41          1HB       SER  41  -1.561   4.723  -2.019
  298   2HB   SER  41          2HB       SER  41  -2.282   3.133  -1.760
  299    HG   SER  41           HG       SER  41  -3.183   3.872  -0.019
  300    H    THR  42           H        THR  42   0.866   5.259  -2.063
  301    HA   THR  42           HA       THR  42   2.042   6.279   0.439
  302    HB   THR  42           HB       THR  42   3.282   7.028  -2.141
  303    HG1  THR  42           HG1      THR  42   4.086   5.032  -2.568
  304   1HG2  THR  42          1HG2      THR  42   4.320   7.548   0.027
  305   2HG2  THR  42          2HG2      THR  42   5.340   6.541  -0.999
  306   3HG2  THR  42          3HG2      THR  42   4.459   5.822   0.350
  307    H    THR  43           H        THR  43  -0.460   6.898  -1.357
  308    HA   THR  43           HA       THR  43  -0.201   9.809  -1.109
  309    HB   THR  43           HB       THR  43  -1.546   9.877  -3.315
  310    HG1  THR  43           HG1      THR  43  -1.908   8.011  -4.160
  311   1HG2  THR  43          1HG2      THR  43   0.760   9.154  -4.559
  312   2HG2  THR  43          2HG2      THR  43   1.328   9.551  -2.935
  313   3HG2  THR  43          3HG2      THR  43   0.424  10.744  -3.872
  314    H    TYR  44           H        TYR  44  -1.660   7.492   0.265
  315    HA   TYR  44           HA       TYR  44  -3.596   7.218   1.396
  316   1HB   TYR  44          1HB       TYR  44  -3.622   9.592   1.842
  317   2HB   TYR  44          2HB       TYR  44  -4.305   9.929   0.253
  318    HD1  TYR  44           HD1      TYR  44  -5.105   7.836   3.277
  319    HD2  TYR  44           HD2      TYR  44  -6.571  10.363   0.182
  320    HE1  TYR  44           HE1      TYR  44  -7.367   7.680   4.225
  321    HE2  TYR  44           HE2      TYR  44  -8.834  10.217   1.121
  322    HH   TYR  44           HH       TYR  44  -9.470   8.944   4.217
  323    H    ASN  45           H        ASN  45  -4.833   8.910  -1.501
  324    HA   ASN  45           HA       ASN  45  -6.693   6.725  -1.938
  325   1HB   ASN  45          1HB       ASN  45  -7.212   9.237  -2.192
  326   2HB   ASN  45          2HB       ASN  45  -6.313   9.159  -3.690
  327   1HD2  ASN  45          1HD2      ASN  45  -7.588   6.303  -3.959
  328   2HD2  ASN  45          2HD2      ASN  45  -9.108   6.745  -4.557
  329    H    PHE  46           H        PHE  46  -5.879   4.979  -2.967
  330    HA   PHE  46           HA       PHE  46  -3.584   5.130  -4.684
  331   1HB   PHE  46          1HB       PHE  46  -3.801   3.223  -3.255
  332   2HB   PHE  46          2HB       PHE  46  -5.428   2.868  -3.885
  333    HD1  PHE  46           HD1      PHE  46  -5.687   1.705  -5.989
  334    HD2  PHE  46           HD2      PHE  46  -1.793   2.737  -4.591
  335    HE1  PHE  46           HE1      PHE  46  -4.682   0.216  -7.667
  336    HE2  PHE  46           HE2      PHE  46  -0.801   1.249  -6.262
  337    HZ   PHE  46           HZ       PHE  46  -2.249  -0.019  -7.807
  338    H    GLU  47           H        GLU  47  -7.025   5.026  -5.216
  339    HA   GLU  47           HA       GLU  47  -7.084   3.994  -7.802
  340   1HB   GLU  47          1HB       GLU  47  -9.020   4.438  -6.226
  341   2HB   GLU  47          2HB       GLU  47  -8.964   6.106  -6.769
  342   1HG   GLU  47          1HG       GLU  47  -9.433   5.428  -9.036
  343   2HG   GLU  47          2HG       GLU  47  -9.387   3.728  -8.563
  344    H    LYS  48           H        LYS  48  -7.131   7.459  -6.898
  345    HA   LYS  48           HA       LYS  48  -6.811   8.208  -9.646
  346   1HB   LYS  48          1HB       LYS  48  -6.787  10.535  -8.774
  347   2HB   LYS  48          2HB       LYS  48  -8.200   9.598  -8.318
  348   1HG   LYS  48          1HG       LYS  48  -7.364   9.302  -6.089
  349   2HG   LYS  48          2HG       LYS  48  -5.818  10.045  -6.525
  350   1HD   LYS  48          1HD       LYS  48  -6.990  12.153  -7.000
  351   2HD   LYS  48          2HD       LYS  48  -8.515  11.407  -6.524
  352   1HE   LYS  48          1HE       LYS  48  -7.672  11.053  -4.280
  353   2HE   LYS  48          2HE       LYS  48  -6.101  11.711  -4.741
  354   1HZ   LYS  48          1HZ       LYS  48  -7.957  13.637  -5.429
  355   2HZ   LYS  48          2HZ       LYS  48  -6.864  13.677  -4.125
  356   3HZ   LYS  48          3HZ       LYS  48  -8.440  13.076  -3.894
  357    H    ASP  49           H        ASP  49  -4.611   7.964  -6.908
  358    HA   ASP  49           HA       ASP  49  -2.548   9.401  -8.357
  359   1HB   ASP  49          1HB       ASP  49  -2.584   8.126  -5.622
  360   2HB   ASP  49          2HB       ASP  49  -1.129   8.830  -6.322
  361    H    GLY  50           H        GLY  50  -2.879   6.101  -7.027
  362   1HA   GLY  50          1HA       GLY  50  -2.279   4.126  -8.128
  363   2HA   GLY  50          2HA       GLY  50  -1.454   5.091  -9.336
  364    H    LYS  51           H        LYS  51  -0.572   6.004  -6.187
  365    HA   LYS  51           HA       LYS  51   2.054   4.849  -6.548
  366   1HB   LYS  51          1HB       LYS  51   0.849   6.768  -4.592
  367   2HB   LYS  51          2HB       LYS  51   2.396   6.026  -4.244
  368   1HG   LYS  51          1HG       LYS  51   2.779   8.166  -5.200
  369   2HG   LYS  51          2HG       LYS  51   3.243   6.946  -6.383
  370   1HD   LYS  51          1HD       LYS  51   1.186   7.315  -7.608
  371   2HD   LYS  51          2HD       LYS  51   0.630   8.454  -6.377
  372   1HE   LYS  51          1HE       LYS  51   1.524   9.594  -8.362
  373   2HE   LYS  51          2HE       LYS  51   2.450   9.963  -6.908
  374   1HZ   LYS  51          1HZ       LYS  51   4.034   9.548  -8.566
  375   2HZ   LYS  51          2HZ       LYS  51   3.206   8.185  -9.163
  376   3HZ   LYS  51          3HZ       LYS  51   3.993   8.109  -7.660
  377    H    TYR  52           H        TYR  52   2.774   3.021  -5.620
  378    HA   TYR  52           HA       TYR  52   1.533   2.038  -3.191
  379   1HB   TYR  52          1HB       TYR  52   0.912  -0.098  -4.122
  380   2HB   TYR  52          2HB       TYR  52   0.187   1.149  -5.130
  381    HD1  TYR  52           HD1      TYR  52   2.734  -1.478  -4.960
  382    HD2  TYR  52           HD2      TYR  52   0.980   1.523  -7.414
  383    HE1  TYR  52           HE1      TYR  52   3.819  -2.467  -6.922
  384    HE2  TYR  52           HE2      TYR  52   2.060   0.533  -9.390
  385    HH   TYR  52           HH       TYR  52   4.056  -2.396  -9.129
  386    H    GLY  53           H        GLY  53   2.569  -0.185  -2.732
  387   1HA   GLY  53          1HA       GLY  53   5.123  -0.825  -3.665
  388   2HA   GLY  53          2HA       GLY  53   5.264   0.154  -2.220
  389    H    PHE  54           H        PHE  54   6.162  -2.447  -2.172
  390    HA   PHE  54           HA       PHE  54   3.998  -3.930  -0.910
  391   1HB   PHE  54          1HB       PHE  54   6.736  -4.876  -1.752
  392   2HB   PHE  54          2HB       PHE  54   5.473  -5.898  -1.080
  393    HD1  PHE  54           HD1      PHE  54   5.976  -3.467  -3.881
  394    HD2  PHE  54           HD2      PHE  54   4.145  -7.064  -2.534
  395    HE1  PHE  54           HE1      PHE  54   5.047  -3.824  -6.123
  396    HE2  PHE  54           HE2      PHE  54   3.215  -7.429  -4.776
  397    HZ   PHE  54           HZ       PHE  54   3.657  -5.813  -6.576
  398    H    CYS  55           H        CYS  55   4.232  -4.931   1.129
  399    HA   CYS  55           HA       CYS  55   6.187  -3.588   2.883
  400   1HB   CYS  55          1HB       CYS  55   3.622  -4.826   3.841
  401   2HB   CYS  55          2HB       CYS  55   4.610  -3.592   4.613
  402    HA   PRO  56           HA       PRO  56   7.041  -8.098   3.384
  403   1HB   PRO  56          1HB       PRO  56   9.567  -8.172   2.483
  404   2HB   PRO  56          2HB       PRO  56   8.191  -8.238   1.383
  405   1HG   PRO  56          1HG       PRO  56  10.093  -6.040   1.879
  406   2HG   PRO  56          2HG       PRO  56   9.087  -6.356   0.457
  407   1HD   PRO  56          1HD       PRO  56   8.593  -4.517   2.599
  408   2HD   PRO  56          2HD       PRO  56   7.577  -4.840   1.180
  409    H    HIS  57           H        HIS  57   8.899  -9.125   4.682
  410    HA   HIS  57           HA       HIS  57   9.772  -7.200   6.728
  411   1HB   HIS  57          1HB       HIS  57   8.209  -9.172   7.338
  412   2HB   HIS  57          2HB       HIS  57   9.651 -10.170   7.170
  413    HD1  HIS  57           HD1      HIS  57  11.800  -9.042   8.663
  414    HD2  HIS  57           HD2      HIS  57   7.885  -8.312   9.869
  415    HE1  HIS  57           HE1      HIS  57  11.953  -8.313  11.068
  416    H    GLU  58           H        GLU  58  11.734  -6.575   6.120
  417    HA   GLU  58           HA       GLU  58  13.581  -7.961   4.645
  418   1HB   GLU  58          1HB       GLU  58  14.023  -5.834   6.695
  419   2HB   GLU  58          2HB       GLU  58  15.204  -6.333   5.509
  420   1HG   GLU  58          1HG       GLU  58  12.510  -5.162   4.859
  421   2HG   GLU  58          2HG       GLU  58  14.018  -4.252   4.898
  422    H    ALA  59           H        ALA  59  14.981  -9.489   4.989
  423    HA   ALA  59           HA       ALA  59  15.886 -10.122   7.690
  424   1HB   ALA  59          1HB       ALA  59  14.620 -11.953   7.815
  425   2HB   ALA  59          2HB       ALA  59  15.543 -12.612   6.462
  426   3HB   ALA  59          3HB       ALA  59  14.044 -11.729   6.167
  Start of MODEL   44
    1   1H    ARG   1          1H        ARG   1  10.426   4.929  11.712
    2   2H    ARG   1          2H        ARG   1  11.567   3.847  11.017
    3   3H    ARG   1          3H        ARG   1  10.431   3.275  12.170
    4    HA   ARG   1           HA       ARG   1   8.818   3.128  10.734
    5   1HB   ARG   1          1HB       ARG   1   8.762   4.707   8.678
    6   2HB   ARG   1          2HB       ARG   1   8.350   5.335  10.270
    7   1HG   ARG   1          1HG       ARG   1  10.408   6.403  10.505
    8   2HG   ARG   1          2HG       ARG   1  11.117   5.497   9.164
    9   1HD   ARG   1          1HD       ARG   1   8.820   7.426   8.830
   10   2HD   ARG   1          2HD       ARG   1  10.509   7.906   8.676
   11    HE   ARG   1           HE       ARG   1  10.058   5.697   7.013
   12   1HH1  ARG   1          1HH1      ARG   1   9.086   9.036   7.285
   13   2HH1  ARG   1          2HH1      ARG   1   9.015   9.283   5.566
   14   1HH2  ARG   1          1HH2      ARG   1  10.015   6.038   4.755
   15   2HH2  ARG   1          2HH2      ARG   1   9.572   7.598   4.133
   16    H    ILE   2           H        ILE   2   8.749   1.480   9.359
   17    HA   ILE   2           HA       ILE   2  11.137   0.541   8.133
   18    HB   ILE   2           HB       ILE   2   9.606  -1.186   7.067
   19   1HG1  ILE   2          1HG1      ILE   2   7.490   0.255   8.679
   20   2HG1  ILE   2          2HG1      ILE   2   7.605   0.219   6.920
   21   1HG2  ILE   2          1HG2      ILE   2  10.358  -2.188   9.025
   22   2HG2  ILE   2          2HG2      ILE   2   8.681  -1.959   9.510
   23   3HG2  ILE   2          3HG2      ILE   2   9.901  -0.796  10.012
   24   1HD1  ILE   2          1HD1      ILE   2   6.752  -1.902   8.818
   25   2HD1  ILE   2          2HD1      ILE   2   7.481  -2.373   7.284
   26   3HD1  ILE   2          3HD1      ILE   2   6.023  -1.382   7.298
   27    HA   PRO   3           HA       PRO   3  10.725   2.390   4.184
   28   1HB   PRO   3          1HB       PRO   3  12.372   0.521   2.881
   29   2HB   PRO   3          2HB       PRO   3  12.895   1.970   3.735
   30   1HG   PRO   3          1HG       PRO   3  13.417  -0.682   4.485
   31   2HG   PRO   3          2HG       PRO   3  13.658   0.761   5.483
   32   1HD   PRO   3          1HD       PRO   3  11.402  -1.192   5.482
   33   2HD   PRO   3          2HD       PRO   3  12.113  -0.284   6.837
   34    H    VAL   4           H        VAL   4   9.715   2.303   2.233
   35    HA   VAL   4           HA       VAL   4   7.879   0.101   1.758
   36    HB   VAL   4           HB       VAL   4   8.355   2.730   0.295
   37   1HG1  VAL   4          1HG1      VAL   4   6.052   1.350  -0.677
   38   2HG1  VAL   4          2HG1      VAL   4   7.470   0.318  -0.883
   39   3HG1  VAL   4          3HG1      VAL   4   7.449   1.943  -1.573
   40   1HG2  VAL   4          1HG2      VAL   4   6.606   1.868   2.379
   41   2HG2  VAL   4          2HG2      VAL   4   5.630   2.193   0.948
   42   3HG2  VAL   4          3HG2      VAL   4   6.686   3.448   1.598
   43    H    LYS   5           H        LYS   5   7.942  -1.317   0.024
   44    HA   LYS   5           HA       LYS   5  10.660  -1.758  -0.924
   45   1HB   LYS   5          1HB       LYS   5   8.241  -3.486  -0.569
   46   2HB   LYS   5          2HB       LYS   5   9.607  -4.034  -1.531
   47   1HG   LYS   5          1HG       LYS   5   9.588  -3.324   1.388
   48   2HG   LYS   5          2HG       LYS   5   9.790  -4.932   0.670
   49   1HD   LYS   5          1HD       LYS   5  11.978  -4.623   0.255
   50   2HD   LYS   5          2HD       LYS   5  11.735  -2.955  -0.290
   51   1HE   LYS   5          1HE       LYS   5  11.612  -2.211   2.021
   52   2HE   LYS   5          2HE       LYS   5  11.779  -3.869   2.593
   53   1HZ   LYS   5          1HZ       LYS   5  13.873  -2.769   2.747
   54   2HZ   LYS   5          2HZ       LYS   5  13.814  -2.284   1.120
   55   3HZ   LYS   5          3HZ       LYS   5  13.977  -3.930   1.513
   56    H    TYR   6           H        TYR   6   9.036  -3.672  -2.774
   57    HA   TYR   6           HA       TYR   6   9.624  -2.357  -5.163
   58   1HB   TYR   6          1HB       TYR   6   7.680  -4.639  -5.039
   59   2HB   TYR   6          2HB       TYR   6   8.945  -4.314  -6.224
   60    HD1  TYR   6           HD1      TYR   6   8.237  -5.708  -2.907
   61    HD2  TYR   6           HD2      TYR   6  11.271  -4.938  -5.789
   62    HE1  TYR   6           HE1      TYR   6   9.761  -7.184  -1.682
   63    HE2  TYR   6           HE2      TYR   6  12.803  -6.425  -4.571
   64    HH   TYR   6           HH       TYR   6  12.069  -8.647  -2.630
   65    H    GLY   7           H        GLY   7   8.265  -1.693  -6.861
   66   1HA   GLY   7          1HA       GLY   7   5.827  -1.357  -7.457
   67   2HA   GLY   7          2HA       GLY   7   5.735  -0.500  -5.932
   68    H    ASN   8           H        ASN   8   5.170   1.453  -6.959
   69    HA   ASN   8           HA       ASN   8   7.316   2.590  -8.624
   70   1HB   ASN   8          1HB       ASN   8   5.721   4.022  -9.683
   71   2HB   ASN   8          2HB       ASN   8   5.071   2.389  -9.707
   72   1HD2  ASN   8          1HD2      ASN   8   3.739   4.979  -9.933
   73   2HD2  ASN   8          2HD2      ASN   8   2.549   5.004  -8.682
   74    H    ALA   9           H        ALA   9   6.778   2.546  -5.577
   75    HA   ALA   9           HA       ALA   9   6.830   5.403  -5.020
   76   1HB   ALA   9          1HB       ALA   9   6.973   3.293  -2.914
   77   2HB   ALA   9          2HB       ALA   9   5.436   3.666  -3.698
   78   3HB   ALA   9          3HB       ALA   9   6.308   4.924  -2.819
   79    H    ASP  10           H        ASP  10   8.554   6.368  -3.833
   80    HA   ASP  10           HA       ASP  10  11.134   5.217  -4.466
   81   1HB   ASP  10          1HB       ASP  10  10.365   7.796  -3.087
   82   2HB   ASP  10          2HB       ASP  10  12.026   7.324  -3.416
   83    H    GLY  11           H        GLY  11  10.047   6.748  -1.466
   84   1HA   GLY  11          1HA       GLY  11  10.653   4.395   0.072
   85   2HA   GLY  11          2HA       GLY  11  11.794   5.711   0.300
   86    H    GLU  12           H        GLU  12   8.581   6.673  -0.389
   87    HA   GLU  12           HA       GLU  12   8.309   7.959   2.144
   88   1HB   GLU  12          1HB       GLU  12   6.396   7.577  -0.159
   89   2HB   GLU  12          2HB       GLU  12   5.972   8.462   1.293
   90   1HG   GLU  12          1HG       GLU  12   6.583   9.958  -0.506
   91   2HG   GLU  12          2HG       GLU  12   7.713  10.095   0.834
   92    H    TYR  13           H        TYR  13   7.391   7.198   3.985
   93    HA   TYR  13           HA       TYR  13   6.784   4.602   4.428
   94   1HB   TYR  13          1HB       TYR  13   7.460   6.412   5.999
   95   2HB   TYR  13          2HB       TYR  13   5.803   6.996   5.919
   96    HD1  TYR  13           HD1      TYR  13   7.415   3.688   6.294
   97    HD2  TYR  13           HD2      TYR  13   4.618   6.513   7.761
   98    HE1  TYR  13           HE1      TYR  13   6.818   2.147   8.053
   99    HE2  TYR  13           HE2      TYR  13   3.993   5.000   9.538
  100    HH   TYR  13           HH       TYR  13   4.511   1.840   9.557
  101    H    CYS  14           H        CYS  14   4.914   3.431   4.711
  102    HA   CYS  14           HA       CYS  14   2.790   3.739   2.993
  103   1HB   CYS  14          1HB       CYS  14   2.790   2.364   5.685
  104   2HB   CYS  14          2HB       CYS  14   1.546   2.168   4.457
  105    H    LYS  15           H        LYS  15   0.663   4.438   3.162
  106    HA   LYS  15           HA       LYS  15   0.242   6.642   5.020
  107   1HB   LYS  15          1HB       LYS  15  -0.300   7.030   2.687
  108   2HB   LYS  15          2HB       LYS  15  -1.364   5.633   2.662
  109   1HG   LYS  15          1HG       LYS  15  -2.663   7.654   2.756
  110   2HG   LYS  15          2HG       LYS  15  -2.850   6.747   4.258
  111   1HD   LYS  15          1HD       LYS  15  -2.606   9.049   4.827
  112   2HD   LYS  15          2HD       LYS  15  -1.110   8.230   5.271
  113   1HE   LYS  15          1HE       LYS  15  -0.024   9.055   3.263
  114   2HE   LYS  15          2HE       LYS  15  -1.535   9.795   2.729
  115   1HZ   LYS  15          1HZ       LYS  15  -0.257  11.509   3.710
  116   2HZ   LYS  15          2HZ       LYS  15   0.125  10.560   5.066
  117   3HZ   LYS  15          3HZ       LYS  15  -1.462  11.120   4.842
  118    H    PHE  16           H        PHE  16  -0.596   6.158   6.951
  119    HA   PHE  16           HA       PHE  16  -2.699   4.097   7.085
  120   1HB   PHE  16          1HB       PHE  16  -0.511   4.735   9.076
  121   2HB   PHE  16          2HB       PHE  16  -1.897   3.728   9.461
  122    HD1  PHE  16           HD1      PHE  16   0.972   2.869   9.653
  123    HD2  PHE  16           HD2      PHE  16  -1.848   2.584   6.484
  124    HE1  PHE  16           HE1      PHE  16   2.153   0.900   8.788
  125    HE2  PHE  16           HE2      PHE  16  -0.681   0.621   5.606
  126    HZ   PHE  16           HZ       PHE  16   1.338  -0.256   6.747
  127    HA   PRO  17           HA       PRO  17  -4.367   3.934   7.059
  128   1HB   PRO  17          1HB       PRO  17  -6.992   4.624   6.788
  129   2HB   PRO  17          2HB       PRO  17  -6.330   3.808   8.205
  130   1HG   PRO  17          1HG       PRO  17  -7.350   6.519   7.990
  131   2HG   PRO  17          2HG       PRO  17  -6.876   5.621   9.440
  132   1HD   PRO  17          1HD       PRO  17  -5.376   7.626   7.926
  133   2HD   PRO  17          2HD       PRO  17  -5.074   6.991   9.554
  134    H    PHE  18           H        PHE  18  -4.921   3.550   4.898
  135    HA   PHE  18           HA       PHE  18  -5.008   5.962   3.217
  136   1HB   PHE  18          1HB       PHE  18  -4.012   4.694   1.404
  137   2HB   PHE  18          2HB       PHE  18  -2.984   4.621   2.825
  138    HD1  PHE  18           HD1      PHE  18  -3.036   2.497   4.222
  139    HD2  PHE  18           HD2      PHE  18  -4.744   2.775   0.337
  140    HE1  PHE  18           HE1      PHE  18  -2.960   0.047   4.008
  141    HE2  PHE  18           HE2      PHE  18  -4.671   0.332   0.113
  142    HZ   PHE  18           HZ       PHE  18  -3.772  -1.053   1.961
  143    H    LEU  19           H        LEU  19  -6.309   5.822   1.251
  144    HA   LEU  19           HA       LEU  19  -8.728   4.270   1.802
  145   1HB   LEU  19          1HB       LEU  19  -8.901   6.734   1.570
  146   2HB   LEU  19          2HB       LEU  19  -8.364   6.582  -0.093
  147    HG   LEU  19           HG       LEU  19 -10.376   5.084  -0.484
  148   1HD1  LEU  19          1HD1      LEU  19 -10.621   5.440   2.320
  149   2HD1  LEU  19          2HD1      LEU  19 -11.635   4.484   1.237
  150   3HD1  LEU  19          3HD1      LEU  19 -12.016   6.179   1.548
  151   1HD2  LEU  19          1HD2      LEU  19 -11.961   7.197  -0.219
  152   2HD2  LEU  19          2HD2      LEU  19 -10.712   7.110  -1.461
  153   3HD2  LEU  19          3HD2      LEU  19 -10.410   7.999   0.031
  154    H    PHE  20           H        PHE  20  -9.075   2.495   0.744
  155    HA   PHE  20           HA       PHE  20  -8.025   2.204  -2.009
  156   1HB   PHE  20          1HB       PHE  20  -7.017   0.675  -0.222
  157   2HB   PHE  20          2HB       PHE  20  -8.627  -0.010  -0.062
  158    HD1  PHE  20           HD1      PHE  20  -7.412  -2.105  -0.497
  159    HD2  PHE  20           HD2      PHE  20  -7.899   0.918  -3.443
  160    HE1  PHE  20           HE1      PHE  20  -7.006  -3.785  -2.252
  161    HE2  PHE  20           HE2      PHE  20  -7.495  -0.749  -5.212
  162    HZ   PHE  20           HZ       PHE  20  -7.058  -3.099  -4.630
  163    H    ASN  21           H        ASN  21  -9.782   2.648  -3.248
  164    HA   ASN  21           HA       ASN  21 -11.855   2.526  -4.174
  165   1HB   ASN  21          1HB       ASN  21 -11.501  -0.261  -3.100
  166   2HB   ASN  21          2HB       ASN  21 -12.959   0.205  -3.972
  167   1HD2  ASN  21          1HD2      ASN  21 -11.080   2.122  -5.516
  168   2HD2  ASN  21          2HD2      ASN  21 -10.379   1.090  -6.711
  169    H    GLY  22           H        GLY  22 -11.679   3.359  -1.249
  170   1HA   GLY  22          1HA       GLY  22 -13.569   4.416  -0.204
  171   2HA   GLY  22          2HA       GLY  22 -14.560   3.076  -0.748
  172    H    LYS  23           H        LYS  23 -11.690   1.843   0.402
  173    HA   LYS  23           HA       LYS  23 -12.825   1.494   3.106
  174   1HB   LYS  23          1HB       LYS  23 -12.904  -0.565   1.668
  175   2HB   LYS  23          2HB       LYS  23 -11.152  -0.521   1.586
  176   1HG   LYS  23          1HG       LYS  23 -11.028  -0.833   4.012
  177   2HG   LYS  23          2HG       LYS  23 -12.793  -0.880   4.091
  178   1HD   LYS  23          1HD       LYS  23 -12.802  -2.838   2.610
  179   2HD   LYS  23          2HD       LYS  23 -11.036  -2.806   2.566
  180   1HE   LYS  23          1HE       LYS  23 -11.039  -3.082   5.045
  181   2HE   LYS  23          2HE       LYS  23 -12.792  -3.277   4.970
  182   1HZ   LYS  23          1HZ       LYS  23 -12.606  -5.309   3.881
  183   2HZ   LYS  23          2HZ       LYS  23 -11.356  -5.368   5.022
  184   3HZ   LYS  23          3HZ       LYS  23 -11.005  -5.026   3.391
  185    H    GLU  24           H        GLU  24 -11.539   2.010   4.772
  186    HA   GLU  24           HA       GLU  24  -8.858   2.980   4.153
  187   1HB   GLU  24          1HB       GLU  24 -10.536   3.252   6.655
  188   2HB   GLU  24          2HB       GLU  24  -8.935   3.942   6.454
  189   1HG   GLU  24          1HG       GLU  24  -9.747   5.321   4.630
  190   2HG   GLU  24          2HG       GLU  24 -11.350   4.610   4.792
  191    H    TYR  25           H        TYR  25  -7.007   2.087   4.840
  192    HA   TYR  25           HA       TYR  25  -7.224  -0.308   6.541
  193   1HB   TYR  25          1HB       TYR  25  -5.309   0.255   4.297
  194   2HB   TYR  25          2HB       TYR  25  -5.168  -1.130   5.362
  195    HD1  TYR  25           HD1      TYR  25  -7.367   0.498   2.876
  196    HD2  TYR  25           HD2      TYR  25  -6.420  -3.099   4.939
  197    HE1  TYR  25           HE1      TYR  25  -8.888  -0.736   1.387
  198    HE2  TYR  25           HE2      TYR  25  -7.940  -4.351   3.444
  199    HH   TYR  25           HH       TYR  25  -9.366  -4.236   1.728
  200    H    ASN  26           H        ASN  26  -5.960  -0.456   8.298
  201    HA   ASN  26           HA       ASN  26  -4.273   1.854   8.924
  202   1HB   ASN  26          1HB       ASN  26  -5.376  -0.363  10.660
  203   2HB   ASN  26          2HB       ASN  26  -4.228   0.838  11.240
  204   1HD2  ASN  26          1HD2      ASN  26  -6.074   2.377   9.022
  205   2HD2  ASN  26          2HD2      ASN  26  -7.280   3.045  10.067
  206    H    SER  27           H        SER  27  -3.897  -1.030   7.480
  207    HA   SER  27           HA       SER  27  -1.062  -1.082   8.052
  208   1HB   SER  27          1HB       SER  27  -1.143  -3.574   8.471
  209   2HB   SER  27          2HB       SER  27  -1.801  -2.577   9.771
  210    HG   SER  27           HG       SER  27  -3.054  -4.503   8.988
  211    H    CYS  28           H        CYS  28  -0.270  -3.287   6.769
  212    HA   CYS  28           HA       CYS  28  -0.808  -2.665   4.018
  213   1HB   CYS  28          1HB       CYS  28   0.714  -5.047   5.094
  214   2HB   CYS  28          2HB       CYS  28   0.879  -4.288   3.513
  215    H    THR  29           H        THR  29  -2.007  -3.848   2.542
  216    HA   THR  29           HA       THR  29  -3.407  -6.183   3.602
  217    HB   THR  29           HB       THR  29  -4.919  -4.255   3.604
  218    HG1  THR  29           HG1      THR  29  -5.674  -6.398   3.023
  219   1HG2  THR  29          1HG2      THR  29  -5.275  -4.052   0.724
  220   2HG2  THR  29          2HG2      THR  29  -3.717  -3.437   1.270
  221   3HG2  THR  29          3HG2      THR  29  -5.208  -2.788   1.952
  222    H    ASP  30           H        ASP  30  -4.320  -7.612   1.886
  223    HA   ASP  30           HA       ASP  30  -2.501  -7.695  -0.409
  224   1HB   ASP  30          1HB       ASP  30  -4.102 -10.057   0.003
  225   2HB   ASP  30          2HB       ASP  30  -2.389  -9.923  -0.275
  226    H    THR  31           H        THR  31  -5.363  -6.572   0.316
  227    HA   THR  31           HA       THR  31  -7.146  -7.656  -1.581
  228    HB   THR  31           HB       THR  31  -7.144  -4.853  -0.478
  229    HG1  THR  31           HG1      THR  31  -6.987  -6.118   1.302
  230   1HG2  THR  31          1HG2      THR  31  -8.964  -6.086  -2.165
  231   2HG2  THR  31          2HG2      THR  31  -9.217  -4.622  -1.214
  232   3HG2  THR  31          3HG2      THR  31  -9.692  -6.191  -0.562
  233    H    GLY  32           H        GLY  32  -7.767  -6.838  -3.643
  234   1HA   GLY  32          1HA       GLY  32  -7.529  -5.535  -5.575
  235   2HA   GLY  32          2HA       GLY  32  -6.162  -4.729  -4.816
  236    H    ARG  33           H        ARG  33  -4.914  -7.182  -4.005
  237    HA   ARG  33           HA       ARG  33  -3.600  -7.877  -6.511
  238   1HB   ARG  33          1HB       ARG  33  -2.941  -8.738  -3.685
  239   2HB   ARG  33          2HB       ARG  33  -1.905  -8.889  -5.096
  240   1HG   ARG  33          1HG       ARG  33  -2.816  -6.261  -3.943
  241   2HG   ARG  33          2HG       ARG  33  -1.284  -7.041  -3.553
  242   1HD   ARG  33          1HD       ARG  33  -2.161  -6.218  -6.320
  243   2HD   ARG  33          2HD       ARG  33  -1.075  -5.281  -5.292
  244    HE   ARG  33           HE       ARG  33  -0.146  -7.963  -5.662
  245   1HH1  ARG  33          1HH1      ARG  33  -0.279  -4.785  -7.143
  246   2HH1  ARG  33          2HH1      ARG  33   1.046  -5.101  -8.224
  247   1HH2  ARG  33          1HH2      ARG  33   1.579  -8.372  -7.097
  248   2HH2  ARG  33          2HH2      ARG  33   2.097  -7.129  -8.196
  249    H    SER  34           H        SER  34  -2.926 -10.378  -6.506
  250    HA   SER  34           HA       SER  34  -5.369 -11.874  -5.815
  251   1HB   SER  34          1HB       SER  34  -3.624 -12.395  -8.232
  252   2HB   SER  34          2HB       SER  34  -5.156 -13.176  -7.832
  253    HG   SER  34           HG       SER  34  -6.022 -11.626  -8.950
  254    H    ASP  35           H        ASP  35  -1.856 -11.920  -5.937
  255    HA   ASP  35           HA       ASP  35  -1.817 -14.639  -4.972
  256   1HB   ASP  35          1HB       ASP  35   0.229 -12.814  -6.017
  257   2HB   ASP  35          2HB       ASP  35   0.740 -14.137  -4.998
  258    H    GLY  36           H        GLY  36  -2.570 -12.086  -3.426
  259   1HA   GLY  36          1HA       GLY  36  -2.591 -11.521  -1.208
  260   2HA   GLY  36          2HA       GLY  36  -1.826 -13.066  -0.898
  261    H    PHE  37           H        PHE  37  -0.792  -9.985  -2.437
  262    HA   PHE  37           HA       PHE  37   1.611 -10.175  -0.753
  263   1HB   PHE  37          1HB       PHE  37   1.152  -8.810  -3.393
  264   2HB   PHE  37          2HB       PHE  37   2.492  -8.350  -2.358
  265    HD1  PHE  37           HD1      PHE  37   3.604  -9.018  -4.648
  266    HD2  PHE  37           HD2      PHE  37   1.879 -11.773  -1.900
  267    HE1  PHE  37           HE1      PHE  37   4.978 -10.817  -5.600
  268    HE2  PHE  37           HE2      PHE  37   3.251 -13.581  -2.855
  269    HZ   PHE  37           HZ       PHE  37   4.802 -13.105  -4.703
  270    H    LEU  38           H        LEU  38   2.030  -8.647   0.748
  271    HA   LEU  38           HA       LEU  38  -0.098  -6.843   1.403
  272   1HB   LEU  38          1HB       LEU  38   2.583  -7.259   2.660
  273   2HB   LEU  38          2HB       LEU  38   1.365  -6.189   3.302
  274    HG   LEU  38           HG       LEU  38  -0.116  -8.369   3.298
  275   1HD1  LEU  38          1HD1      LEU  38   2.074  -9.982   4.102
  276   2HD1  LEU  38          2HD1      LEU  38   2.401  -9.386   2.475
  277   3HD1  LEU  38          3HD1      LEU  38   0.911 -10.272   2.809
  278   1HD2  LEU  38          1HD2      LEU  38   1.328  -8.867   5.560
  279   2HD2  LEU  38          2HD2      LEU  38   0.064  -7.646   5.408
  280   3HD2  LEU  38          3HD2      LEU  38   1.758  -7.191   5.207
  281    H    TRP  39           H        TRP  39  -0.341  -4.846   0.721
  282    HA   TRP  39           HA       TRP  39   2.057  -3.284   0.070
  283   1HB   TRP  39          1HB       TRP  39   1.018  -2.368  -1.934
  284   2HB   TRP  39          2HB       TRP  39   1.078  -4.119  -2.053
  285    HD1  TRP  39           HD1      TRP  39  -1.322  -5.436  -1.743
  286    HE1  TRP  39           HE1      TRP  39  -3.698  -4.657  -2.299
  287    HE3  TRP  39           HE3      TRP  39  -0.520  -0.383  -1.987
  288    HZ2  TRP  39           HZ2      TRP  39  -5.059  -2.245  -2.787
  289    HZ3  TRP  39           HZ3      TRP  39  -2.436   1.080  -2.517
  290    HH2  TRP  39           HH2      TRP  39  -4.648   0.159  -2.897
  291    H    CYS  40           H        CYS  40   1.431  -0.934  -0.279
  292    HA   CYS  40           HA       CYS  40  -0.847   0.031   1.245
  293   1HB   CYS  40          1HB       CYS  40   0.561   1.382   2.758
  294   2HB   CYS  40          2HB       CYS  40   0.889  -0.335   2.992
  295    H    SER  41           H        SER  41  -1.098   2.404   0.841
  296    HA   SER  41           HA       SER  41   0.346   3.174  -1.600
  297   1HB   SER  41          1HB       SER  41  -1.474   4.820  -1.951
  298   2HB   SER  41          2HB       SER  41  -2.081   3.169  -1.856
  299    HG   SER  41           HG       SER  41  -2.504   5.313  -0.170
  300    H    THR  42           H        THR  42   0.929   5.478  -1.807
  301    HA   THR  42           HA       THR  42   2.105   6.424   0.689
  302    HB   THR  42           HB       THR  42   2.487   7.458  -2.125
  303    HG1  THR  42           HG1      THR  42   4.592   6.112  -1.383
  304   1HG2  THR  42          1HG2      THR  42   3.223   8.852  -0.084
  305   2HG2  THR  42          2HG2      THR  42   4.348   8.610  -1.420
  306   3HG2  THR  42          3HG2      THR  42   4.513   7.657   0.057
  307    H    THR  43           H        THR  43  -0.248   7.296  -1.718
  308    HA   THR  43           HA       THR  43  -0.665   9.921  -0.527
  309    HB   THR  43           HB       THR  43  -2.187  10.214  -2.504
  310    HG1  THR  43           HG1      THR  43  -2.596   8.572  -3.744
  311   1HG2  THR  43          1HG2      THR  43  -0.511  10.569  -4.076
  312   2HG2  THR  43          2HG2      THR  43   0.467   9.228  -3.476
  313   3HG2  THR  43          3HG2      THR  43   0.333  10.712  -2.532
  314    H    TYR  44           H        TYR  44  -3.266  10.364  -1.068
  315    HA   TYR  44           HA       TYR  44  -4.579   9.188   1.158
  316   1HB   TYR  44          1HB       TYR  44  -4.960  11.520   0.366
  317   2HB   TYR  44          2HB       TYR  44  -5.746  10.890  -1.074
  318    HD1  TYR  44           HD1      TYR  44  -7.794   9.216  -0.511
  319    HD2  TYR  44           HD2      TYR  44  -6.276  12.198   2.118
  320    HE1  TYR  44           HE1      TYR  44  -9.936   9.239   0.687
  321    HE2  TYR  44           HE2      TYR  44  -8.419  12.234   3.317
  322    HH   TYR  44           HH       TYR  44 -10.515  11.480   3.387
  323    H    ASN  45           H        ASN  45  -5.608   9.214  -2.262
  324    HA   ASN  45           HA       ASN  45  -6.820   6.578  -1.766
  325   1HB   ASN  45          1HB       ASN  45  -8.349   8.571  -2.246
  326   2HB   ASN  45          2HB       ASN  45  -7.691   8.574  -3.864
  327   1HD2  ASN  45          1HD2      ASN  45  -7.703   5.447  -3.476
  328   2HD2  ASN  45          2HD2      ASN  45  -9.315   5.152  -3.909
  329    H    PHE  46           H        PHE  46  -5.715   4.999  -2.717
  330    HA   PHE  46           HA       PHE  46  -3.735   5.299  -4.681
  331   1HB   PHE  46          1HB       PHE  46  -3.705   3.398  -3.230
  332   2HB   PHE  46          2HB       PHE  46  -5.319   2.885  -3.772
  333    HD1  PHE  46           HD1      PHE  46  -5.583   1.864  -6.001
  334    HD2  PHE  46           HD2      PHE  46  -1.726   2.893  -4.508
  335    HE1  PHE  46           HE1      PHE  46  -4.544   0.447  -7.720
  336    HE2  PHE  46           HE2      PHE  46  -0.690   1.476  -6.221
  337    HZ   PHE  46           HZ       PHE  46  -2.092   0.248  -7.827
  338    H    GLU  47           H        GLU  47  -7.145   4.771  -4.953
  339    HA   GLU  47           HA       GLU  47  -7.490   3.764  -7.480
  340   1HB   GLU  47          1HB       GLU  47  -9.191   4.420  -5.629
  341   2HB   GLU  47          2HB       GLU  47  -9.225   5.978  -6.432
  342   1HG   GLU  47          1HG       GLU  47 -10.007   4.946  -8.471
  343   2HG   GLU  47          2HG       GLU  47  -9.900   3.348  -7.726
  344    H    LYS  48           H        LYS  48  -7.022   7.179  -6.594
  345    HA   LYS  48           HA       LYS  48  -7.026   7.883  -9.423
  346   1HB   LYS  48          1HB       LYS  48  -6.974  10.245  -8.508
  347   2HB   LYS  48          2HB       LYS  48  -8.430   9.311  -8.211
  348   1HG   LYS  48          1HG       LYS  48  -7.905   8.999  -5.946
  349   2HG   LYS  48          2HG       LYS  48  -6.222   9.473  -6.186
  350   1HD   LYS  48          1HD       LYS  48  -8.550  11.341  -6.576
  351   2HD   LYS  48          2HD       LYS  48  -7.679  11.168  -5.048
  352   1HE   LYS  48          1HE       LYS  48  -5.611  11.858  -6.106
  353   2HE   LYS  48          2HE       LYS  48  -6.408  11.927  -7.680
  354   1HZ   LYS  48          1HZ       LYS  48  -7.493  13.536  -5.473
  355   2HZ   LYS  48          2HZ       LYS  48  -7.498  13.853  -7.144
  356   3HZ   LYS  48          3HZ       LYS  48  -6.075  14.073  -6.238
  357    H    ASP  49           H        ASP  49  -4.865   7.989  -6.623
  358    HA   ASP  49           HA       ASP  49  -2.857   9.468  -8.050
  359   1HB   ASP  49          1HB       ASP  49  -2.712   8.030  -5.401
  360   2HB   ASP  49          2HB       ASP  49  -1.495   9.139  -6.030
  361    H    GLY  50           H        GLY  50  -3.081   6.108  -6.892
  362   1HA   GLY  50          1HA       GLY  50  -2.257   4.211  -7.939
  363   2HA   GLY  50          2HA       GLY  50  -1.527   5.245  -9.152
  364    H    LYS  51           H        LYS  51  -0.624   6.340  -6.096
  365    HA   LYS  51           HA       LYS  51   2.027   5.210  -6.453
  366   1HB   LYS  51          1HB       LYS  51   0.921   7.292  -4.577
  367   2HB   LYS  51          2HB       LYS  51   2.538   6.648  -4.387
  368   1HG   LYS  51          1HG       LYS  51   2.909   8.569  -5.577
  369   2HG   LYS  51          2HG       LYS  51   2.839   7.356  -6.852
  370   1HD   LYS  51          1HD       LYS  51   0.504   7.953  -7.291
  371   2HD   LYS  51          2HD       LYS  51   0.595   9.182  -6.021
  372   1HE   LYS  51          1HE       LYS  51   2.501  10.208  -7.305
  373   2HE   LYS  51          2HE       LYS  51   2.129   9.093  -8.619
  374   1HZ   LYS  51          1HZ       LYS  51   1.128  11.394  -8.747
  375   2HZ   LYS  51          2HZ       LYS  51   0.086  10.925  -7.494
  376   3HZ   LYS  51          3HZ       LYS  51   0.057  10.098  -8.982
  377    H    TYR  52           H        TYR  52   2.649   3.365  -5.494
  378    HA   TYR  52           HA       TYR  52   1.745   2.745  -2.818
  379   1HB   TYR  52          1HB       TYR  52   0.774   0.639  -3.355
  380   2HB   TYR  52          2HB       TYR  52   0.022   1.814  -4.434
  381    HD1  TYR  52           HD1      TYR  52   1.416   2.110  -6.753
  382    HD2  TYR  52           HD2      TYR  52   1.411  -1.354  -4.281
  383    HE1  TYR  52           HE1      TYR  52   2.107   0.743  -8.672
  384    HE2  TYR  52           HE2      TYR  52   2.101  -2.730  -6.196
  385    HH   TYR  52           HH       TYR  52   2.850  -1.268  -9.333
  386    H    GLY  53           H        GLY  53   2.647   0.540  -2.208
  387   1HA   GLY  53          1HA       GLY  53   4.942  -0.463  -3.549
  388   2HA   GLY  53          2HA       GLY  53   5.387   0.530  -2.167
  389    H    PHE  54           H        PHE  54   5.975  -2.184  -2.271
  390    HA   PHE  54           HA       PHE  54   3.941  -3.497  -0.673
  391   1HB   PHE  54          1HB       PHE  54   6.542  -4.496  -1.801
  392   2HB   PHE  54          2HB       PHE  54   5.416  -5.489  -0.889
  393    HD1  PHE  54           HD1      PHE  54   6.224  -6.338  -3.511
  394    HD2  PHE  54           HD2      PHE  54   3.127  -3.641  -2.404
  395    HE1  PHE  54           HE1      PHE  54   5.043  -6.850  -5.602
  396    HE2  PHE  54           HE2      PHE  54   1.934  -4.146  -4.490
  397    HZ   PHE  54           HZ       PHE  54   2.892  -5.753  -6.102
  398    H    CYS  55           H        CYS  55   4.392  -4.423   1.388
  399    HA   CYS  55           HA       CYS  55   6.217  -2.755   2.910
  400   1HB   CYS  55          1HB       CYS  55   4.330  -4.863   3.983
  401   2HB   CYS  55          2HB       CYS  55   5.103  -3.557   4.879
  402    HA   PRO  56           HA       PRO  56   8.363  -6.869   3.702
  403   1HB   PRO  56          1HB       PRO  56   7.189  -9.225   3.170
  404   2HB   PRO  56          2HB       PRO  56   6.791  -8.289   4.610
  405   1HG   PRO  56          1HG       PRO  56   5.171  -8.788   2.216
  406   2HG   PRO  56          2HG       PRO  56   4.668  -8.223   3.817
  407   1HD   PRO  56          1HD       PRO  56   5.176  -6.679   1.410
  408   2HD   PRO  56          2HD       PRO  56   4.481  -6.140   2.951
  409    H    HIS  57           H        HIS  57   9.076  -9.120   2.394
  410    HA   HIS  57           HA       HIS  57   9.588  -8.135  -0.321
  411   1HB   HIS  57          1HB       HIS  57  11.454  -9.801  -0.355
  412   2HB   HIS  57          2HB       HIS  57  11.627  -8.559   0.874
  413    HD1  HIS  57           HD1      HIS  57  10.433 -12.174   0.632
  414    HD2  HIS  57           HD2      HIS  57  12.221  -9.549   3.320
  415    HE1  HIS  57           HE1      HIS  57  11.004 -13.561   2.653
  416    H    GLU  58           H        GLU  58  10.262 -10.514  -1.585
  417    HA   GLU  58           HA       GLU  58   7.625 -11.514  -2.119
  418   1HB   GLU  58          1HB       GLU  58   8.864 -13.005  -3.773
  419   2HB   GLU  58          2HB       GLU  58   8.933 -11.273  -4.051
  420   1HG   GLU  58          1HG       GLU  58  11.120 -12.746  -2.613
  421   2HG   GLU  58          2HG       GLU  58  11.066 -12.623  -4.371
  422    H    ALA  59           H        ALA  59   6.817 -12.692  -0.520
  423    HA   ALA  59           HA       ALA  59   7.746 -15.373  -0.163
  424   1HB   ALA  59          1HB       ALA  59   7.684 -14.794   2.486
  425   2HB   ALA  59          2HB       ALA  59   8.437 -13.336   1.836
  426   3HB   ALA  59          3HB       ALA  59   9.162 -14.916   1.529
  Start of MODEL   45
    1   1H    ARG   1          1H        ARG   1  11.561   6.466  10.050
    2   2H    ARG   1          2H        ARG   1  12.219   7.067   8.578
    3   3H    ARG   1          3H        ARG   1  12.880   5.657   9.304
    4    HA   ARG   1           HA       ARG   1  11.187   4.342   8.673
    5   1HB   ARG   1          1HB       ARG   1   9.568   6.089   9.721
    6   2HB   ARG   1          2HB       ARG   1   9.451   6.748   8.097
    7   1HG   ARG   1          1HG       ARG   1   8.561   4.649   7.278
    8   2HG   ARG   1          2HG       ARG   1   8.746   3.924   8.879
    9   1HD   ARG   1          1HD       ARG   1   7.185   5.582   9.799
   10   2HD   ARG   1          2HD       ARG   1   6.995   6.289   8.197
   11    HE   ARG   1           HE       ARG   1   6.350   3.550   8.049
   12   1HH1  ARG   1          1HH1      ARG   1   5.152   6.535   9.405
   13   2HH1  ARG   1          2HH1      ARG   1   3.494   6.018   9.412
   14   1HH2  ARG   1          1HH2      ARG   1   4.171   2.857   8.046
   15   2HH2  ARG   1          2HH2      ARG   1   2.933   3.933   8.626
   16    H    ILE   2           H        ILE   2  12.227   3.698   6.850
   17    HA   ILE   2           HA       ILE   2  11.650   5.148   4.392
   18    HB   ILE   2           HB       ILE   2  13.820   6.045   5.147
   19   1HG1  ILE   2          1HG1      ILE   2  15.149   5.485   3.058
   20   2HG1  ILE   2          2HG1      ILE   2  13.859   4.359   2.652
   21   1HG2  ILE   2          1HG2      ILE   2  14.424   3.273   5.630
   22   2HG2  ILE   2          2HG2      ILE   2  15.278   4.725   6.163
   23   3HG2  ILE   2          3HG2      ILE   2  15.646   4.015   4.591
   24   1HD1  ILE   2          1HD1      ILE   2  12.315   6.054   2.310
   25   2HD1  ILE   2          2HD1      ILE   2  13.808   6.693   1.623
   26   3HD1  ILE   2          3HD1      ILE   2  13.270   7.236   3.213
   27    HA   PRO   3           HA       PRO   3  11.586   0.528   3.872
   28   1HB   PRO   3          1HB       PRO   3   8.814   0.275   4.338
   29   2HB   PRO   3          2HB       PRO   3  10.116  -0.126   5.458
   30   1HG   PRO   3          1HG       PRO   3   8.250   1.897   5.822
   31   2HG   PRO   3          2HG       PRO   3   9.810   1.768   6.661
   32   1HD   PRO   3          1HD       PRO   3   9.101   3.383   4.215
   33   2HD   PRO   3          2HD       PRO   3  10.073   3.849   5.638
   34    H    VAL   4           H        VAL   4   8.791  -0.213   3.024
   35    HA   VAL   4           HA       VAL   4   7.591  -0.594   1.148
   36    HB   VAL   4           HB       VAL   4   8.580   2.137   0.217
   37   1HG1  VAL   4          1HG1      VAL   4   6.247   0.476  -0.761
   38   2HG1  VAL   4          2HG1      VAL   4   7.786   0.649  -1.609
   39   3HG1  VAL   4          3HG1      VAL   4   6.745   2.055  -1.367
   40   1HG2  VAL   4          1HG2      VAL   4   7.063   1.768   2.379
   41   2HG2  VAL   4          2HG2      VAL   4   5.799   1.642   1.157
   42   3HG2  VAL   4          3HG2      VAL   4   6.781   3.103   1.251
   43    H    LYS   5           H        LYS   5   8.003  -1.985  -0.344
   44    HA   LYS   5           HA       LYS   5  10.700  -2.145  -1.424
   45   1HB   LYS   5          1HB       LYS   5   8.478  -4.052  -0.955
   46   2HB   LYS   5          2HB       LYS   5   9.537  -4.396  -2.316
   47   1HG   LYS   5          1HG       LYS   5  10.450  -3.994   0.530
   48   2HG   LYS   5          2HG       LYS   5  10.213  -5.550  -0.264
   49   1HD   LYS   5          1HD       LYS   5  11.980  -5.163  -1.791
   50   2HD   LYS   5          2HD       LYS   5  12.078  -3.454  -1.357
   51   1HE   LYS   5          1HE       LYS   5  12.997  -3.965   0.775
   52   2HE   LYS   5          2HE       LYS   5  12.631  -5.682   0.598
   53   1HZ   LYS   5          1HZ       LYS   5  14.753  -5.821  -0.058
   54   2HZ   LYS   5          2HZ       LYS   5  14.886  -4.164  -0.387
   55   3HZ   LYS   5          3HZ       LYS   5  14.211  -5.208  -1.540
   56    H    TYR   6           H        TYR   6   8.731  -3.906  -3.348
   57    HA   TYR   6           HA       TYR   6   9.313  -2.439  -5.676
   58   1HB   TYR   6          1HB       TYR   6   7.210  -4.581  -5.512
   59   2HB   TYR   6          2HB       TYR   6   8.302  -4.202  -6.844
   60    HD1  TYR   6           HD1      TYR   6  10.925  -4.397  -6.131
   61    HD2  TYR   6           HD2      TYR   6   7.703  -6.502  -4.299
   62    HE1  TYR   6           HE1      TYR   6  12.495  -6.091  -5.311
   63    HE2  TYR   6           HE2      TYR   6   9.274  -8.195  -3.477
   64    HH   TYR   6           HH       TYR   6  12.226  -7.914  -3.034
   65    H    GLY   7           H        GLY   7   7.859  -1.606  -7.235
   66   1HA   GLY   7          1HA       GLY   7   5.514  -0.983  -7.724
   67   2HA   GLY   7          2HA       GLY   7   5.429  -0.367  -6.084
   68    H    ASN   8           H        ASN   8   4.890   1.712  -6.950
   69    HA   ASN   8           HA       ASN   8   7.160   3.024  -8.269
   70   1HB   ASN   8          1HB       ASN   8   5.599   4.680  -9.183
   71   2HB   ASN   8          2HB       ASN   8   5.167   3.044  -9.664
   72   1HD2  ASN   8          1HD2      ASN   8   3.511   5.360  -9.654
   73   2HD2  ASN   8          2HD2      ASN   8   2.187   5.015  -8.598
   74    H    ALA   9           H        ALA   9   6.112   2.704  -5.285
   75    HA   ALA   9           HA       ALA   9   6.251   5.487  -4.456
   76   1HB   ALA   9          1HB       ALA   9   6.226   3.343  -2.430
   77   2HB   ALA   9          2HB       ALA   9   4.798   3.457  -3.464
   78   3HB   ALA   9          3HB       ALA   9   5.301   4.847  -2.505
   79    H    ASP  10           H        ASP  10   8.413   6.029  -4.887
   80    HA   ASP  10           HA       ASP  10  10.506   4.301  -3.861
   81   1HB   ASP  10          1HB       ASP  10  10.669   5.439  -6.088
   82   2HB   ASP  10          2HB       ASP  10  10.814   6.971  -5.232
   83    H    GLY  11           H        GLY  11  10.914   4.393  -1.767
   84   1HA   GLY  11          1HA       GLY  11  11.897   5.302   0.117
   85   2HA   GLY  11          2HA       GLY  11  11.872   6.869  -0.665
   86    H    GLU  12           H        GLU  12   8.891   6.642  -1.098
   87    HA   GLU  12           HA       GLU  12   8.204   7.830   1.410
   88   1HB   GLU  12          1HB       GLU  12   6.563   7.255  -1.050
   89   2HB   GLU  12          2HB       GLU  12   5.935   8.079   0.370
   90   1HG   GLU  12          1HG       GLU  12   7.675   9.811   0.091
   91   2HG   GLU  12          2HG       GLU  12   8.186   9.010  -1.389
   92    H    TYR  13           H        TYR  13   7.702   6.815   3.115
   93    HA   TYR  13           HA       TYR  13   7.158   4.097   3.404
   94   1HB   TYR  13          1HB       TYR  13   6.640   4.783   5.747
   95   2HB   TYR  13          2HB       TYR  13   8.203   5.309   5.113
   96    HD1  TYR  13           HD1      TYR  13   4.694   6.530   5.417
   97    HD2  TYR  13           HD2      TYR  13   8.841   7.456   5.410
   98    HE1  TYR  13           HE1      TYR  13   4.164   8.875   5.972
   99    HE2  TYR  13           HE2      TYR  13   8.334   9.804   5.969
  100    HH   TYR  13           HH       TYR  13   5.567  11.235   5.533
  101    H    CYS  14           H        CYS  14   5.167   3.289   4.697
  102    HA   CYS  14           HA       CYS  14   2.869   3.703   3.096
  103   1HB   CYS  14          1HB       CYS  14   3.180   2.290   5.748
  104   2HB   CYS  14          2HB       CYS  14   1.746   2.216   4.731
  105    H    LYS  15           H        LYS  15   1.002   4.822   3.487
  106    HA   LYS  15           HA       LYS  15   1.067   6.649   5.793
  107   1HB   LYS  15          1HB       LYS  15   1.130   7.659   3.494
  108   2HB   LYS  15          2HB       LYS  15  -0.452   6.956   3.190
  109   1HG   LYS  15          1HG       LYS  15  -1.439   8.312   4.924
  110   2HG   LYS  15          2HG       LYS  15   0.145   8.955   5.369
  111   1HD   LYS  15          1HD       LYS  15   0.362   9.890   3.088
  112   2HD   LYS  15          2HD       LYS  15  -1.272   9.324   2.732
  113   1HE   LYS  15          1HE       LYS  15  -2.202  10.779   4.396
  114   2HE   LYS  15          2HE       LYS  15  -0.596  11.206   4.983
  115   1HZ   LYS  15          1HZ       LYS  15  -2.047  12.577   3.120
  116   2HZ   LYS  15          2HZ       LYS  15  -0.890  11.746   2.192
  117   3HZ   LYS  15          3HZ       LYS  15  -0.391  12.773   3.448
  118    H    PHE  16           H        PHE  16  -0.117   5.774   7.390
  119    HA   PHE  16           HA       PHE  16  -2.643   4.424   6.717
  120   1HB   PHE  16          1HB       PHE  16  -1.037   4.328   9.284
  121   2HB   PHE  16          2HB       PHE  16  -2.503   3.410   8.953
  122    HD1  PHE  16           HD1      PHE  16   0.054   2.201   9.840
  123    HD2  PHE  16           HD2      PHE  16  -1.453   2.986   5.939
  124    HE1  PHE  16           HE1      PHE  16   1.403   0.358   8.958
  125    HE2  PHE  16           HE2      PHE  16  -0.101   1.144   5.041
  126    HZ   PHE  16           HZ       PHE  16   1.338  -0.208   6.552
  127    HA   PRO  17           HA       PRO  17  -4.429   4.032   7.112
  128   1HB   PRO  17          1HB       PRO  17  -7.004   4.724   6.894
  129   2HB   PRO  17          2HB       PRO  17  -6.322   4.173   8.431
  130   1HG   PRO  17          1HG       PRO  17  -7.074   6.924   7.584
  131   2HG   PRO  17          2HG       PRO  17  -7.072   6.206   9.203
  132   1HD   PRO  17          1HD       PRO  17  -5.089   7.886   8.069
  133   2HD   PRO  17          2HD       PRO  17  -4.999   7.015   9.612
  134    H    PHE  18           H        PHE  18  -5.273   3.615   4.991
  135    HA   PHE  18           HA       PHE  18  -5.196   5.961   3.227
  136   1HB   PHE  18          1HB       PHE  18  -4.121   4.670   1.505
  137   2HB   PHE  18          2HB       PHE  18  -3.174   4.565   2.977
  138    HD1  PHE  18           HD1      PHE  18  -5.552   2.722   0.831
  139    HD2  PHE  18           HD2      PHE  18  -2.639   2.493   3.920
  140    HE1  PHE  18           HE1      PHE  18  -5.517   0.285   0.607
  141    HE2  PHE  18           HE2      PHE  18  -2.605   0.044   3.707
  142    HZ   PHE  18           HZ       PHE  18  -4.044  -1.081   2.044
  143    H    LEU  19           H        LEU  19  -6.423   5.738   1.218
  144    HA   LEU  19           HA       LEU  19  -8.881   4.209   1.735
  145   1HB   LEU  19          1HB       LEU  19  -9.009   6.703   1.520
  146   2HB   LEU  19          2HB       LEU  19  -8.486   6.531  -0.146
  147    HG   LEU  19           HG       LEU  19 -10.525   5.088  -0.529
  148   1HD1  LEU  19          1HD1      LEU  19 -10.973   5.879   2.294
  149   2HD1  LEU  19          2HD1      LEU  19 -11.326   4.358   1.476
  150   3HD1  LEU  19          3HD1      LEU  19 -12.366   5.759   1.219
  151   1HD2  LEU  19          1HD2      LEU  19 -11.811   6.901  -1.102
  152   2HD2  LEU  19          2HD2      LEU  19 -10.226   7.653  -0.935
  153   3HD2  LEU  19          3HD2      LEU  19 -11.403   7.790   0.367
  154    H    PHE  20           H        PHE  20  -8.913   2.326   0.715
  155    HA   PHE  20           HA       PHE  20  -7.770   2.139  -1.986
  156   1HB   PHE  20          1HB       PHE  20  -7.055   0.462  -0.268
  157   2HB   PHE  20          2HB       PHE  20  -8.729  -0.086  -0.180
  158    HD1  PHE  20           HD1      PHE  20  -7.670  -2.270  -0.642
  159    HD2  PHE  20           HD2      PHE  20  -7.772   0.867  -3.510
  160    HE1  PHE  20           HE1      PHE  20  -7.253  -3.920  -2.425
  161    HE2  PHE  20           HE2      PHE  20  -7.352  -0.776  -5.303
  162    HZ   PHE  20           HZ       PHE  20  -7.097  -3.163  -4.767
  163    H    ASN  21           H        ASN  21  -9.318   3.030  -3.174
  164    HA   ASN  21           HA       ASN  21 -11.297   3.405  -4.226
  165   1HB   ASN  21          1HB       ASN  21 -11.134   0.397  -4.186
  166   2HB   ASN  21          2HB       ASN  21 -12.304   1.297  -5.151
  167   1HD2  ASN  21          1HD2      ASN  21 -11.700   1.491  -7.180
  168   2HD2  ASN  21          2HD2      ASN  21 -10.078   1.699  -7.743
  169    H    GLY  22           H        GLY  22 -11.659   3.545  -1.387
  170   1HA   GLY  22          1HA       GLY  22 -13.883   4.153  -0.583
  171   2HA   GLY  22          2HA       GLY  22 -14.468   2.656  -1.264
  172    H    LYS  23           H        LYS  23 -11.759   1.572  -0.009
  173    HA   LYS  23           HA       LYS  23 -12.964   1.210   2.655
  174   1HB   LYS  23          1HB       LYS  23 -12.810  -0.813   1.097
  175   2HB   LYS  23          2HB       LYS  23 -11.071  -0.725   1.322
  176   1HG   LYS  23          1HG       LYS  23 -11.356  -1.091   3.723
  177   2HG   LYS  23          2HG       LYS  23 -13.105  -1.150   3.513
  178   1HD   LYS  23          1HD       LYS  23 -11.137  -3.055   2.242
  179   2HD   LYS  23          2HD       LYS  23 -12.105  -3.395   3.680
  180   1HE   LYS  23          1HE       LYS  23 -14.155  -3.122   2.383
  181   2HE   LYS  23          2HE       LYS  23 -13.200  -2.749   0.944
  182   1HZ   LYS  23          1HZ       LYS  23 -14.032  -5.247   1.786
  183   2HZ   LYS  23          2HZ       LYS  23 -12.359  -5.207   2.103
  184   3HZ   LYS  23          3HZ       LYS  23 -12.932  -4.904   0.540
  185    H    GLU  24           H        GLU  24 -11.783   1.745   4.421
  186    HA   GLU  24           HA       GLU  24  -9.134   2.889   3.958
  187   1HB   GLU  24          1HB       GLU  24 -10.769   2.948   6.492
  188   2HB   GLU  24          2HB       GLU  24  -9.416   3.988   6.071
  189   1HG   GLU  24          1HG       GLU  24 -10.747   4.963   4.269
  190   2HG   GLU  24          2HG       GLU  24 -12.103   3.929   4.720
  191    H    TYR  25           H        TYR  25  -7.259   2.081   4.770
  192    HA   TYR  25           HA       TYR  25  -7.463  -0.307   6.485
  193   1HB   TYR  25          1HB       TYR  25  -5.508   0.246   4.274
  194   2HB   TYR  25          2HB       TYR  25  -5.362  -1.105   5.382
  195    HD1  TYR  25           HD1      TYR  25  -7.411   0.384   2.721
  196    HD2  TYR  25           HD2      TYR  25  -6.680  -3.090   5.060
  197    HE1  TYR  25           HE1      TYR  25  -8.855  -0.920   1.207
  198    HE2  TYR  25           HE2      TYR  25  -8.125  -4.413   3.548
  199    HH   TYR  25           HH       TYR  25  -9.032  -4.393   1.397
  200    H    ASN  26           H        ASN  26  -6.303  -0.327   8.294
  201    HA   ASN  26           HA       ASN  26  -4.592   1.988   8.861
  202   1HB   ASN  26          1HB       ASN  26  -5.771  -0.103  10.711
  203   2HB   ASN  26          2HB       ASN  26  -4.687   1.175  11.235
  204   1HD2  ASN  26          1HD2      ASN  26  -6.644   2.312   8.780
  205   2HD2  ASN  26          2HD2      ASN  26  -7.852   3.076   9.751
  206    H    SER  27           H        SER  27  -4.112  -0.672   7.362
  207    HA   SER  27           HA       SER  27  -1.361  -0.932   8.063
  208   1HB   SER  27          1HB       SER  27  -1.641  -3.480   8.451
  209   2HB   SER  27          2HB       SER  27  -2.039  -2.390   9.791
  210    HG   SER  27           HG       SER  27  -3.704  -3.988   8.227
  211    H    CYS  28           H        CYS  28  -0.547  -3.053   6.751
  212    HA   CYS  28           HA       CYS  28  -1.265  -2.467   4.032
  213   1HB   CYS  28          1HB       CYS  28   0.541  -4.646   5.087
  214   2HB   CYS  28          2HB       CYS  28   0.479  -4.049   3.433
  215    H    THR  29           H        THR  29  -2.302  -3.828   2.547
  216    HA   THR  29           HA       THR  29  -3.591  -6.211   3.656
  217    HB   THR  29           HB       THR  29  -5.199  -4.356   3.595
  218    HG1  THR  29           HG1      THR  29  -6.270  -6.172   3.239
  219   1HG2  THR  29          1HG2      THR  29  -5.688  -3.039   1.833
  220   2HG2  THR  29          2HG2      THR  29  -5.323  -4.296   0.649
  221   3HG2  THR  29          3HG2      THR  29  -4.011  -3.395   1.408
  222    H    ASP  30           H        ASP  30  -4.365  -7.743   1.958
  223    HA   ASP  30           HA       ASP  30  -2.505  -7.710  -0.290
  224   1HB   ASP  30          1HB       ASP  30  -3.978 -10.144  -0.071
  225   2HB   ASP  30          2HB       ASP  30  -2.260  -9.929  -0.129
  226    H    THR  31           H        THR  31  -5.424  -6.695   0.363
  227    HA   THR  31           HA       THR  31  -7.204  -7.836  -1.442
  228    HB   THR  31           HB       THR  31  -7.071  -4.949  -0.582
  229    HG1  THR  31           HG1      THR  31  -7.156  -6.203   1.254
  230   1HG2  THR  31          1HG2      THR  31  -9.047  -6.454  -2.094
  231   2HG2  THR  31          2HG2      THR  31  -8.842  -4.712  -1.907
  232   3HG2  THR  31          3HG2      THR  31  -9.706  -5.632  -0.677
  233    H    GLY  32           H        GLY  32  -7.534  -7.645  -3.578
  234   1HA   GLY  32          1HA       GLY  32  -7.400  -6.702  -5.709
  235   2HA   GLY  32          2HA       GLY  32  -6.281  -5.504  -5.071
  236    H    ARG  33           H        ARG  33  -4.798  -7.769  -3.753
  237    HA   ARG  33           HA       ARG  33  -3.134  -8.462  -6.060
  238   1HB   ARG  33          1HB       ARG  33  -2.568  -8.540  -3.089
  239   2HB   ARG  33          2HB       ARG  33  -1.420  -8.989  -4.335
  240   1HG   ARG  33          1HG       ARG  33  -2.631  -6.263  -3.931
  241   2HG   ARG  33          2HG       ARG  33  -0.991  -6.744  -3.497
  242   1HD   ARG  33          1HD       ARG  33  -2.165  -6.639  -6.272
  243   2HD   ARG  33          2HD       ARG  33  -1.000  -5.504  -5.599
  244    HE   ARG  33           HE       ARG  33  -0.168  -8.296  -5.688
  245   1HH1  ARG  33          1HH1      ARG  33  -0.160  -5.167  -7.234
  246   2HH1  ARG  33          2HH1      ARG  33   1.209  -5.526  -8.244
  247   1HH2  ARG  33          1HH2      ARG  33   1.567  -8.814  -7.024
  248   2HH2  ARG  33          2HH2      ARG  33   2.223  -7.615  -8.097
  249    H    SER  34           H        SER  34  -3.346 -10.445  -6.869
  250    HA   SER  34           HA       SER  34  -4.704 -12.501  -5.360
  251   1HB   SER  34          1HB       SER  34  -3.403 -12.666  -8.088
  252   2HB   SER  34          2HB       SER  34  -4.550 -13.810  -7.401
  253    HG   SER  34           HG       SER  34  -4.975 -11.281  -8.478
  254    H    ASP  35           H        ASP  35  -1.499 -11.454  -5.656
  255    HA   ASP  35           HA       ASP  35  -0.301 -14.034  -5.320
  256   1HB   ASP  35          1HB       ASP  35   1.398 -11.798  -4.692
  257   2HB   ASP  35          2HB       ASP  35   1.638 -13.059  -5.864
  258    H    GLY  36           H        GLY  36  -1.926 -12.106  -3.315
  259   1HA   GLY  36          1HA       GLY  36  -2.190 -12.133  -1.020
  260   2HA   GLY  36          2HA       GLY  36  -1.009 -13.431  -0.973
  261    H    PHE  37           H        PHE  37  -0.105 -10.523  -2.561
  262    HA   PHE  37           HA       PHE  37   1.958 -10.038  -0.590
  263   1HB   PHE  37          1HB       PHE  37   1.311  -8.747  -3.240
  264   2HB   PHE  37          2HB       PHE  37   2.592  -8.165  -2.195
  265    HD1  PHE  37           HD1      PHE  37   3.575  -8.675  -4.665
  266    HD2  PHE  37           HD2      PHE  37   2.598 -11.581  -1.709
  267    HE1  PHE  37           HE1      PHE  37   5.157 -10.250  -5.696
  268    HE2  PHE  37           HE2      PHE  37   4.180 -13.160  -2.740
  269    HZ   PHE  37           HZ       PHE  37   5.458 -12.497  -4.735
  270    H    LEU  38           H        LEU  38   1.801  -8.623   1.036
  271    HA   LEU  38           HA       LEU  38  -0.540  -6.956   1.250
  272   1HB   LEU  38          1HB       LEU  38   1.851  -7.184   3.045
  273   2HB   LEU  38          2HB       LEU  38   0.436  -6.227   3.403
  274    HG   LEU  38           HG       LEU  38  -0.841  -8.479   3.199
  275   1HD1  LEU  38          1HD1      LEU  38   0.748  -9.944   2.332
  276   2HD1  LEU  38          2HD1      LEU  38   0.667 -10.351   4.046
  277   3HD1  LEU  38          3HD1      LEU  38   2.005  -9.380   3.433
  278   1HD2  LEU  38          1HD2      LEU  38  -0.370  -8.965   5.566
  279   2HD2  LEU  38          2HD2      LEU  38  -0.638  -7.249   5.262
  280   3HD2  LEU  38          3HD2      LEU  38   1.001  -7.863   5.498
  281    H    TRP  39           H        TRP  39  -0.679  -4.861   0.749
  282    HA   TRP  39           HA       TRP  39   1.813  -3.391   0.255
  283   1HB   TRP  39          1HB       TRP  39   0.860  -2.415  -1.787
  284   2HB   TRP  39          2HB       TRP  39   0.956  -4.163  -1.910
  285    HD1  TRP  39           HD1      TRP  39  -1.434  -5.526  -1.777
  286    HE1  TRP  39           HE1      TRP  39  -3.811  -4.770  -2.373
  287    HE3  TRP  39           HE3      TRP  39  -0.715  -0.468  -1.801
  288    HZ2  TRP  39           HZ2      TRP  39  -5.199  -2.356  -2.794
  289    HZ3  TRP  39           HZ3      TRP  39  -2.628   0.988  -2.312
  290    HH2  TRP  39           HH2      TRP  39  -4.822   0.056  -2.794
  291    H    CYS  40           H        CYS  40   1.324  -1.035  -0.109
  292    HA   CYS  40           HA       CYS  40  -0.966   0.008   1.362
  293   1HB   CYS  40          1HB       CYS  40   0.399   1.338   2.862
  294   2HB   CYS  40          2HB       CYS  40   0.887  -0.346   3.037
  295    H    SER  41           H        SER  41  -1.168   2.372   0.905
  296    HA   SER  41           HA       SER  41   0.116   2.981  -1.650
  297   1HB   SER  41          1HB       SER  41  -1.590   4.885  -1.704
  298   2HB   SER  41          2HB       SER  41  -2.220   3.245  -1.843
  299    HG   SER  41           HG       SER  41  -2.070   4.658   0.619
  300    H    THR  42           H        THR  42   0.383   5.531  -1.881
  301    HA   THR  42           HA       THR  42   2.142   6.292   0.352
  302    HB   THR  42           HB       THR  42   2.120   7.438  -2.444
  303    HG1  THR  42           HG1      THR  42   3.732   5.337  -1.426
  304   1HG2  THR  42          1HG2      THR  42   4.342   7.345  -0.421
  305   2HG2  THR  42          2HG2      THR  42   3.327   8.751  -0.741
  306   3HG2  THR  42          3HG2      THR  42   4.370   8.112  -2.009
  307    H    THR  43           H        THR  43  -0.364   7.496  -1.822
  308    HA   THR  43           HA       THR  43  -0.544   9.989  -0.346
  309    HB   THR  43           HB       THR  43  -2.202  10.592  -2.095
  310    HG1  THR  43           HG1      THR  43  -3.051   9.105  -3.305
  311   1HG2  THR  43          1HG2      THR  43  -0.715  10.318  -4.115
  312   2HG2  THR  43          2HG2      THR  43   0.403   9.449  -3.063
  313   3HG2  THR  43          3HG2      THR  43   0.010  11.136  -2.725
  314    H    TYR  44           H        TYR  44  -3.442  10.261  -0.818
  315    HA   TYR  44           HA       TYR  44  -4.305   8.705   1.496
  316   1HB   TYR  44          1HB       TYR  44  -4.684  11.228   1.293
  317   2HB   TYR  44          2HB       TYR  44  -5.900  10.846   0.075
  318    HD1  TYR  44           HD1      TYR  44  -7.258  12.229   1.861
  319    HD2  TYR  44           HD2      TYR  44  -5.808   8.282   2.525
  320    HE1  TYR  44           HE1      TYR  44  -8.929  11.919   3.643
  321    HE2  TYR  44           HE2      TYR  44  -7.478   7.961   4.294
  322    HH   TYR  44           HH       TYR  44 -10.100   9.557   4.670
  323    H    ASN  45           H        ASN  45  -5.555   9.535  -1.748
  324    HA   ASN  45           HA       ASN  45  -7.211   7.121  -1.655
  325   1HB   ASN  45          1HB       ASN  45  -8.190   9.368  -2.308
  326   2HB   ASN  45          2HB       ASN  45  -7.226   9.293  -3.765
  327   1HD2  ASN  45          1HD2      ASN  45  -7.779   6.269  -3.770
  328   2HD2  ASN  45          2HD2      ASN  45  -9.357   6.250  -4.407
  329    H    PHE  46           H        PHE  46  -6.295   5.337  -2.450
  330    HA   PHE  46           HA       PHE  46  -3.911   5.225  -3.867
  331   1HB   PHE  46          1HB       PHE  46  -4.704   3.304  -2.668
  332   2HB   PHE  46          2HB       PHE  46  -6.146   3.198  -3.699
  333    HD1  PHE  46           HD1      PHE  46  -2.417   3.414  -4.223
  334    HD2  PHE  46           HD2      PHE  46  -6.070   1.449  -5.205
  335    HE1  PHE  46           HE1      PHE  46  -1.211   1.917  -5.752
  336    HE2  PHE  46           HE2      PHE  46  -4.860  -0.048  -6.726
  337    HZ   PHE  46           HZ       PHE  46  -2.425   0.187  -7.004
  338    H    GLU  47           H        GLU  47  -7.214   4.903  -5.182
  339    HA   GLU  47           HA       GLU  47  -6.520   4.429  -7.833
  340   1HB   GLU  47          1HB       GLU  47  -8.803   4.205  -6.911
  341   2HB   GLU  47          2HB       GLU  47  -8.922   5.952  -6.806
  342   1HG   GLU  47          1HG       GLU  47  -8.604   6.051  -9.274
  343   2HG   GLU  47          2HG       GLU  47  -8.703   4.289  -9.299
  344    H    LYS  48           H        LYS  48  -7.246   7.495  -6.258
  345    HA   LYS  48           HA       LYS  48  -7.110   9.224  -8.359
  346   1HB   LYS  48          1HB       LYS  48  -7.837  10.009  -6.226
  347   2HB   LYS  48          2HB       LYS  48  -6.323   9.568  -5.457
  348   1HG   LYS  48          1HG       LYS  48  -5.184  11.404  -6.629
  349   2HG   LYS  48          2HG       LYS  48  -6.711  11.861  -7.403
  350   1HD   LYS  48          1HD       LYS  48  -7.366  11.727  -4.731
  351   2HD   LYS  48          2HD       LYS  48  -5.733  12.403  -4.719
  352   1HE   LYS  48          1HE       LYS  48  -7.443  14.152  -4.834
  353   2HE   LYS  48          2HE       LYS  48  -6.421  14.145  -6.273
  354   1HZ   LYS  48          1HZ       LYS  48  -9.149  14.090  -6.255
  355   2HZ   LYS  48          2HZ       LYS  48  -8.743  12.466  -6.541
  356   3HZ   LYS  48          3HZ       LYS  48  -8.164  13.684  -7.580
  357    H    ASP  49           H        ASP  49  -4.289   8.503  -6.236
  358    HA   ASP  49           HA       ASP  49  -2.577   9.779  -8.209
  359   1HB   ASP  49          1HB       ASP  49  -2.225   8.920  -5.378
  360   2HB   ASP  49          2HB       ASP  49  -0.790   9.100  -6.383
  361    H    GLY  50           H        GLY  50  -2.768   6.581  -6.641
  362   1HA   GLY  50          1HA       GLY  50  -2.419   4.542  -7.777
  363   2HA   GLY  50          2HA       GLY  50  -1.603   5.426  -9.051
  364    H    LYS  51           H        LYS  51  -0.591   6.353  -5.959
  365    HA   LYS  51           HA       LYS  51   1.973   5.069  -6.369
  366   1HB   LYS  51          1HB       LYS  51   0.948   7.226  -4.572
  367   2HB   LYS  51          2HB       LYS  51   2.463   6.427  -4.191
  368   1HG   LYS  51          1HG       LYS  51   2.819   8.492  -5.407
  369   2HG   LYS  51          2HG       LYS  51   3.370   7.101  -6.339
  370   1HD   LYS  51          1HD       LYS  51   1.237   7.170  -7.603
  371   2HD   LYS  51          2HD       LYS  51   0.814   8.648  -6.727
  372   1HE   LYS  51          1HE       LYS  51   2.755   9.774  -7.640
  373   2HE   LYS  51          2HE       LYS  51   3.267   8.293  -8.450
  374   1HZ   LYS  51          1HZ       LYS  51   1.262   8.366  -9.805
  375   2HZ   LYS  51          2HZ       LYS  51   2.159   9.797  -9.983
  376   3HZ   LYS  51          3HZ       LYS  51   0.762   9.792  -9.020
  377    H    TYR  52           H        TYR  52   2.456   3.163  -5.496
  378    HA   TYR  52           HA       TYR  52   1.520   2.511  -2.826
  379   1HB   TYR  52          1HB       TYR  52   0.517   0.429  -3.432
  380   2HB   TYR  52          2HB       TYR  52  -0.212   1.660  -4.460
  381    HD1  TYR  52           HD1      TYR  52   1.126   2.014  -6.775
  382    HD2  TYR  52           HD2      TYR  52   1.137  -1.532  -4.428
  383    HE1  TYR  52           HE1      TYR  52   1.776   0.713  -8.754
  384    HE2  TYR  52           HE2      TYR  52   1.785  -2.848  -6.397
  385    HH   TYR  52           HH       TYR  52   3.132  -1.883  -8.912
  386    H    GLY  53           H        GLY  53   2.455   0.388  -2.129
  387   1HA   GLY  53          1HA       GLY  53   4.702  -0.699  -3.483
  388   2HA   GLY  53          2HA       GLY  53   5.196   0.366  -2.181
  389    H    PHE  54           H        PHE  54   5.692  -2.444  -2.264
  390    HA   PHE  54           HA       PHE  54   3.765  -3.627  -0.475
  391   1HB   PHE  54          1HB       PHE  54   6.363  -4.725  -1.529
  392   2HB   PHE  54          2HB       PHE  54   5.161  -5.648  -0.630
  393    HD1  PHE  54           HD1      PHE  54   2.673  -5.314  -1.670
  394    HD2  PHE  54           HD2      PHE  54   6.347  -5.025  -3.799
  395    HE1  PHE  54           HE1      PHE  54   1.485  -5.796  -3.767
  396    HE2  PHE  54           HE2      PHE  54   5.161  -5.512  -5.912
  397    HZ   PHE  54           HZ       PHE  54   2.741  -5.898  -5.895
  398    H    CYS  55           H        CYS  55   4.049  -4.032   1.722
  399    HA   CYS  55           HA       CYS  55   6.371  -2.643   2.855
  400   1HB   CYS  55          1HB       CYS  55   4.498  -2.703   4.874
  401   2HB   CYS  55          2HB       CYS  55   4.835  -1.345   3.802
  402    HA   PRO  56           HA       PRO  56   5.915  -6.217   6.024
  403   1HB   PRO  56          1HB       PRO  56   4.056  -8.148   4.922
  404   2HB   PRO  56          2HB       PRO  56   4.099  -7.431   6.526
  405   1HG   PRO  56          1HG       PRO  56   2.191  -6.778   4.765
  406   2HG   PRO  56          2HG       PRO  56   2.877  -5.578   5.877
  407   1HD   PRO  56          1HD       PRO  56   3.518  -6.049   2.974
  408   2HD   PRO  56          2HD       PRO  56   3.229  -4.515   3.827
  409    H    HIS  57           H        HIS  57   7.833  -6.185   4.443
  410    HA   HIS  57           HA       HIS  57   8.400  -8.962   3.727
  411   1HB   HIS  57          1HB       HIS  57   9.082  -6.571   2.075
  412   2HB   HIS  57          2HB       HIS  57   9.769  -8.155   1.804
  413    HD1  HIS  57           HD1      HIS  57   6.288  -6.575   1.911
  414    HD2  HIS  57           HD2      HIS  57   8.383  -9.599  -0.021
  415    HE1  HIS  57           HE1      HIS  57   4.698  -7.508   0.197
  416    H    GLU  58           H        GLU  58  10.185  -5.968   3.452
  417    HA   GLU  58           HA       GLU  58  11.672  -6.332   5.843
  418   1HB   GLU  58          1HB       GLU  58  13.850  -6.251   4.532
  419   2HB   GLU  58          2HB       GLU  58  13.010  -7.785   4.580
  420   1HG   GLU  58          1HG       GLU  58  12.153  -7.406   2.350
  421   2HG   GLU  58          2HG       GLU  58  12.936  -5.826   2.303
  422    H    ALA  59           H        ALA  59  12.897  -4.409   6.346
  423    HA   ALA  59           HA       ALA  59  11.785  -2.068   5.018
  424   1HB   ALA  59          1HB       ALA  59  13.608  -2.005   7.400
  425   2HB   ALA  59          2HB       ALA  59  11.890  -2.377   7.557
  426   3HB   ALA  59          3HB       ALA  59  12.401  -0.823   6.900
  Start of MODEL   46
    1   1H    ARG   1          1H        ARG   1   9.577   3.897  10.029
    2   2H    ARG   1          2H        ARG   1   8.287   3.382  11.042
    3   3H    ARG   1          3H        ARG   1   8.607   5.062  10.834
    4    HA   ARG   1           HA       ARG   1   7.056   3.289   9.279
    5   1HB   ARG   1          1HB       ARG   1   6.380   5.451  10.304
    6   2HB   ARG   1          2HB       ARG   1   7.506   6.285   9.240
    7   1HG   ARG   1          1HG       ARG   1   6.216   5.498   7.299
    8   2HG   ARG   1          2HG       ARG   1   5.067   4.722   8.397
    9   1HD   ARG   1          1HD       ARG   1   4.504   6.869   9.365
   10   2HD   ARG   1          2HD       ARG   1   5.721   7.670   8.382
   11    HE   ARG   1           HE       ARG   1   3.830   6.318   6.738
   12   1HH1  ARG   1          1HH1      ARG   1   4.321   9.153   8.721
   13   2HH1  ARG   1          2HH1      ARG   1   3.144  10.114   7.881
   14   1HH2  ARG   1          1HH2      ARG   1   2.280   7.604   5.600
   15   2HH2  ARG   1          2HH2      ARG   1   1.994   9.239   6.112
   16    H    ILE   2           H        ILE   2   8.497   2.132   7.967
   17    HA   ILE   2           HA       ILE   2   9.096   3.422   5.479
   18    HB   ILE   2           HB       ILE   2  11.105   4.023   6.749
   19   1HG1  ILE   2          1HG1      ILE   2  11.623   1.933   4.623
   20   2HG1  ILE   2          2HG1      ILE   2  11.348   3.653   4.358
   21   1HG2  ILE   2          1HG2      ILE   2  11.005   1.220   7.554
   22   2HG2  ILE   2          2HG2      ILE   2  11.730   2.616   8.358
   23   3HG2  ILE   2          3HG2      ILE   2  12.613   1.775   7.082
   24   1HD1  ILE   2          1HD1      ILE   2  13.469   4.178   4.819
   25   2HD1  ILE   2          2HD1      ILE   2  13.778   2.464   4.541
   26   3HD1  ILE   2          3HD1      ILE   2  13.550   3.060   6.184
   27    HA   PRO   3           HA       PRO   3   8.341  -1.184   5.392
   28   1HB   PRO   3          1HB       PRO   3   5.537  -1.074   5.227
   29   2HB   PRO   3          2HB       PRO   3   6.487  -1.476   6.659
   30   1HG   PRO   3          1HG       PRO   3   4.871   0.781   6.358
   31   2HG   PRO   3          2HG       PRO   3   6.123   0.559   7.593
   32   1HD   PRO   3          1HD       PRO   3   6.290   2.010   4.964
   33   2HD   PRO   3          2HD       PRO   3   6.984   2.455   6.546
   34    H    VAL   4           H        VAL   4   8.815   0.699   3.183
   35    HA   VAL   4           HA       VAL   4   7.105  -0.639   1.178
   36    HB   VAL   4           HB       VAL   4   8.302   2.131   0.773
   37   1HG1  VAL   4          1HG1      VAL   4   6.387   0.388  -0.764
   38   2HG1  VAL   4          2HG1      VAL   4   7.912   1.094  -1.301
   39   3HG1  VAL   4          3HG1      VAL   4   6.506   2.127  -1.040
   40   1HG2  VAL   4          1HG2      VAL   4   6.700   2.903   2.151
   41   2HG2  VAL   4          2HG2      VAL   4   5.833   1.369   2.168
   42   3HG2  VAL   4          3HG2      VAL   4   5.582   2.509   0.847
   43    H    LYS   5           H        LYS   5   8.137  -1.733  -0.376
   44    HA   LYS   5           HA       LYS   5  11.036  -1.270  -0.660
   45   1HB   LYS   5          1HB       LYS   5   9.969  -3.511   0.496
   46   2HB   LYS   5          2HB       LYS   5  10.091  -4.015  -1.181
   47   1HG   LYS   5          1HG       LYS   5  12.342  -3.057   0.581
   48   2HG   LYS   5          2HG       LYS   5  12.057  -4.701   0.026
   49   1HD   LYS   5          1HD       LYS   5  13.552  -4.166  -1.572
   50   2HD   LYS   5          2HD       LYS   5  12.160  -3.408  -2.347
   51   1HE   LYS   5          1HE       LYS   5  12.807  -1.293  -1.101
   52   2HE   LYS   5          2HE       LYS   5  14.321  -2.100  -0.706
   53   1HZ   LYS   5          1HZ       LYS   5  15.117  -1.720  -2.736
   54   2HZ   LYS   5          2HZ       LYS   5  13.809  -0.653  -2.963
   55   3HZ   LYS   5          3HZ       LYS   5  13.693  -2.253  -3.504
   56    H    TYR   6           H        TYR   6   8.586  -3.300  -2.278
   57    HA   TYR   6           HA       TYR   6   9.725  -2.546  -4.835
   58   1HB   TYR   6          1HB       TYR   6   7.551  -4.551  -4.193
   59   2HB   TYR   6          2HB       TYR   6   8.297  -4.316  -5.771
   60    HD1  TYR   6           HD1      TYR   6   8.956  -5.463  -2.307
   61    HD2  TYR   6           HD2      TYR   6  10.395  -5.276  -6.306
   62    HE1  TYR   6           HE1      TYR   6  10.736  -7.042  -1.734
   63    HE2  TYR   6           HE2      TYR   6  12.174  -6.852  -5.745
   64    HH   TYR   6           HH       TYR   6  12.199  -8.771  -3.138
   65    H    GLY   7           H        GLY   7   8.187  -2.203  -6.681
   66   1HA   GLY   7          1HA       GLY   7   6.084  -1.305  -7.455
   67   2HA   GLY   7          2HA       GLY   7   5.882  -0.510  -5.900
   68    H    ASN   8           H        ASN   8   5.615   1.517  -7.032
   69    HA   ASN   8           HA       ASN   8   8.034   2.416  -8.369
   70   1HB   ASN   8          1HB       ASN   8   6.784   4.338  -9.224
   71   2HB   ASN   8          2HB       ASN   8   5.982   2.825  -9.617
   72   1HD2  ASN   8          1HD2      ASN   8   4.862   5.457  -9.572
   73   2HD2  ASN   8          2HD2      ASN   8   3.581   5.441  -8.410
   74    H    ALA   9           H        ALA   9   6.589   2.614  -5.394
   75    HA   ALA   9           HA       ALA   9   7.674   5.150  -4.537
   76   1HB   ALA   9          1HB       ALA   9   6.754   2.981  -2.701
   77   2HB   ALA   9          2HB       ALA   9   5.566   3.893  -3.655
   78   3HB   ALA   9          3HB       ALA   9   6.614   4.738  -2.510
   79    H    ASP  10           H        ASP  10   9.662   5.417  -3.555
   80    HA   ASP  10           HA       ASP  10  11.075   2.985  -2.700
   81   1HB   ASP  10          1HB       ASP  10  13.193   3.787  -3.616
   82   2HB   ASP  10          2HB       ASP  10  11.998   3.580  -4.888
   83    H    GLY  11           H        GLY  11  10.410   6.323  -2.269
   84   1HA   GLY  11          1HA       GLY  11  11.962   6.277   0.223
   85   2HA   GLY  11          2HA       GLY  11  11.739   7.738  -0.732
   86    H    GLU  12           H        GLU  12   8.945   6.631  -1.269
   87    HA   GLU  12           HA       GLU  12   7.595   8.143   0.712
   88   1HB   GLU  12          1HB       GLU  12   6.576   6.230  -1.402
   89   2HB   GLU  12          2HB       GLU  12   5.537   7.225  -0.398
   90   1HG   GLU  12          1HG       GLU  12   5.683   8.376  -2.415
   91   2HG   GLU  12          2HG       GLU  12   6.796   9.228  -1.350
   92    H    TYR  13           H        TYR  13   6.403   7.482   2.443
   93    HA   TYR  13           HA       TYR  13   6.807   4.711   3.283
   94   1HB   TYR  13          1HB       TYR  13   5.736   6.073   5.452
   95   2HB   TYR  13          2HB       TYR  13   7.412   5.575   5.220
   96    HD1  TYR  13           HD1      TYR  13   9.017   7.204   4.140
   97    HD2  TYR  13           HD2      TYR  13   5.154   8.332   5.514
   98    HE1  TYR  13           HE1      TYR  13   9.727   9.566   4.180
   99    HE2  TYR  13           HE2      TYR  13   5.848  10.699   5.559
  100    HH   TYR  13           HH       TYR  13   9.176  11.642   5.063
  101    H    CYS  14           H        CYS  14   4.963   3.727   4.541
  102    HA   CYS  14           HA       CYS  14   2.685   3.703   2.896
  103   1HB   CYS  14          1HB       CYS  14   3.126   2.581   5.660
  104   2HB   CYS  14          2HB       CYS  14   1.700   2.259   4.683
  105    H    LYS  15           H        LYS  15   0.674   4.512   3.091
  106    HA   LYS  15           HA       LYS  15   0.313   6.727   4.968
  107   1HB   LYS  15          1HB       LYS  15  -0.163   7.141   2.588
  108   2HB   LYS  15          2HB       LYS  15  -1.347   5.838   2.591
  109   1HG   LYS  15          1HG       LYS  15  -2.487   7.934   2.691
  110   2HG   LYS  15          2HG       LYS  15  -2.675   7.112   4.242
  111   1HD   LYS  15          1HD       LYS  15  -0.855   8.498   5.166
  112   2HD   LYS  15          2HD       LYS  15  -0.726   9.335   3.619
  113   1HE   LYS  15          1HE       LYS  15  -2.041  10.642   5.212
  114   2HE   LYS  15          2HE       LYS  15  -3.032  10.124   3.848
  115   1HZ   LYS  15          1HZ       LYS  15  -3.625   8.155   5.389
  116   2HZ   LYS  15          2HZ       LYS  15  -4.374   9.653   5.660
  117   3HZ   LYS  15          3HZ       LYS  15  -3.071   9.164   6.638
  118    H    PHE  16           H        PHE  16  -0.405   6.030   6.892
  119    HA   PHE  16           HA       PHE  16  -2.598   4.053   6.902
  120   1HB   PHE  16          1HB       PHE  16  -0.425   4.577   8.942
  121   2HB   PHE  16          2HB       PHE  16  -1.817   3.546   9.251
  122    HD1  PHE  16           HD1      PHE  16   0.842   2.510   9.616
  123    HD2  PHE  16           HD2      PHE  16  -1.481   2.733   6.060
  124    HE1  PHE  16           HE1      PHE  16   2.070   0.596   8.708
  125    HE2  PHE  16           HE2      PHE  16  -0.258   0.820   5.135
  126    HZ   PHE  16           HZ       PHE  16   1.535  -0.285   6.455
  127    HA   PRO  17           HA       PRO  17  -4.323   3.885   6.877
  128   1HB   PRO  17          1HB       PRO  17  -6.895   4.498   6.657
  129   2HB   PRO  17          2HB       PRO  17  -6.236   3.920   8.194
  130   1HG   PRO  17          1HG       PRO  17  -6.992   6.699   7.396
  131   2HG   PRO  17          2HG       PRO  17  -7.121   5.908   8.977
  132   1HD   PRO  17          1HD       PRO  17  -5.065   7.647   8.120
  133   2HD   PRO  17          2HD       PRO  17  -5.068   6.646   9.586
  134    H    PHE  18           H        PHE  18  -5.339   3.652   4.776
  135    HA   PHE  18           HA       PHE  18  -5.290   6.094   3.143
  136   1HB   PHE  18          1HB       PHE  18  -4.147   4.999   1.333
  137   2HB   PHE  18          2HB       PHE  18  -3.179   4.838   2.788
  138    HD1  PHE  18           HD1      PHE  18  -5.361   3.042   0.427
  139    HD2  PHE  18           HD2      PHE  18  -2.632   2.721   3.675
  140    HE1  PHE  18           HE1      PHE  18  -5.189   0.625   0.037
  141    HE2  PHE  18           HE2      PHE  18  -2.458   0.303   3.297
  142    HZ   PHE  18           HZ       PHE  18  -3.731  -0.769   1.465
  143    H    LEU  19           H        LEU  19  -6.607   5.990   1.214
  144    HA   LEU  19           HA       LEU  19  -9.017   4.432   1.728
  145   1HB   LEU  19          1HB       LEU  19  -9.074   6.894   1.352
  146   2HB   LEU  19          2HB       LEU  19  -8.527   6.619  -0.292
  147    HG   LEU  19           HG       LEU  19 -10.612   5.202  -0.607
  148   1HD1  LEU  19          1HD1      LEU  19 -11.373   4.726   1.531
  149   2HD1  LEU  19          2HD1      LEU  19 -12.471   5.994   0.989
  150   3HD1  LEU  19          3HD1      LEU  19 -11.151   6.378   2.092
  151   1HD2  LEU  19          1HD2      LEU  19 -11.002   7.088  -1.744
  152   2HD2  LEU  19          2HD2      LEU  19 -10.341   8.109  -0.464
  153   3HD2  LEU  19          3HD2      LEU  19 -12.008   7.539  -0.373
  154    H    PHE  20           H        PHE  20  -9.433   2.596   0.713
  155    HA   PHE  20           HA       PHE  20  -8.531   2.244  -2.079
  156   1HB   PHE  20          1HB       PHE  20  -7.213   0.852  -0.342
  157   2HB   PHE  20          2HB       PHE  20  -8.743   0.030  -0.073
  158    HD1  PHE  20           HD1      PHE  20  -6.959   1.069  -3.193
  159    HD2  PHE  20           HD2      PHE  20  -8.779  -2.013  -0.898
  160    HE1  PHE  20           HE1      PHE  20  -6.536  -0.543  -5.005
  161    HE2  PHE  20           HE2      PHE  20  -8.349  -3.633  -2.702
  162    HZ   PHE  20           HZ       PHE  20  -7.228  -2.892  -4.762
  163    H    ASN  21           H        ASN  21 -10.466   2.405  -3.145
  164    HA   ASN  21           HA       ASN  21 -12.608   2.013  -3.797
  165   1HB   ASN  21          1HB       ASN  21 -12.083  -0.603  -2.378
  166   2HB   ASN  21          2HB       ASN  21 -13.523  -0.284  -3.339
  167   1HD2  ASN  21          1HD2      ASN  21 -10.670  -1.773  -3.438
  168   2HD2  ASN  21          2HD2      ASN  21 -10.310  -1.660  -5.125
  169    H    GLY  22           H        GLY  22 -12.117   3.255  -1.112
  170   1HA   GLY  22          1HA       GLY  22 -13.811   4.319   0.162
  171   2HA   GLY  22          2HA       GLY  22 -14.872   2.959  -0.160
  172    H    LYS  23           H        LYS  23 -12.016   1.591   0.641
  173    HA   LYS  23           HA       LYS  23 -12.808   1.450   3.471
  174   1HB   LYS  23          1HB       LYS  23 -12.898  -0.697   2.148
  175   2HB   LYS  23          2HB       LYS  23 -11.151  -0.586   1.968
  176   1HG   LYS  23          1HG       LYS  23 -10.959  -0.604   4.457
  177   2HG   LYS  23          2HG       LYS  23 -12.696  -0.888   4.542
  178   1HD   LYS  23          1HD       LYS  23 -12.390  -2.963   3.246
  179   2HD   LYS  23          2HD       LYS  23 -10.646  -2.681   3.245
  180   1HE   LYS  23          1HE       LYS  23 -10.825  -2.604   5.788
  181   2HE   LYS  23          2HE       LYS  23 -12.445  -3.267   5.587
  182   1HZ   LYS  23          1HZ       LYS  23 -10.815  -4.885   4.060
  183   2HZ   LYS  23          2HZ       LYS  23 -11.483  -5.261   5.576
  184   3HZ   LYS  23          3HZ       LYS  23  -9.922  -4.604   5.482
  185    H    GLU  24           H        GLU  24 -11.394   2.097   5.004
  186    HA   GLU  24           HA       GLU  24  -8.806   3.087   4.078
  187   1HB   GLU  24          1HB       GLU  24 -10.362   3.581   6.612
  188   2HB   GLU  24          2HB       GLU  24  -8.753   4.227   6.322
  189   1HG   GLU  24          1HG       GLU  24  -9.551   5.507   4.467
  190   2HG   GLU  24          2HG       GLU  24 -11.144   4.757   4.575
  191    H    TYR  25           H        TYR  25  -7.033   1.944   4.393
  192    HA   TYR  25           HA       TYR  25  -7.080  -0.216   6.368
  193   1HB   TYR  25          1HB       TYR  25  -5.171   0.290   4.099
  194   2HB   TYR  25          2HB       TYR  25  -5.071  -1.068   5.203
  195    HD1  TYR  25           HD1      TYR  25  -7.139  -2.621   5.309
  196    HD2  TYR  25           HD2      TYR  25  -6.372   0.107   2.143
  197    HE1  TYR  25           HE1      TYR  25  -8.649  -3.905   3.842
  198    HE2  TYR  25           HE2      TYR  25  -7.876  -1.170   0.664
  199    HH   TYR  25           HH       TYR  25  -8.873  -4.235   1.264
  200    H    ASN  26           H        ASN  26  -6.010  -0.065   8.176
  201    HA   ASN  26           HA       ASN  26  -4.226   2.203   8.595
  202   1HB   ASN  26          1HB       ASN  26  -5.146   0.166  10.633
  203   2HB   ASN  26          2HB       ASN  26  -4.448   1.754  10.947
  204   1HD2  ASN  26          1HD2      ASN  26  -5.795   3.393  11.254
  205   2HD2  ASN  26          2HD2      ASN  26  -7.478   3.400  10.866
  206    H    SER  27           H        SER  27  -3.834  -0.601   7.256
  207    HA   SER  27           HA       SER  27  -1.056  -0.860   7.983
  208   1HB   SER  27          1HB       SER  27  -1.374  -3.381   8.351
  209   2HB   SER  27          2HB       SER  27  -1.896  -2.324   9.666
  210    HG   SER  27           HG       SER  27  -3.334  -4.139   8.478
  211    H    CYS  28           H        CYS  28  -0.348  -3.105   6.693
  212    HA   CYS  28           HA       CYS  28  -0.924  -2.437   3.936
  213   1HB   CYS  28          1HB       CYS  28   0.788  -4.687   5.010
  214   2HB   CYS  28          2HB       CYS  28   0.797  -4.049   3.369
  215    H    THR  29           H        THR  29  -2.206  -3.553   2.557
  216    HA   THR  29           HA       THR  29  -3.497  -5.961   3.612
  217    HB   THR  29           HB       THR  29  -5.032  -4.055   3.527
  218    HG1  THR  29           HG1      THR  29  -6.144  -5.860   3.156
  219   1HG2  THR  29          1HG2      THR  29  -5.509  -2.758   1.716
  220   2HG2  THR  29          2HG2      THR  29  -5.037  -4.005   0.558
  221   3HG2  THR  29          3HG2      THR  29  -3.800  -3.084   1.413
  222    H    ASP  30           H        ASP  30  -4.350  -7.436   1.896
  223    HA   ASP  30           HA       ASP  30  -2.495  -7.504  -0.368
  224   1HB   ASP  30          1HB       ASP  30  -3.932  -9.962   0.030
  225   2HB   ASP  30          2HB       ASP  30  -2.238  -9.717  -0.226
  226    H    THR  31           H        THR  31  -5.349  -6.402   0.269
  227    HA   THR  31           HA       THR  31  -7.141  -7.684  -1.493
  228    HB   THR  31           HB       THR  31  -7.161  -4.781  -0.683
  229    HG1  THR  31           HG1      THR  31  -7.022  -5.845   1.219
  230   1HG2  THR  31          1HG2      THR  31  -9.309  -4.658  -1.284
  231   2HG2  THR  31          2HG2      THR  31  -9.659  -6.303  -0.758
  232   3HG2  THR  31          3HG2      THR  31  -8.905  -6.020  -2.326
  233    H    GLY  32           H        GLY  32  -7.630  -7.312  -3.623
  234   1HA   GLY  32          1HA       GLY  32  -7.505  -6.309  -5.717
  235   2HA   GLY  32          2HA       GLY  32  -6.341  -5.164  -5.068
  236    H    ARG  33           H        ARG  33  -4.980  -7.702  -3.910
  237    HA   ARG  33           HA       ARG  33  -3.302  -8.190  -6.267
  238   1HB   ARG  33          1HB       ARG  33  -2.769  -9.037  -3.412
  239   2HB   ARG  33          2HB       ARG  33  -1.614  -8.942  -4.737
  240   1HG   ARG  33          1HG       ARG  33  -2.981  -6.642  -3.359
  241   2HG   ARG  33          2HG       ARG  33  -1.281  -7.092  -3.225
  242   1HD   ARG  33          1HD       ARG  33  -2.682  -6.145  -5.725
  243   2HD   ARG  33          2HD       ARG  33  -1.596  -5.180  -4.723
  244    HE   ARG  33           HE       ARG  33  -0.343  -7.581  -5.632
  245   1HH1  ARG  33          1HH1      ARG  33  -1.224  -4.327  -6.538
  246   2HH1  ARG  33          2HH1      ARG  33  -0.062  -4.228  -7.824
  247   1HH2  ARG  33          1HH2      ARG  33   1.236  -7.438  -7.285
  248   2HH2  ARG  33          2HH2      ARG  33   1.358  -5.990  -8.237
  249    H    SER  34           H        SER  34  -3.001 -10.213  -7.108
  250    HA   SER  34           HA       SER  34  -4.993 -12.185  -6.373
  251   1HB   SER  34          1HB       SER  34  -2.945 -12.310  -8.596
  252   2HB   SER  34          2HB       SER  34  -4.371 -13.326  -8.415
  253    HG   SER  34           HG       SER  34  -5.576 -11.246  -8.506
  254    H    ASP  35           H        ASP  35  -1.584 -11.665  -5.897
  255    HA   ASP  35           HA       ASP  35  -1.281 -14.428  -5.042
  256   1HB   ASP  35          1HB       ASP  35   0.584 -12.434  -6.076
  257   2HB   ASP  35          2HB       ASP  35   1.216 -13.576  -4.914
  258    H    GLY  36           H        GLY  36  -2.485 -12.103  -3.497
  259   1HA   GLY  36          1HA       GLY  36  -2.569 -11.428  -1.308
  260   2HA   GLY  36          2HA       GLY  36  -1.763 -12.945  -0.954
  261    H    PHE  37           H        PHE  37  -0.702  -9.934  -2.577
  262    HA   PHE  37           HA       PHE  37   1.681  -9.996  -0.876
  263   1HB   PHE  37          1HB       PHE  37   1.065  -8.791  -3.536
  264   2HB   PHE  37          2HB       PHE  37   2.287  -8.010  -2.540
  265    HD1  PHE  37           HD1      PHE  37   3.995  -9.806  -1.471
  266    HD2  PHE  37           HD2      PHE  37   1.811 -10.265  -5.089
  267    HE1  PHE  37           HE1      PHE  37   5.670 -11.424  -2.265
  268    HE2  PHE  37           HE2      PHE  37   3.480 -11.890  -5.900
  269    HZ   PHE  37           HZ       PHE  37   5.409 -12.473  -4.483
  270    H    LEU  38           H        LEU  38   2.024  -8.531   0.689
  271    HA   LEU  38           HA       LEU  38  -0.119  -6.743   1.357
  272   1HB   LEU  38          1HB       LEU  38   2.460  -7.486   2.629
  273   2HB   LEU  38          2HB       LEU  38   1.641  -6.041   3.164
  274    HG   LEU  38           HG       LEU  38  -0.376  -7.481   3.648
  275   1HD1  LEU  38          1HD1      LEU  38  -0.414  -9.584   2.975
  276   2HD1  LEU  38          2HD1      LEU  38   0.988  -9.939   3.987
  277   3HD1  LEU  38          3HD1      LEU  38   1.209  -9.421   2.313
  278   1HD2  LEU  38          1HD2      LEU  38   1.703  -8.664   5.328
  279   2HD2  LEU  38          2HD2      LEU  38   0.333  -7.641   5.764
  280   3HD2  LEU  38          3HD2      LEU  38   1.823  -6.914   5.165
  281    H    TRP  39           H        TRP  39  -0.353  -4.753   0.655
  282    HA   TRP  39           HA       TRP  39   2.058  -3.210  -0.011
  283   1HB   TRP  39          1HB       TRP  39   0.968  -2.282  -1.991
  284   2HB   TRP  39          2HB       TRP  39   1.071  -4.031  -2.117
  285    HD1  TRP  39           HD1      TRP  39  -1.285  -5.412  -1.847
  286    HE1  TRP  39           HE1      TRP  39  -3.710  -4.680  -2.303
  287    HE3  TRP  39           HE3      TRP  39  -0.609  -0.357  -1.850
  288    HZ2  TRP  39           HZ2      TRP  39  -5.139  -2.258  -2.606
  289    HZ3  TRP  39           HZ3      TRP  39  -2.553   1.091  -2.217
  290    HH2  TRP  39           HH2      TRP  39  -4.771   0.155  -2.584
  291    H    CYS  40           H        CYS  40   1.487  -0.845  -0.290
  292    HA   CYS  40           HA       CYS  40  -0.775   0.043   1.304
  293   1HB   CYS  40          1HB       CYS  40   0.590   1.357   2.832
  294   2HB   CYS  40          2HB       CYS  40   1.046  -0.338   2.946
  295    H    SER  41           H        SER  41  -1.373   2.172   0.841
  296    HA   SER  41           HA       SER  41  -0.262   3.195  -1.633
  297   1HB   SER  41          1HB       SER  41  -2.724   3.154  -1.270
  298   2HB   SER  41          2HB       SER  41  -2.527   4.289   0.064
  299    HG   SER  41           HG       SER  41  -2.640   5.790  -1.389
  300    H    THR  42           H        THR  42   0.215   5.518  -1.820
  301    HA   THR  42           HA       THR  42   1.854   6.376   0.450
  302    HB   THR  42           HB       THR  42   1.737   7.415  -2.393
  303    HG1  THR  42           HG1      THR  42   3.766   5.815  -1.244
  304   1HG2  THR  42          1HG2      THR  42   4.222   8.003  -1.471
  305   2HG2  THR  42          2HG2      THR  42   3.229   8.306  -0.045
  306   3HG2  THR  42          3HG2      THR  42   2.878   9.137  -1.560
  307    H    THR  43           H        THR  43  -0.686   7.456  -1.711
  308    HA   THR  43           HA       THR  43  -1.119   9.875  -0.129
  309    HB   THR  43           HB       THR  43  -2.607  10.516  -1.996
  310    HG1  THR  43           HG1      THR  43  -3.076   9.149  -3.588
  311   1HG2  THR  43          1HG2      THR  43  -0.910  10.321  -3.912
  312   2HG2  THR  43          2HG2      THR  43   0.151   9.601  -2.702
  313   3HG2  THR  43          3HG2      THR  43  -0.452  11.242  -2.477
  314    H    TYR  44           H        TYR  44  -3.783  10.305  -0.364
  315    HA   TYR  44           HA       TYR  44  -4.871   8.348   1.443
  316   1HB   TYR  44          1HB       TYR  44  -5.400  10.760   1.680
  317   2HB   TYR  44          2HB       TYR  44  -6.240  10.710   0.129
  318    HD1  TYR  44           HD1      TYR  44  -6.242   8.647   3.271
  319    HD2  TYR  44           HD2      TYR  44  -8.547  10.707   0.343
  320    HE1  TYR  44           HE1      TYR  44  -8.301   7.966   4.419
  321    HE2  TYR  44           HE2      TYR  44 -10.612  10.033   1.488
  322    HH   TYR  44           HH       TYR  44 -10.515   7.935   4.355
  323    H    ASN  45           H        ASN  45  -6.240   9.656  -1.598
  324    HA   ASN  45           HA       ASN  45  -7.699   7.202  -2.004
  325   1HB   ASN  45          1HB       ASN  45  -8.554   9.499  -2.653
  326   2HB   ASN  45          2HB       ASN  45  -7.376   9.501  -3.944
  327   1HD2  ASN  45          1HD2      ASN  45  -7.997   6.470  -4.206
  328   2HD2  ASN  45          2HD2      ASN  45  -9.436   6.553  -5.105
  329    H    PHE  46           H        PHE  46  -6.482   5.484  -2.546
  330    HA   PHE  46           HA       PHE  46  -4.013   5.556  -3.860
  331   1HB   PHE  46          1HB       PHE  46  -4.569   3.646  -2.538
  332   2HB   PHE  46          2HB       PHE  46  -6.001   3.297  -3.533
  333    HD1  PHE  46           HD1      PHE  46  -5.739   1.487  -4.933
  334    HD2  PHE  46           HD2      PHE  46  -2.329   3.898  -4.105
  335    HE1  PHE  46           HE1      PHE  46  -4.362   0.031  -6.355
  336    HE2  PHE  46           HE2      PHE  46  -0.961   2.454  -5.525
  337    HZ   PHE  46           HZ       PHE  46  -1.975   0.510  -6.651
  338    H    GLU  47           H        GLU  47  -7.162   4.567  -5.191
  339    HA   GLU  47           HA       GLU  47  -6.402   3.969  -7.772
  340   1HB   GLU  47          1HB       GLU  47  -8.649   3.653  -6.725
  341   2HB   GLU  47          2HB       GLU  47  -8.953   5.364  -6.963
  342   1HG   GLU  47          1HG       GLU  47  -8.628   5.005  -9.406
  343   2HG   GLU  47          2HG       GLU  47  -8.565   3.273  -9.084
  344    H    LYS  48           H        LYS  48  -7.389   7.100  -6.504
  345    HA   LYS  48           HA       LYS  48  -7.316   8.494  -8.928
  346   1HB   LYS  48          1HB       LYS  48  -8.558   9.423  -7.148
  347   2HB   LYS  48          2HB       LYS  48  -7.213   9.313  -6.030
  348   1HG   LYS  48          1HG       LYS  48  -6.090  11.158  -7.228
  349   2HG   LYS  48          2HG       LYS  48  -7.492  11.299  -8.300
  350   1HD   LYS  48          1HD       LYS  48  -7.495  11.639  -5.301
  351   2HD   LYS  48          2HD       LYS  48  -7.608  12.931  -6.500
  352   1HE   LYS  48          1HE       LYS  48  -9.743  12.116  -7.260
  353   2HE   LYS  48          2HE       LYS  48  -9.595  10.672  -6.263
  354   1HZ   LYS  48          1HZ       LYS  48 -10.444  13.341  -5.539
  355   2HZ   LYS  48          2HZ       LYS  48  -9.359  12.636  -4.442
  356   3HZ   LYS  48          3HZ       LYS  48 -10.818  11.844  -4.818
  357    H    ASP  49           H        ASP  49  -4.782   8.069  -6.448
  358    HA   ASP  49           HA       ASP  49  -2.975   9.735  -8.004
  359   1HB   ASP  49          1HB       ASP  49  -2.788   8.478  -5.287
  360   2HB   ASP  49          2HB       ASP  49  -1.383   9.216  -6.058
  361    H    GLY  50           H        GLY  50  -2.863   6.399  -6.707
  362   1HA   GLY  50          1HA       GLY  50  -2.205   4.522  -7.949
  363   2HA   GLY  50          2HA       GLY  50  -1.504   5.595  -9.143
  364    H    LYS  51           H        LYS  51  -0.599   6.285  -5.904
  365    HA   LYS  51           HA       LYS  51   2.059   5.210  -6.466
  366   1HB   LYS  51          1HB       LYS  51   1.064   7.221  -4.448
  367   2HB   LYS  51          2HB       LYS  51   2.684   6.552  -4.384
  368   1HG   LYS  51          1HG       LYS  51   2.804   8.658  -5.465
  369   2HG   LYS  51          2HG       LYS  51   3.047   7.411  -6.689
  370   1HD   LYS  51          1HD       LYS  51   0.565   7.652  -7.191
  371   2HD   LYS  51          2HD       LYS  51   0.618   9.116  -6.204
  372   1HE   LYS  51          1HE       LYS  51   2.195  10.139  -7.669
  373   2HE   LYS  51          2HE       LYS  51   2.432   8.635  -8.562
  374   1HZ   LYS  51          1HZ       LYS  51   0.399  10.637  -8.877
  375   2HZ   LYS  51          2HZ       LYS  51  -0.244   9.072  -8.739
  376   3HZ   LYS  51          3HZ       LYS  51   0.894   9.411  -9.944
  377    H    TYR  52           H        TYR  52   2.778   3.390  -5.501
  378    HA   TYR  52           HA       TYR  52   1.686   2.559  -2.938
  379   1HB   TYR  52          1HB       TYR  52   0.892   0.416  -3.754
  380   2HB   TYR  52          2HB       TYR  52   0.119   1.692  -4.685
  381    HD1  TYR  52           HD1      TYR  52   2.644  -0.989  -4.785
  382    HD2  TYR  52           HD2      TYR  52   0.567   1.962  -7.042
  383    HE1  TYR  52           HE1      TYR  52   3.483  -1.998  -6.860
  384    HE2  TYR  52           HE2      TYR  52   1.403   0.959  -9.121
  385    HH   TYR  52           HH       TYR  52   2.205  -1.466  -9.795
  386    H    GLY  53           H        GLY  53   2.613   0.305  -2.428
  387   1HA   GLY  53          1HA       GLY  53   5.017  -0.549  -3.608
  388   2HA   GLY  53          2HA       GLY  53   5.367   0.420  -2.185
  389    H    PHE  54           H        PHE  54   5.960  -2.361  -2.429
  390    HA   PHE  54           HA       PHE  54   3.888  -3.630  -0.838
  391   1HB   PHE  54          1HB       PHE  54   6.366  -4.818  -2.060
  392   2HB   PHE  54          2HB       PHE  54   5.128  -5.720  -1.197
  393    HD1  PHE  54           HD1      PHE  54   2.649  -5.038  -2.094
  394    HD2  PHE  54           HD2      PHE  54   6.255  -5.023  -4.349
  395    HE1  PHE  54           HE1      PHE  54   1.351  -5.268  -4.172
  396    HE2  PHE  54           HE2      PHE  54   4.969  -5.252  -6.428
  397    HZ   PHE  54           HZ       PHE  54   2.507  -5.378  -6.345
  398    H    CYS  55           H        CYS  55   4.118  -4.418   1.165
  399    HA   CYS  55           HA       CYS  55   6.236  -3.216   2.754
  400   1HB   CYS  55          1HB       CYS  55   3.905  -4.889   3.709
  401   2HB   CYS  55          2HB       CYS  55   4.861  -3.745   4.645
  402    HA   PRO  56           HA       PRO  56   8.604  -6.916   3.223
  403   1HB   PRO  56          1HB       PRO  56   9.528  -6.692   5.753
  404   2HB   PRO  56          2HB       PRO  56  10.136  -5.715   4.419
  405   1HG   PRO  56          1HG       PRO  56   8.191  -4.987   6.562
  406   2HG   PRO  56          2HG       PRO  56   9.478  -4.008   5.838
  407   1HD   PRO  56          1HD       PRO  56   6.849  -3.764   5.158
  408   2HD   PRO  56          2HD       PRO  56   8.183  -3.394   4.050
  409    H    HIS  57           H        HIS  57   7.132  -8.587   3.126
  410    HA   HIS  57           HA       HIS  57   5.608  -9.300   5.495
  411   1HB   HIS  57          1HB       HIS  57   4.741  -9.427   3.073
  412   2HB   HIS  57          2HB       HIS  57   5.744 -10.863   2.918
  413    HD1  HIS  57           HD1      HIS  57   3.254 -11.883   2.416
  414    HD2  HIS  57           HD2      HIS  57   4.124 -10.853   6.352
  415    HE1  HIS  57           HE1      HIS  57   1.546 -13.084   3.827
  416    H    GLU  58           H        GLU  58   6.061 -10.943   6.828
  417    HA   GLU  58           HA       GLU  58   8.669 -12.098   6.789
  418   1HB   GLU  58          1HB       GLU  58   7.767 -13.370   8.807
  419   2HB   GLU  58          2HB       GLU  58   7.818 -11.619   8.936
  420   1HG   GLU  58          1HG       GLU  58   5.286 -12.805   7.962
  421   2HG   GLU  58          2HG       GLU  58   5.701 -13.095   9.650
  422    H    ALA  59           H        ALA  59   9.042 -14.447   7.022
  423    HA   ALA  59           HA       ALA  59   7.386 -15.912   5.092
  424   1HB   ALA  59          1HB       ALA  59   9.274 -16.685   4.208
  425   2HB   ALA  59          2HB       ALA  59   9.844 -17.246   5.780
  426   3HB   ALA  59          3HB       ALA  59  10.152 -15.585   5.271
  Start of MODEL   47
    1   1H    ARG   1          1H        ARG   1   8.788   0.205  11.929
    2   2H    ARG   1          2H        ARG   1   7.578  -1.015  12.030
    3   3H    ARG   1          3H        ARG   1   7.391   0.457  12.890
    4    HA   ARG   1           HA       ARG   1   6.165   0.039  10.686
    5   1HB   ARG   1          1HB       ARG   1   6.452   2.125  12.239
    6   2HB   ARG   1          2HB       ARG   1   7.633   2.665  11.060
    7   1HG   ARG   1          1HG       ARG   1   4.929   1.940  10.058
    8   2HG   ARG   1          2HG       ARG   1   5.084   3.418  11.000
    9   1HD   ARG   1          1HD       ARG   1   5.542   4.356   9.014
   10   2HD   ARG   1          2HD       ARG   1   7.155   3.697   9.278
   11    HE   ARG   1           HE       ARG   1   6.816   2.390   7.448
   12   1HH1  ARG   1          1HH1      ARG   1   3.667   3.238   8.737
   13   2HH1  ARG   1          2HH1      ARG   1   2.803   2.245   7.614
   14   1HH2  ARG   1          1HH2      ARG   1   5.670   1.044   6.002
   15   2HH2  ARG   1          2HH2      ARG   1   3.941   0.926   6.116
   16    H    ILE   2           H        ILE   2   7.365  -1.322   9.203
   17    HA   ILE   2           HA       ILE   2   9.826  -0.525   8.060
   18    HB   ILE   2           HB       ILE   2   9.420  -2.279   6.320
   19   1HG1  ILE   2          1HG1      ILE   2   6.870  -1.874   6.418
   20   2HG1  ILE   2          2HG1      ILE   2   7.462  -3.505   6.121
   21   1HG2  ILE   2          1HG2      ILE   2  10.468  -3.481   7.994
   22   2HG2  ILE   2          2HG2      ILE   2   8.869  -4.185   8.210
   23   3HG2  ILE   2          3HG2      ILE   2   9.383  -2.849   9.230
   24   1HD1  ILE   2          1HD1      ILE   2   7.214  -3.772   8.691
   25   2HD1  ILE   2          2HD1      ILE   2   5.790  -3.859   7.652
   26   3HD1  ILE   2          3HD1      ILE   2   6.141  -2.379   8.545
   27    HA   PRO   3           HA       PRO   3   8.629   2.269   4.898
   28   1HB   PRO   3          1HB       PRO   3  10.666   2.047   3.195
   29   2HB   PRO   3          2HB       PRO   3  10.896   2.684   4.830
   30   1HG   PRO   3          1HG       PRO   3  11.400  -0.085   3.793
   31   2HG   PRO   3          2HG       PRO   3  12.450   0.935   4.797
   32   1HD   PRO   3          1HD       PRO   3  10.870  -1.029   5.835
   33   2HD   PRO   3          2HD       PRO   3  11.281   0.450   6.730
   34    H    VAL   4           H        VAL   4   9.220   2.167   2.223
   35    HA   VAL   4           HA       VAL   4   7.449   0.011   1.251
   36    HB   VAL   4           HB       VAL   4   8.021   2.755   0.031
   37   1HG1  VAL   4          1HG1      VAL   4   6.271   0.502  -0.938
   38   2HG1  VAL   4          2HG1      VAL   4   7.718   1.132  -1.728
   39   3HG1  VAL   4          3HG1      VAL   4   6.269   2.133  -1.598
   40   1HG2  VAL   4          1HG2      VAL   4   5.930   1.752   1.827
   41   2HG2  VAL   4          2HG2      VAL   4   5.300   2.522   0.374
   42   3HG2  VAL   4          3HG2      VAL   4   6.388   3.409   1.438
   43    H    LYS   5           H        LYS   5   8.092  -1.233  -0.517
   44    HA   LYS   5           HA       LYS   5  10.932  -0.975  -1.215
   45   1HB   LYS   5          1HB       LYS   5   9.263  -3.237  -0.430
   46   2HB   LYS   5          2HB       LYS   5  10.222  -3.557  -1.869
   47   1HG   LYS   5          1HG       LYS   5  11.310  -2.617   0.788
   48   2HG   LYS   5          2HG       LYS   5  11.342  -4.285   0.180
   49   1HD   LYS   5          1HD       LYS   5  12.759  -3.639  -1.663
   50   2HD   LYS   5          2HD       LYS   5  12.661  -1.940  -1.194
   51   1HE   LYS   5          1HE       LYS   5  13.855  -4.141   0.494
   52   2HE   LYS   5          2HE       LYS   5  14.782  -3.023  -0.507
   53   1HZ   LYS   5          1HZ       LYS   5  14.873  -2.057   1.571
   54   2HZ   LYS   5          2HZ       LYS   5  13.278  -2.485   1.982
   55   3HZ   LYS   5          3HZ       LYS   5  13.568  -1.228   0.873
   56    H    TYR   6           H        TYR   6   8.800  -3.186  -2.796
   57    HA   TYR   6           HA       TYR   6   9.539  -2.119  -5.365
   58   1HB   TYR   6          1HB       TYR   6   7.697  -4.440  -4.771
   59   2HB   TYR   6          2HB       TYR   6   8.559  -4.117  -6.274
   60    HD1  TYR   6           HD1      TYR   6  11.247  -3.768  -5.823
   61    HD2  TYR   6           HD2      TYR   6   8.604  -6.156  -3.488
   62    HE1  TYR   6           HE1      TYR   6  13.151  -5.078  -5.009
   63    HE2  TYR   6           HE2      TYR   6  10.504  -7.470  -2.671
   64    HH   TYR   6           HH       TYR   6  12.993  -7.961  -3.757
   65    H    GLY   7           H        GLY   7   7.947  -1.884  -7.112
   66   1HA   GLY   7          1HA       GLY   7   5.587  -1.498  -7.674
   67   2HA   GLY   7          2HA       GLY   7   5.442  -0.614  -6.163
   68    H    ASN   8           H        ASN   8   4.733   1.231  -7.408
   69    HA   ASN   8           HA       ASN   8   6.829   2.423  -9.061
   70   1HB   ASN   8          1HB       ASN   8   5.185   3.822 -10.067
   71   2HB   ASN   8          2HB       ASN   8   4.527   2.194 -10.009
   72   1HD2  ASN   8          1HD2      ASN   8   3.230   4.844 -10.195
   73   2HD2  ASN   8          2HD2      ASN   8   2.092   4.877  -8.898
   74    H    ALA   9           H        ALA   9   6.480   2.410  -6.005
   75    HA   ALA   9           HA       ALA   9   6.603   5.276  -5.457
   76   1HB   ALA   9          1HB       ALA   9   6.832   3.230  -3.317
   77   2HB   ALA   9          2HB       ALA   9   5.260   3.441  -4.095
   78   3HB   ALA   9          3HB       ALA   9   6.035   4.806  -3.282
   79    H    ASP  10           H        ASP  10   8.377   5.768  -3.675
   80    HA   ASP  10           HA       ASP  10  10.882   4.663  -4.732
   81   1HB   ASP  10          1HB       ASP  10  10.520   7.159  -4.635
   82   2HB   ASP  10          2HB       ASP  10  10.516   7.034  -2.880
   83    H    GLY  11           H        GLY  11  10.816   6.045  -1.575
   84   1HA   GLY  11          1HA       GLY  11  10.872   3.420  -0.308
   85   2HA   GLY  11          2HA       GLY  11  12.258   4.480  -0.098
   86    H    GLU  12           H        GLU  12   8.936   5.582  -0.289
   87    HA   GLU  12           HA       GLU  12   9.207   6.991   2.198
   88   1HB   GLU  12          1HB       GLU  12   6.704   6.609   0.546
   89   2HB   GLU  12          2HB       GLU  12   7.008   7.864   1.735
   90   1HG   GLU  12          1HG       GLU  12   8.289   7.555  -0.968
   91   2HG   GLU  12          2HG       GLU  12   7.194   8.830  -0.422
   92    H    TYR  13           H        TYR  13   6.716   6.807   3.354
   93    HA   TYR  13           HA       TYR  13   6.707   4.060   4.312
   94   1HB   TYR  13          1HB       TYR  13   6.550   4.842   6.417
   95   2HB   TYR  13          2HB       TYR  13   7.184   6.311   5.721
   96    HD1  TYR  13           HD1      TYR  13   5.227   7.867   4.673
   97    HD2  TYR  13           HD2      TYR  13   4.781   5.038   7.809
   98    HE1  TYR  13           HE1      TYR  13   3.228   9.075   5.472
   99    HE2  TYR  13           HE2      TYR  13   2.784   6.228   8.622
  100    HH   TYR  13           HH       TYR  13   1.915   8.730   8.427
  101    H    CYS  14           H        CYS  14   4.613   3.150   4.935
  102    HA   CYS  14           HA       CYS  14   2.646   3.647   2.930
  103   1HB   CYS  14          1HB       CYS  14   2.354   2.000   5.445
  104   2HB   CYS  14          2HB       CYS  14   1.339   1.918   4.012
  105    H    LYS  15           H        LYS  15   1.076   5.098   2.982
  106    HA   LYS  15           HA       LYS  15   0.699   6.740   5.310
  107   1HB   LYS  15          1HB       LYS  15   0.620   7.637   2.974
  108   2HB   LYS  15          2HB       LYS  15  -0.872   6.743   2.721
  109   1HG   LYS  15          1HG       LYS  15  -1.479   8.976   3.193
  110   2HG   LYS  15          2HG       LYS  15  -1.852   8.031   4.635
  111   1HD   LYS  15          1HD       LYS  15   0.406   8.750   5.536
  112   2HD   LYS  15          2HD       LYS  15   0.469   9.899   4.192
  113   1HE   LYS  15          1HE       LYS  15  -1.506   9.785   6.462
  114   2HE   LYS  15          2HE       LYS  15  -0.394  11.087   6.042
  115   1HZ   LYS  15          1HZ       LYS  15  -2.931  10.316   4.755
  116   2HZ   LYS  15          2HZ       LYS  15  -1.742  11.093   3.828
  117   3HZ   LYS  15          3HZ       LYS  15  -2.382  11.856   5.215
  118    H    PHE  16           H        PHE  16  -0.639   6.295   6.925
  119    HA   PHE  16           HA       PHE  16  -3.004   4.640   6.357
  120   1HB   PHE  16          1HB       PHE  16  -1.349   4.681   8.883
  121   2HB   PHE  16          2HB       PHE  16  -2.841   3.773   8.664
  122    HD1  PHE  16           HD1      PHE  16  -2.478   2.739   5.932
  123    HD2  PHE  16           HD2      PHE  16   0.271   3.037   9.162
  124    HE1  PHE  16           HE1      PHE  16  -1.231   0.841   5.028
  125    HE2  PHE  16           HE2      PHE  16   1.530   1.136   8.269
  126    HZ   PHE  16           HZ       PHE  16   0.806   0.021   6.184
  127    HA   PRO  17           HA       PRO  17  -4.678   4.191   6.761
  128   1HB   PRO  17          1HB       PRO  17  -7.337   4.919   6.480
  129   2HB   PRO  17          2HB       PRO  17  -6.660   4.098   7.887
  130   1HG   PRO  17          1HG       PRO  17  -7.700   6.769   7.749
  131   2HG   PRO  17          2HG       PRO  17  -7.006   5.940   9.151
  132   1HD   PRO  17          1HD       PRO  17  -5.771   7.899   7.325
  133   2HD   PRO  17          2HD       PRO  17  -5.328   7.468   8.991
  134    H    PHE  18           H        PHE  18  -5.154   3.654   4.613
  135    HA   PHE  18           HA       PHE  18  -5.301   5.965   2.806
  136   1HB   PHE  18          1HB       PHE  18  -4.162   4.739   1.113
  137   2HB   PHE  18          2HB       PHE  18  -3.238   4.569   2.595
  138    HD1  PHE  18           HD1      PHE  18  -5.524   2.829   0.272
  139    HD2  PHE  18           HD2      PHE  18  -2.783   2.450   3.504
  140    HE1  PHE  18           HE1      PHE  18  -5.480   0.401  -0.067
  141    HE2  PHE  18           HE2      PHE  18  -2.733   0.016   3.178
  142    HZ   PHE  18           HZ       PHE  18  -4.080  -1.035   1.384
  143    H    LEU  19           H        LEU  19  -6.644   5.833   0.960
  144    HA   LEU  19           HA       LEU  19  -9.080   4.344   1.536
  145   1HB   LEU  19          1HB       LEU  19  -9.113   6.793   1.144
  146   2HB   LEU  19          2HB       LEU  19  -8.569   6.509  -0.500
  147    HG   LEU  19           HG       LEU  19 -10.677   5.127  -0.822
  148   1HD1  LEU  19          1HD1      LEU  19 -11.780   4.646   1.069
  149   2HD1  LEU  19          2HD1      LEU  19 -12.400   6.293   0.960
  150   3HD1  LEU  19          3HD1      LEU  19 -10.992   5.955   1.964
  151   1HD2  LEU  19          1HD2      LEU  19 -11.171   7.003  -1.918
  152   2HD2  LEU  19          2HD2      LEU  19 -10.267   7.980  -0.761
  153   3HD2  LEU  19          3HD2      LEU  19 -11.956   7.579  -0.454
  154    H    PHE  20           H        PHE  20  -9.546   2.513   0.557
  155    HA   PHE  20           HA       PHE  20  -8.651   2.096  -2.224
  156   1HB   PHE  20          1HB       PHE  20  -7.441   0.666  -0.414
  157   2HB   PHE  20          2HB       PHE  20  -8.996  -0.139  -0.252
  158    HD1  PHE  20           HD1      PHE  20  -7.670  -2.140  -0.758
  159    HD2  PHE  20           HD2      PHE  20  -8.342   0.931  -3.625
  160    HE1  PHE  20           HE1      PHE  20  -7.141  -3.737  -2.548
  161    HE2  PHE  20           HE2      PHE  20  -7.817  -0.672  -5.434
  162    HZ   PHE  20           HZ       PHE  20  -7.222  -2.998  -4.900
  163    H    ASN  21           H        ASN  21 -10.539   2.429  -3.275
  164    HA   ASN  21           HA       ASN  21 -12.697   2.203  -3.970
  165   1HB   ASN  21          1HB       ASN  21 -12.193  -0.501  -2.757
  166   2HB   ASN  21          2HB       ASN  21 -13.747  -0.100  -3.485
  167   1HD2  ASN  21          1HD2      ASN  21 -13.856  -1.012  -5.394
  168   2HD2  ASN  21          2HD2      ASN  21 -12.605  -1.035  -6.586
  169    H    GLY  22           H        GLY  22 -12.273   3.451  -1.386
  170   1HA   GLY  22          1HA       GLY  22 -13.873   4.506  -0.043
  171   2HA   GLY  22          2HA       GLY  22 -15.017   3.232  -0.422
  172    H    LYS  23           H        LYS  23 -12.268   1.647   0.374
  173    HA   LYS  23           HA       LYS  23 -13.143   1.418   3.174
  174   1HB   LYS  23          1HB       LYS  23 -13.133  -0.625   1.614
  175   2HB   LYS  23          2HB       LYS  23 -11.382  -0.539   1.686
  176   1HG   LYS  23          1HG       LYS  23 -11.464  -0.850   4.110
  177   2HG   LYS  23          2HG       LYS  23 -13.227  -0.948   4.035
  178   1HD   LYS  23          1HD       LYS  23 -13.064  -2.923   2.606
  179   2HD   LYS  23          2HD       LYS  23 -11.302  -2.824   2.654
  180   1HE   LYS  23          1HE       LYS  23 -11.359  -3.146   5.086
  181   2HE   LYS  23          2HE       LYS  23 -13.118  -3.258   5.026
  182   1HZ   LYS  23          1HZ       LYS  23 -12.280  -5.446   5.099
  183   2HZ   LYS  23          2HZ       LYS  23 -11.139  -5.153   3.880
  184   3HZ   LYS  23          3HZ       LYS  23 -12.794  -5.205   3.501
  185    H    GLU  24           H        GLU  24 -11.745   1.831   4.822
  186    HA   GLU  24           HA       GLU  24  -9.167   3.009   4.074
  187   1HB   GLU  24          1HB       GLU  24 -10.658   3.069   6.697
  188   2HB   GLU  24          2HB       GLU  24  -9.190   3.961   6.336
  189   1HG   GLU  24          1HG       GLU  24 -10.318   5.313   4.750
  190   2HG   GLU  24          2HG       GLU  24 -11.763   4.304   4.836
  191    H    TYR  25           H        TYR  25  -7.243   2.207   4.690
  192    HA   TYR  25           HA       TYR  25  -7.239  -0.177   6.415
  193   1HB   TYR  25          1HB       TYR  25  -5.498   0.382   4.030
  194   2HB   TYR  25          2HB       TYR  25  -5.288  -0.985   5.106
  195    HD1  TYR  25           HD1      TYR  25  -7.440  -2.497   5.393
  196    HD2  TYR  25           HD2      TYR  25  -6.719   0.103   2.105
  197    HE1  TYR  25           HE1      TYR  25  -9.004  -3.814   4.007
  198    HE2  TYR  25           HE2      TYR  25  -8.280  -1.205   0.713
  199    HH   TYR  25           HH       TYR  25  -9.552  -4.255   1.762
  200    H    ASN  26           H        ASN  26  -6.023  -0.041   8.162
  201    HA   ASN  26           HA       ASN  26  -4.148   2.200   8.382
  202   1HB   ASN  26          1HB       ASN  26  -5.668   0.584  10.389
  203   2HB   ASN  26          2HB       ASN  26  -4.181   1.390  10.882
  204   1HD2  ASN  26          1HD2      ASN  26  -7.472   1.715  10.478
  205   2HD2  ASN  26          2HD2      ASN  26  -7.587   3.437  10.566
  206    H    SER  27           H        SER  27  -3.918  -0.571   7.133
  207    HA   SER  27           HA       SER  27  -1.170  -0.973   7.813
  208   1HB   SER  27          1HB       SER  27  -1.500  -3.435   8.326
  209   2HB   SER  27          2HB       SER  27  -2.051  -2.327   9.589
  210    HG   SER  27           HG       SER  27  -3.548  -4.053   9.058
  211    H    CYS  28           H        CYS  28  -0.464  -3.123   6.506
  212    HA   CYS  28           HA       CYS  28  -1.218  -2.528   3.798
  213   1HB   CYS  28          1HB       CYS  28   0.543  -4.718   4.906
  214   2HB   CYS  28          2HB       CYS  28   0.342  -4.355   3.199
  215    H    THR  29           H        THR  29  -2.302  -3.860   2.346
  216    HA   THR  29           HA       THR  29  -3.655  -6.188   3.473
  217    HB   THR  29           HB       THR  29  -5.193  -4.233   3.484
  218    HG1  THR  29           HG1      THR  29  -6.282  -6.095   3.237
  219   1HG2  THR  29          1HG2      THR  29  -4.107  -3.629   0.981
  220   2HG2  THR  29          2HG2      THR  29  -5.447  -2.823   1.800
  221   3HG2  THR  29          3HG2      THR  29  -5.766  -4.139   0.670
  222    H    ASP  30           H        ASP  30  -4.426  -7.709   1.774
  223    HA   ASP  30           HA       ASP  30  -2.651  -7.606  -0.557
  224   1HB   ASP  30          1HB       ASP  30  -4.040 -10.105  -0.004
  225   2HB   ASP  30          2HB       ASP  30  -2.398  -9.841  -0.520
  226    H    THR  31           H        THR  31  -5.478  -6.550   0.122
  227    HA   THR  31           HA       THR  31  -7.343  -7.765  -1.590
  228    HB   THR  31           HB       THR  31  -7.174  -4.858  -0.776
  229    HG1  THR  31           HG1      THR  31  -7.153  -5.933   1.119
  230   1HG2  THR  31          1HG2      THR  31  -9.241  -4.544  -1.506
  231   2HG2  THR  31          2HG2      THR  31  -9.799  -6.042  -0.762
  232   3HG2  THR  31          3HG2      THR  31  -9.074  -6.077  -2.367
  233    H    GLY  32           H        GLY  32  -7.945  -7.289  -3.741
  234   1HA   GLY  32          1HA       GLY  32  -7.767  -6.206  -5.816
  235   2HA   GLY  32          2HA       GLY  32  -6.355  -5.343  -5.213
  236    H    ARG  33           H        ARG  33  -4.498  -6.897  -4.616
  237    HA   ARG  33           HA       ARG  33  -3.849  -8.411  -6.959
  238   1HB   ARG  33          1HB       ARG  33  -1.720  -8.812  -5.832
  239   2HB   ARG  33          2HB       ARG  33  -2.014  -7.160  -6.009
  240   1HG   ARG  33          1HG       ARG  33  -1.538  -6.900  -3.853
  241   2HG   ARG  33          2HG       ARG  33  -2.958  -7.852  -3.433
  242   1HD   ARG  33          1HD       ARG  33  -1.013  -8.842  -2.430
  243   2HD   ARG  33          2HD       ARG  33  -1.662  -9.896  -3.689
  244    HE   ARG  33           HE       ARG  33   0.350  -9.734  -4.743
  245   1HH1  ARG  33          1HH1      ARG  33   0.024  -6.855  -2.793
  246   2HH1  ARG  33          2HH1      ARG  33   1.546  -6.205  -3.298
  247   1HH2  ARG  33          1HH2      ARG  33   2.318  -8.905  -5.400
  248   2HH2  ARG  33          2HH2      ARG  33   2.874  -7.390  -4.764
  249    H    SER  34           H        SER  34  -2.582 -10.633  -6.347
  250    HA   SER  34           HA       SER  34  -4.151 -12.116  -4.374
  251   1HB   SER  34          1HB       SER  34  -3.940 -12.962  -7.273
  252   2HB   SER  34          2HB       SER  34  -4.725 -13.878  -5.985
  253    HG   SER  34           HG       SER  34  -5.740 -11.409  -5.997
  254    H    ASP  35           H        ASP  35  -1.301 -11.274  -4.660
  255    HA   ASP  35           HA       ASP  35   0.015 -13.833  -4.990
  256   1HB   ASP  35          1HB       ASP  35   1.397 -11.284  -4.466
  257   2HB   ASP  35          2HB       ASP  35   1.993 -12.695  -5.290
  258    H    GLY  36           H        GLY  36  -1.424 -12.338  -2.570
  259   1HA   GLY  36          1HA       GLY  36  -1.369 -12.767  -0.294
  260   2HA   GLY  36          2HA       GLY  36   0.001 -13.823  -0.581
  261    H    PHE  37           H        PHE  37   1.164 -11.288  -2.024
  262    HA   PHE  37           HA       PHE  37   2.673 -10.430   0.263
  263   1HB   PHE  37          1HB       PHE  37   2.760  -9.755  -2.675
  264   2HB   PHE  37          2HB       PHE  37   3.679  -8.806  -1.522
  265    HD1  PHE  37           HD1      PHE  37   3.062 -12.379  -2.392
  266    HD2  PHE  37           HD2      PHE  37   5.864  -9.418  -1.168
  267    HE1  PHE  37           HE1      PHE  37   4.880 -14.041  -2.512
  268    HE2  PHE  37           HE2      PHE  37   7.673 -11.066  -1.287
  269    HZ   PHE  37           HZ       PHE  37   7.179 -13.388  -1.969
  270    H    LEU  38           H        LEU  38   2.382  -8.644   1.449
  271    HA   LEU  38           HA       LEU  38  -0.085  -7.222   1.143
  272   1HB   LEU  38          1HB       LEU  38   2.143  -6.726   3.081
  273   2HB   LEU  38          2HB       LEU  38   0.524  -6.100   3.204
  274    HG   LEU  38           HG       LEU  38  -0.181  -8.610   3.303
  275   1HD1  LEU  38          1HD1      LEU  38   1.553  -9.995   3.047
  276   2HD1  LEU  38          2HD1      LEU  38   1.886  -9.619   4.741
  277   3HD1  LEU  38          3HD1      LEU  38   2.738  -8.756   3.456
  278   1HD2  LEU  38          1HD2      LEU  38  -0.520  -7.103   5.135
  279   2HD2  LEU  38          2HD2      LEU  38   1.191  -7.174   5.566
  280   3HD2  LEU  38          3HD2      LEU  38   0.177  -8.604   5.752
  281    H    TRP  39           H        TRP  39  -0.445  -5.147   0.483
  282    HA   TRP  39           HA       TRP  39   1.924  -3.567  -0.231
  283   1HB   TRP  39          1HB       TRP  39   0.896  -2.726  -2.225
  284   2HB   TRP  39          2HB       TRP  39   0.855  -4.477  -2.291
  285    HD1  TRP  39           HD1      TRP  39  -1.589  -5.672  -2.021
  286    HE1  TRP  39           HE1      TRP  39  -3.946  -4.790  -2.500
  287    HE3  TRP  39           HE3      TRP  39  -0.607  -0.632  -2.158
  288    HZ2  TRP  39           HZ2      TRP  39  -5.222  -2.320  -2.892
  289    HZ3  TRP  39           HZ3      TRP  39  -2.486   0.912  -2.603
  290    HH2  TRP  39           HH2      TRP  39  -4.737   0.067  -2.956
  291    H    CYS  40           H        CYS  40   1.317  -1.197  -0.545
  292    HA   CYS  40           HA       CYS  40  -0.934  -0.318   1.060
  293   1HB   CYS  40          1HB       CYS  40   0.470   0.965   2.616
  294   2HB   CYS  40          2HB       CYS  40   0.810  -0.761   2.734
  295    H    SER  41           H        SER  41  -1.129   2.067   1.006
  296    HA   SER  41           HA       SER  41  -0.131   3.074  -1.545
  297   1HB   SER  41          1HB       SER  41  -2.570   3.153  -1.156
  298   2HB   SER  41          2HB       SER  41  -2.306   4.164   0.266
  299    HG   SER  41           HG       SER  41  -2.466   5.753  -1.101
  300    H    THR  42           H        THR  42   0.495   5.373  -1.611
  301    HA   THR  42           HA       THR  42   2.111   6.058   0.753
  302    HB   THR  42           HB       THR  42   2.447   7.220  -2.012
  303    HG1  THR  42           HG1      THR  42   2.577   4.912  -2.123
  304   1HG2  THR  42          1HG2      THR  42   4.262   6.914   0.355
  305   2HG2  THR  42          2HG2      THR  42   3.765   8.392  -0.461
  306   3HG2  THR  42          3HG2      THR  42   4.857   7.270  -1.266
  307    H    THR  43           H        THR  43  -0.586   6.879  -1.080
  308    HA   THR  43           HA       THR  43  -0.789   9.530   0.198
  309    HB   THR  43           HB       THR  43  -2.191  10.181  -1.768
  310    HG1  THR  43           HG1      THR  43  -2.752   8.716  -3.165
  311   1HG2  THR  43          1HG2      THR  43   0.529   9.175  -2.580
  312   2HG2  THR  43          2HG2      THR  43   0.192  10.739  -1.838
  313   3HG2  THR  43          3HG2      THR  43  -0.443  10.366  -3.442
  314    H    TYR  44           H        TYR  44  -3.178  10.207   0.383
  315    HA   TYR  44           HA       TYR  44  -4.589   8.093   1.725
  316   1HB   TYR  44          1HB       TYR  44  -4.797  10.310   2.651
  317   2HB   TYR  44          2HB       TYR  44  -5.349  10.962   1.111
  318    HD1  TYR  44           HD1      TYR  44  -6.375   8.089   3.321
  319    HD2  TYR  44           HD2      TYR  44  -7.581  11.546   1.141
  320    HE1  TYR  44           HE1      TYR  44  -8.704   7.698   3.992
  321    HE2  TYR  44           HE2      TYR  44  -9.912  11.158   1.811
  322    HH   TYR  44           HH       TYR  44 -10.941   8.243   3.300
  323    H    ASN  45           H        ASN  45  -5.028  10.019  -1.202
  324    HA   ASN  45           HA       ASN  45  -7.232   8.333  -2.055
  325   1HB   ASN  45          1HB       ASN  45  -7.166  10.851  -2.428
  326   2HB   ASN  45          2HB       ASN  45  -5.892  10.569  -3.594
  327   1HD2  ASN  45          1HD2      ASN  45  -7.539   7.980  -4.258
  328   2HD2  ASN  45          2HD2      ASN  45  -8.693   8.658  -5.293
  329    H    PHE  46           H        PHE  46  -6.523   6.357  -2.730
  330    HA   PHE  46           HA       PHE  46  -3.990   6.083  -4.118
  331   1HB   PHE  46          1HB       PHE  46  -4.568   4.403  -2.458
  332   2HB   PHE  46          2HB       PHE  46  -6.069   4.017  -3.325
  333    HD1  PHE  46           HD1      PHE  46  -6.034   2.465  -5.123
  334    HD2  PHE  46           HD2      PHE  46  -2.341   3.880  -3.528
  335    HE1  PHE  46           HE1      PHE  46  -4.820   0.797  -6.447
  336    HE2  PHE  46           HE2      PHE  46  -1.139   2.210  -4.851
  337    HZ   PHE  46           HZ       PHE  46  -2.378   0.661  -6.310
  338    H    GLU  47           H        GLU  47  -7.362   6.160  -4.864
  339    HA   GLU  47           HA       GLU  47  -7.423   4.928  -7.374
  340   1HB   GLU  47          1HB       GLU  47  -9.406   5.600  -6.066
  341   2HB   GLU  47          2HB       GLU  47  -9.034   7.284  -6.368
  342   1HG   GLU  47          1HG       GLU  47  -9.305   6.817  -8.811
  343   2HG   GLU  47          2HG       GLU  47  -9.905   5.217  -8.366
  344    H    LYS  48           H        LYS  48  -7.045   8.373  -6.594
  345    HA   LYS  48           HA       LYS  48  -6.573   9.082  -9.317
  346   1HB   LYS  48          1HB       LYS  48  -7.642  10.781  -8.153
  347   2HB   LYS  48          2HB       LYS  48  -6.675  10.550  -6.709
  348   1HG   LYS  48          1HG       LYS  48  -4.739  11.573  -7.934
  349   2HG   LYS  48          2HG       LYS  48  -5.853  11.961  -9.252
  350   1HD   LYS  48          1HD       LYS  48  -5.597  13.878  -7.818
  351   2HD   LYS  48          2HD       LYS  48  -7.236  13.239  -7.657
  352   1HE   LYS  48          1HE       LYS  48  -6.648  12.139  -5.586
  353   2HE   LYS  48          2HE       LYS  48  -4.964  12.636  -5.764
  354   1HZ   LYS  48          1HZ       LYS  48  -5.671  14.945  -5.606
  355   2HZ   LYS  48          2HZ       LYS  48  -6.125  14.068  -4.223
  356   3HZ   LYS  48          3HZ       LYS  48  -7.288  14.450  -5.404
  357    H    ASP  49           H        ASP  49  -4.492   9.070  -6.400
  358    HA   ASP  49           HA       ASP  49  -2.192   9.912  -7.838
  359   1HB   ASP  49          1HB       ASP  49  -2.590   8.774  -5.080
  360   2HB   ASP  49          2HB       ASP  49  -0.992   9.173  -5.699
  361    H    GLY  50           H        GLY  50  -2.989   6.791  -6.343
  362   1HA   GLY  50          1HA       GLY  50  -2.537   4.656  -7.086
  363   2HA   GLY  50          2HA       GLY  50  -1.913   5.348  -8.569
  364    H    LYS  51           H        LYS  51  -0.546   6.433  -5.558
  365    HA   LYS  51           HA       LYS  51   1.995   5.224  -6.309
  366   1HB   LYS  51          1HB       LYS  51   1.222   7.131  -4.098
  367   2HB   LYS  51          2HB       LYS  51   2.819   6.415  -4.203
  368   1HG   LYS  51          1HG       LYS  51   3.142   8.438  -5.205
  369   2HG   LYS  51          2HG       LYS  51   2.802   7.408  -6.597
  370   1HD   LYS  51          1HD       LYS  51   0.521   8.196  -6.673
  371   2HD   LYS  51          2HD       LYS  51   0.752   9.118  -5.186
  372   1HE   LYS  51          1HE       LYS  51   2.470  10.474  -6.338
  373   2HE   LYS  51          2HE       LYS  51   2.128   9.594  -7.827
  374   1HZ   LYS  51          1HZ       LYS  51  -0.129  10.881  -6.467
  375   2HZ   LYS  51          2HZ       LYS  51   0.171  10.675  -8.129
  376   3HZ   LYS  51          3HZ       LYS  51   0.989  11.886  -7.267
  377    H    TYR  52           H        TYR  52   2.312   3.144  -5.745
  378    HA   TYR  52           HA       TYR  52   1.583   2.375  -3.019
  379   1HB   TYR  52          1HB       TYR  52   0.604   0.328  -3.716
  380   2HB   TYR  52          2HB       TYR  52  -0.119   1.577  -4.719
  381    HD1  TYR  52           HD1      TYR  52   2.220  -1.269  -4.672
  382    HD2  TYR  52           HD2      TYR  52   0.265   1.629  -7.101
  383    HE1  TYR  52           HE1      TYR  52   2.870  -2.526  -6.678
  384    HE2  TYR  52           HE2      TYR  52   0.913   0.376  -9.113
  385    HH   TYR  52           HH       TYR  52   3.117  -1.493  -9.499
  386    H    GLY  53           H        GLY  53   2.547   0.284  -2.425
  387   1HA   GLY  53          1HA       GLY  53   4.798  -0.714  -3.816
  388   2HA   GLY  53          2HA       GLY  53   5.289   0.324  -2.493
  389    H    PHE  54           H        PHE  54   6.005  -2.298  -2.430
  390    HA   PHE  54           HA       PHE  54   4.034  -3.645  -0.765
  391   1HB   PHE  54          1HB       PHE  54   6.682  -4.640  -1.820
  392   2HB   PHE  54          2HB       PHE  54   5.484  -5.616  -0.979
  393    HD1  PHE  54           HD1      PHE  54   6.437  -6.470  -3.571
  394    HD2  PHE  54           HD2      PHE  54   3.315  -3.739  -2.619
  395    HE1  PHE  54           HE1      PHE  54   5.366  -6.943  -5.733
  396    HE2  PHE  54           HE2      PHE  54   2.234  -4.202  -4.778
  397    HZ   PHE  54           HZ       PHE  54   3.261  -5.810  -6.345
  398    H    CYS  55           H        CYS  55   4.316  -3.986   1.412
  399    HA   CYS  55           HA       CYS  55   6.520  -2.501   2.607
  400   1HB   CYS  55          1HB       CYS  55   5.185  -2.574   4.702
  401   2HB   CYS  55          2HB       CYS  55   4.326  -1.835   3.350
  402    HA   PRO  56           HA       PRO  56   6.859  -6.751   4.941
  403   1HB   PRO  56          1HB       PRO  56   6.443  -8.960   3.440
  404   2HB   PRO  56          2HB       PRO  56   5.198  -8.230   4.457
  405   1HG   PRO  56          1HG       PRO  56   5.623  -7.971   1.505
  406   2HG   PRO  56          2HG       PRO  56   4.111  -8.180   2.408
  407   1HD   PRO  56          1HD       PRO  56   4.919  -5.775   1.477
  408   2HD   PRO  56          2HD       PRO  56   3.996  -5.950   2.982
  409    H    HIS  57           H        HIS  57   8.905  -7.215   5.141
  410    HA   HIS  57           HA       HIS  57  10.550  -7.576   2.723
  411   1HB   HIS  57          1HB       HIS  57  11.027  -5.524   4.148
  412   2HB   HIS  57          2HB       HIS  57  11.523  -6.622   5.428
  413    HD1  HIS  57           HD1      HIS  57  13.750  -5.001   4.901
  414    HD2  HIS  57           HD2      HIS  57  12.862  -8.079   2.243
  415    HE1  HIS  57           HE1      HIS  57  15.863  -5.406   3.592
  416    H    GLU  58           H        GLU  58  10.421  -8.386   6.180
  417    HA   GLU  58           HA       GLU  58  11.063 -11.148   5.533
  418   1HB   GLU  58          1HB       GLU  58  12.571 -11.160   7.573
  419   2HB   GLU  58          2HB       GLU  58  13.204 -10.370   6.142
  420   1HG   GLU  58          1HG       GLU  58  12.596  -8.192   7.119
  421   2HG   GLU  58          2HG       GLU  58  12.023  -9.021   8.566
  422    H    ALA  59           H        ALA  59   8.600 -10.744   5.928
  423    HA   ALA  59           HA       ALA  59   8.004 -10.966   8.793
  424   1HB   ALA  59          1HB       ALA  59   5.576 -10.735   7.706
  425   2HB   ALA  59          2HB       ALA  59   6.519  -9.910   6.467
  426   3HB   ALA  59          3HB       ALA  59   6.567  -9.343   8.137
  Start of MODEL   48
    1   1H    ARG   1          1H        ARG   1  14.699   2.741   7.590
    2   2H    ARG   1          2H        ARG   1  14.402   3.450   9.123
    3   3H    ARG   1          3H        ARG   1  14.792   4.445   7.778
    4    HA   ARG   1           HA       ARG   1  12.319   3.715   8.690
    5   1HB   ARG   1          1HB       ARG   1  13.358   5.743   7.390
    6   2HB   ARG   1          2HB       ARG   1  12.862   4.853   5.957
    7   1HG   ARG   1          1HG       ARG   1  11.196   6.501   6.579
    8   2HG   ARG   1          2HG       ARG   1  10.545   4.867   6.761
    9   1HD   ARG   1          1HD       ARG   1  10.854   4.944   9.135
   10   2HD   ARG   1          2HD       ARG   1  11.724   6.477   9.021
   11    HE   ARG   1           HE       ARG   1   9.236   6.956   7.928
   12   1HH1  ARG   1          1HH1      ARG   1  10.477   5.808  10.983
   13   2HH1  ARG   1          2HH1      ARG   1   9.196   6.511  11.926
   14   1HH2  ARG   1          1HH2      ARG   1   7.555   7.900   9.148
   15   2HH2  ARG   1          2HH2      ARG   1   7.517   7.697  10.872
   16    H    ILE   2           H        ILE   2  13.201   3.328   5.300
   17    HA   ILE   2           HA       ILE   2  12.407   1.929   3.679
   18    HB   ILE   2           HB       ILE   2  14.401   0.725   4.469
   19   1HG1  ILE   2          1HG1      ILE   2  12.122  -1.118   3.709
   20   2HG1  ILE   2          2HG1      ILE   2  13.164  -0.227   2.600
   21   1HG2  ILE   2          1HG2      ILE   2  12.702   0.028   6.662
   22   2HG2  ILE   2          2HG2      ILE   2  14.448  -0.205   6.475
   23   3HG2  ILE   2          3HG2      ILE   2  13.332  -1.443   5.898
   24   1HD1  ILE   2          1HD1      ILE   2  13.529  -2.812   3.444
   25   2HD1  ILE   2          2HD1      ILE   2  14.656  -1.898   4.445
   26   3HD1  ILE   2          3HD1      ILE   2  14.748  -1.784   2.688
   27    HA   PRO   3           HA       PRO   3   8.420   0.663   5.778
   28   1HB   PRO   3          1HB       PRO   3   7.126   2.917   4.488
   29   2HB   PRO   3          2HB       PRO   3   7.281   2.574   6.215
   30   1HG   PRO   3          1HG       PRO   3   8.567   4.657   5.058
   31   2HG   PRO   3          2HG       PRO   3   9.267   3.739   6.409
   32   1HD   PRO   3          1HD       PRO   3   9.794   3.410   3.452
   33   2HD   PRO   3          2HD       PRO   3  10.970   3.583   4.782
   34    H    VAL   4           H        VAL   4   9.139   1.815   2.546
   35    HA   VAL   4           HA       VAL   4   7.241  -0.162   1.436
   36    HB   VAL   4           HB       VAL   4   7.919   2.574   0.271
   37   1HG1  VAL   4          1HG1      VAL   4   6.220   2.044  -1.418
   38   2HG1  VAL   4          2HG1      VAL   4   6.083   0.414  -0.760
   39   3HG1  VAL   4          3HG1      VAL   4   7.599   0.951  -1.493
   40   1HG2  VAL   4          1HG2      VAL   4   5.663   1.577   1.901
   41   2HG2  VAL   4          2HG2      VAL   4   5.254   2.611   0.532
   42   3HG2  VAL   4          3HG2      VAL   4   6.356   3.195   1.783
   43    H    LYS   5           H        LYS   5   8.000  -1.289  -0.471
   44    HA   LYS   5           HA       LYS   5  10.847  -0.803  -1.046
   45   1HB   LYS   5          1HB       LYS   5   9.907  -2.996   0.295
   46   2HB   LYS   5          2HB       LYS   5   9.986  -3.588  -1.359
   47   1HG   LYS   5          1HG       LYS   5  12.266  -2.320   0.159
   48   2HG   LYS   5          2HG       LYS   5  12.051  -4.051  -0.125
   49   1HD   LYS   5          1HD       LYS   5  12.378  -3.804  -2.454
   50   2HD   LYS   5          2HD       LYS   5  12.232  -2.047  -2.369
   51   1HE   LYS   5          1HE       LYS   5  14.334  -1.857  -1.220
   52   2HE   LYS   5          2HE       LYS   5  14.433  -3.606  -1.010
   53   1HZ   LYS   5          1HZ       LYS   5  15.629  -2.232  -2.986
   54   2HZ   LYS   5          2HZ       LYS   5  14.203  -2.743  -3.765
   55   3HZ   LYS   5          3HZ       LYS   5  15.243  -3.886  -3.062
   56    H    TYR   6           H        TYR   6   8.752  -3.265  -2.455
   57    HA   TYR   6           HA       TYR   6   9.497  -2.458  -5.101
   58   1HB   TYR   6          1HB       TYR   6   7.413  -4.504  -4.322
   59   2HB   TYR   6          2HB       TYR   6   8.243  -4.362  -5.867
   60    HD1  TYR   6           HD1      TYR   6   8.778  -5.184  -2.282
   61    HD2  TYR   6           HD2      TYR   6  10.325  -5.422  -6.241
   62    HE1  TYR   6           HE1      TYR   6  10.512  -6.723  -1.500
   63    HE2  TYR   6           HE2      TYR   6  12.059  -6.974  -5.468
   64    HH   TYR   6           HH       TYR   6  12.222  -8.682  -3.399
   65    H    GLY   7           H        GLY   7   8.124  -1.858  -6.795
   66   1HA   GLY   7          1HA       GLY   7   5.795  -1.365  -7.462
   67   2HA   GLY   7          2HA       GLY   7   5.625  -0.495  -5.950
   68    H    ASN   8           H        ASN   8   5.039   1.381  -7.169
   69    HA   ASN   8           HA       ASN   8   7.222   2.565  -8.740
   70   1HB   ASN   8          1HB       ASN   8   5.617   3.924  -9.848
   71   2HB   ASN   8          2HB       ASN   8   4.947   2.300  -9.790
   72   1HD2  ASN   8          1HD2      ASN   8   3.693   4.927 -10.099
   73   2HD2  ASN   8          2HD2      ASN   8   2.511   5.031  -8.843
   74    H    ALA   9           H        ALA   9   6.715   2.539  -5.706
   75    HA   ALA   9           HA       ALA   9   6.687   5.396  -5.158
   76   1HB   ALA   9          1HB       ALA   9   6.957   3.348  -3.019
   77   2HB   ALA   9          2HB       ALA   9   5.401   3.549  -3.828
   78   3HB   ALA   9          3HB       ALA   9   6.139   4.913  -2.988
   79    H    ASP  10           H        ASP  10   8.345   6.004  -3.303
   80    HA   ASP  10           HA       ASP  10  10.950   4.952  -4.198
   81   1HB   ASP  10          1HB       ASP  10  10.157   7.690  -3.213
   82   2HB   ASP  10          2HB       ASP  10  11.841   7.174  -3.298
   83    H    GLY  11           H        GLY  11  10.410   6.976  -1.378
   84   1HA   GLY  11          1HA       GLY  11  10.949   4.686   0.353
   85   2HA   GLY  11          2HA       GLY  11  12.027   6.063   0.430
   86    H    GLU  12           H        GLU  12   8.584   6.344  -0.073
   87    HA   GLU  12           HA       GLU  12   8.346   7.932   2.352
   88   1HB   GLU  12          1HB       GLU  12   6.521   7.365   0.022
   89   2HB   GLU  12          2HB       GLU  12   5.940   8.180   1.466
   90   1HG   GLU  12          1HG       GLU  12   6.484   9.755  -0.296
   91   2HG   GLU  12          2HG       GLU  12   7.531   9.977   1.099
   92    H    TYR  13           H        TYR  13   7.013   7.410   4.100
   93    HA   TYR  13           HA       TYR  13   6.697   4.748   4.762
   94   1HB   TYR  13          1HB       TYR  13   6.990   6.870   6.173
   95   2HB   TYR  13          2HB       TYR  13   5.260   7.080   5.944
   96    HD1  TYR  13           HD1      TYR  13   3.716   5.297   6.738
   97    HD2  TYR  13           HD2      TYR  13   7.829   5.435   7.732
   98    HE1  TYR  13           HE1      TYR  13   3.303   3.792   8.583
   99    HE2  TYR  13           HE2      TYR  13   7.460   3.936   9.589
  100    HH   TYR  13           HH       TYR  13   4.626   2.127   9.970
  101    H    CYS  14           H        CYS  14   4.788   3.498   4.957
  102    HA   CYS  14           HA       CYS  14   2.882   3.715   2.930
  103   1HB   CYS  14          1HB       CYS  14   2.807   2.251   5.570
  104   2HB   CYS  14          2HB       CYS  14   1.513   2.132   4.388
  105    H    LYS  15           H        LYS  15   0.907   4.682   2.789
  106    HA   LYS  15           HA       LYS  15   0.376   6.772   4.693
  107   1HB   LYS  15          1HB       LYS  15   0.009   6.757   2.089
  108   2HB   LYS  15          2HB       LYS  15  -1.541   6.033   2.503
  109   1HG   LYS  15          1HG       LYS  15  -1.776   8.427   2.252
  110   2HG   LYS  15          2HG       LYS  15  -2.036   7.970   3.939
  111   1HD   LYS  15          1HD       LYS  15   0.277   8.610   4.462
  112   2HD   LYS  15          2HD       LYS  15   0.524   9.076   2.779
  113   1HE   LYS  15          1HE       LYS  15  -1.245  10.766   3.014
  114   2HE   LYS  15          2HE       LYS  15  -1.444  10.310   4.702
  115   1HZ   LYS  15          1HZ       LYS  15   0.214  11.647   5.261
  116   2HZ   LYS  15          2HZ       LYS  15   0.322  12.181   3.649
  117   3HZ   LYS  15          3HZ       LYS  15   1.280  10.886   4.180
  118    H    PHE  16           H        PHE  16  -0.484   6.237   6.574
  119    HA   PHE  16           HA       PHE  16  -2.705   4.302   6.578
  120   1HB   PHE  16          1HB       PHE  16  -0.568   4.789   8.657
  121   2HB   PHE  16          2HB       PHE  16  -2.015   3.845   8.973
  122    HD1  PHE  16           HD1      PHE  16   0.722   2.783   9.303
  123    HD2  PHE  16           HD2      PHE  16  -1.839   2.812   5.909
  124    HE1  PHE  16           HE1      PHE  16   1.865   0.797   8.439
  125    HE2  PHE  16           HE2      PHE  16  -0.705   0.825   5.028
  126    HZ   PHE  16           HZ       PHE  16   1.171  -0.204   6.281
  127    HA   PRO  17           HA       PRO  17  -4.351   3.981   6.799
  128   1HB   PRO  17          1HB       PRO  17  -7.024   4.619   6.653
  129   2HB   PRO  17          2HB       PRO  17  -6.253   3.824   8.027
  130   1HG   PRO  17          1HG       PRO  17  -7.380   6.468   7.918
  131   2HG   PRO  17          2HG       PRO  17  -6.648   5.650   9.304
  132   1HD   PRO  17          1HD       PRO  17  -5.476   7.654   7.484
  133   2HD   PRO  17          2HD       PRO  17  -4.990   7.191   9.128
  134    H    PHE  18           H        PHE  18  -4.662   3.510   4.636
  135    HA   PHE  18           HA       PHE  18  -5.036   5.842   2.900
  136   1HB   PHE  18          1HB       PHE  18  -4.043   4.589   1.100
  137   2HB   PHE  18          2HB       PHE  18  -2.992   4.504   2.504
  138    HD1  PHE  18           HD1      PHE  18  -2.973   2.358   3.863
  139    HD2  PHE  18           HD2      PHE  18  -4.842   2.663   0.052
  140    HE1  PHE  18           HE1      PHE  18  -2.923  -0.092   3.639
  141    HE2  PHE  18           HE2      PHE  18  -4.794   0.222  -0.182
  142    HZ   PHE  18           HZ       PHE  18  -3.826  -1.178   1.611
  143    H    LEU  19           H        LEU  19  -6.490   5.824   1.201
  144    HA   LEU  19           HA       LEU  19  -8.871   4.268   1.755
  145   1HB   LEU  19          1HB       LEU  19  -8.920   6.735   1.401
  146   2HB   LEU  19          2HB       LEU  19  -8.446   6.463  -0.264
  147    HG   LEU  19           HG       LEU  19 -10.547   5.084  -0.527
  148   1HD1  LEU  19          1HD1      LEU  19 -12.312   5.946   1.217
  149   2HD1  LEU  19          2HD1      LEU  19 -10.894   6.076   2.258
  150   3HD1  LEU  19          3HD1      LEU  19 -11.329   4.517   1.550
  151   1HD2  LEU  19          1HD2      LEU  19 -12.011   7.261  -0.361
  152   2HD2  LEU  19          2HD2      LEU  19 -10.728   7.118  -1.566
  153   3HD2  LEU  19          3HD2      LEU  19 -10.446   8.021  -0.078
  154    H    PHE  20           H        PHE  20  -9.277   2.436   0.765
  155    HA   PHE  20           HA       PHE  20  -8.384   2.062  -2.026
  156   1HB   PHE  20          1HB       PHE  20  -7.232   0.601  -0.204
  157   2HB   PHE  20          2HB       PHE  20  -8.805  -0.174  -0.077
  158    HD1  PHE  20           HD1      PHE  20  -7.900  -2.265  -0.639
  159    HD2  PHE  20           HD2      PHE  20  -7.682   0.990  -3.368
  160    HE1  PHE  20           HE1      PHE  20  -7.391  -3.849  -2.448
  161    HE2  PHE  20           HE2      PHE  20  -7.171  -0.591  -5.191
  162    HZ   PHE  20           HZ       PHE  20  -7.030  -3.006  -4.740
  163    H    ASN  21           H        ASN  21 -10.250   2.301  -3.180
  164    HA   ASN  21           HA       ASN  21 -12.377   2.007  -3.934
  165   1HB   ASN  21          1HB       ASN  21 -12.175  -0.569  -2.372
  166   2HB   ASN  21          2HB       ASN  21 -13.407  -0.205  -3.573
  167   1HD2  ASN  21          1HD2      ASN  21 -10.732  -1.916  -3.126
  168   2HD2  ASN  21          2HD2      ASN  21 -10.091  -1.938  -4.732
  169    H    GLY  22           H        GLY  22 -11.906   3.167  -1.146
  170   1HA   GLY  22          1HA       GLY  22 -13.664   4.398  -0.073
  171   2HA   GLY  22          2HA       GLY  22 -14.734   3.040  -0.358
  172    H    LYS  23           H        LYS  23 -11.928   1.678   0.626
  173    HA   LYS  23           HA       LYS  23 -12.747   1.761   3.459
  174   1HB   LYS  23          1HB       LYS  23 -13.044  -0.454   2.298
  175   2HB   LYS  23          2HB       LYS  23 -11.302  -0.501   2.071
  176   1HG   LYS  23          1HG       LYS  23 -11.032  -0.378   4.541
  177   2HG   LYS  23          2HG       LYS  23 -12.788  -0.517   4.686
  178   1HD   LYS  23          1HD       LYS  23 -10.934  -2.537   3.413
  179   2HD   LYS  23          2HD       LYS  23 -11.705  -2.679   4.997
  180   1HE   LYS  23          1HE       LYS  23 -13.910  -2.632   3.906
  181   2HE   LYS  23          2HE       LYS  23 -13.124  -2.518   2.334
  182   1HZ   LYS  23          1HZ       LYS  23 -13.886  -4.816   3.358
  183   2HZ   LYS  23          2HZ       LYS  23 -12.341  -4.748   4.055
  184   3HZ   LYS  23          3HZ       LYS  23 -12.510  -4.693   2.367
  185    H    GLU  24           H        GLU  24 -11.285   2.389   4.920
  186    HA   GLU  24           HA       GLU  24  -8.606   3.035   3.939
  187   1HB   GLU  24          1HB       GLU  24 -10.141   3.900   6.385
  188   2HB   GLU  24          2HB       GLU  24  -8.439   4.267   6.156
  189   1HG   GLU  24          1HG       GLU  24  -8.941   5.517   4.159
  190   2HG   GLU  24          2HG       GLU  24 -10.640   5.064   4.272
  191    H    TYR  25           H        TYR  25  -6.881   1.917   4.458
  192    HA   TYR  25           HA       TYR  25  -7.131  -0.222   6.453
  193   1HB   TYR  25          1HB       TYR  25  -5.237   0.153   4.151
  194   2HB   TYR  25          2HB       TYR  25  -5.117  -1.175   5.292
  195    HD1  TYR  25           HD1      TYR  25  -7.316  -2.615   5.557
  196    HD2  TYR  25           HD2      TYR  25  -6.442  -0.123   2.222
  197    HE1  TYR  25           HE1      TYR  25  -8.926  -3.886   4.180
  198    HE2  TYR  25           HE2      TYR  25  -8.044  -1.389   0.839
  199    HH   TYR  25           HH       TYR  25 -10.022  -2.822   1.155
  200    H    ASN  26           H        ASN  26  -5.841  -0.325   8.206
  201    HA   ASN  26           HA       ASN  26  -4.081   1.961   8.705
  202   1HB   ASN  26          1HB       ASN  26  -5.179  -0.194  10.517
  203   2HB   ASN  26          2HB       ASN  26  -3.930   0.926  11.041
  204   1HD2  ASN  26          1HD2      ASN  26  -6.136   2.249   8.829
  205   2HD2  ASN  26          2HD2      ASN  26  -7.116   3.113   9.964
  206    H    SER  27           H        SER  27  -3.751  -0.919   7.273
  207    HA   SER  27           HA       SER  27  -0.899  -1.014   7.769
  208   1HB   SER  27          1HB       SER  27  -1.067  -3.536   8.193
  209   2HB   SER  27          2HB       SER  27  -1.543  -2.473   9.523
  210    HG   SER  27           HG       SER  27  -3.040  -4.215   9.096
  211    H    CYS  28           H        CYS  28  -0.158  -3.237   6.484
  212    HA   CYS  28           HA       CYS  28  -0.889  -2.664   3.754
  213   1HB   CYS  28          1HB       CYS  28   0.995  -4.693   4.973
  214   2HB   CYS  28          2HB       CYS  28   0.650  -4.647   3.253
  215    H    THR  29           H        THR  29  -2.300  -3.775   2.479
  216    HA   THR  29           HA       THR  29  -3.516  -6.178   3.629
  217    HB   THR  29           HB       THR  29  -5.079  -4.275   3.623
  218    HG1  THR  29           HG1      THR  29  -6.128  -6.164   3.325
  219   1HG2  THR  29          1HG2      THR  29  -4.670  -2.794   1.955
  220   2HG2  THR  29          2HG2      THR  29  -5.954  -3.729   1.189
  221   3HG2  THR  29          3HG2      THR  29  -4.265  -4.046   0.781
  222    H    ASP  30           H        ASP  30  -4.402  -7.719   1.981
  223    HA   ASP  30           HA       ASP  30  -2.600  -7.788  -0.310
  224   1HB   ASP  30          1HB       ASP  30  -4.195 -10.146  -0.025
  225   2HB   ASP  30          2HB       ASP  30  -2.469 -10.010  -0.127
  226    H    THR  31           H        THR  31  -5.520  -6.710   0.386
  227    HA   THR  31           HA       THR  31  -7.323  -7.784  -1.432
  228    HB   THR  31           HB       THR  31  -7.139  -4.903  -0.566
  229    HG1  THR  31           HG1      THR  31  -7.352  -5.771   1.343
  230   1HG2  THR  31          1HG2      THR  31  -9.693  -6.375  -0.952
  231   2HG2  THR  31          2HG2      THR  31  -8.873  -5.668  -2.345
  232   3HG2  THR  31          3HG2      THR  31  -9.373  -4.644  -0.996
  233    H    GLY  32           H        GLY  32  -7.732  -7.492  -3.569
  234   1HA   GLY  32          1HA       GLY  32  -7.597  -6.454  -5.662
  235   2HA   GLY  32          2HA       GLY  32  -6.349  -5.399  -5.021
  236    H    ARG  33           H        ARG  33  -4.758  -7.490  -3.888
  237    HA   ARG  33           HA       ARG  33  -3.313  -8.316  -6.260
  238   1HB   ARG  33          1HB       ARG  33  -2.752  -8.700  -3.309
  239   2HB   ARG  33          2HB       ARG  33  -1.649  -9.138  -4.598
  240   1HG   ARG  33          1HG       ARG  33  -2.628  -6.344  -4.068
  241   2HG   ARG  33          2HG       ARG  33  -1.099  -6.990  -3.481
  242   1HD   ARG  33          1HD       ARG  33  -1.947  -6.633  -6.352
  243   2HD   ARG  33          2HD       ARG  33  -0.751  -5.671  -5.487
  244    HE   ARG  33           HE       ARG  33  -0.044  -8.443  -5.532
  245   1HH1  ARG  33          1HH1      ARG  33  -0.003  -5.493  -7.395
  246   2HH1  ARG  33          2HH1      ARG  33   1.247  -6.036  -8.476
  247   1HH2  ARG  33          1HH2      ARG  33   1.567  -9.192  -6.962
  248   2HH2  ARG  33          2HH2      ARG  33   2.152  -8.140  -8.220
  249    H    SER  34           H        SER  34  -2.931 -10.463  -6.876
  250    HA   SER  34           HA       SER  34  -4.867 -12.390  -5.816
  251   1HB   SER  34          1HB       SER  34  -3.117 -12.578  -8.278
  252   2HB   SER  34          2HB       SER  34  -4.431 -13.666  -7.848
  253    HG   SER  34           HG       SER  34  -4.673 -11.625  -9.353
  254    H    ASP  35           H        ASP  35  -1.533 -11.655  -5.694
  255    HA   ASP  35           HA       ASP  35  -0.693 -14.335  -5.133
  256   1HB   ASP  35          1HB       ASP  35   1.194 -12.270  -4.475
  257   2HB   ASP  35          2HB       ASP  35   1.375 -13.611  -5.568
  258    H    GLY  36           H        GLY  36  -2.213 -12.096  -3.343
  259   1HA   GLY  36          1HA       GLY  36  -2.599 -11.908  -1.071
  260   2HA   GLY  36          2HA       GLY  36  -1.694 -13.404  -0.882
  261    H    PHE  37           H        PHE  37  -0.549 -10.337  -2.261
  262    HA   PHE  37           HA       PHE  37   1.565 -10.323  -0.238
  263   1HB   PHE  37          1HB       PHE  37   1.350  -9.162  -2.991
  264   2HB   PHE  37          2HB       PHE  37   2.490  -8.480  -1.836
  265    HD1  PHE  37           HD1      PHE  37   3.664 -10.637  -0.465
  266    HD2  PHE  37           HD2      PHE  37   2.433 -10.470  -4.537
  267    HE1  PHE  37           HE1      PHE  37   5.317 -12.370  -1.027
  268    HE2  PHE  37           HE2      PHE  37   4.075 -12.206  -5.105
  269    HZ   PHE  37           HZ       PHE  37   5.523 -13.161  -3.353
  270    H    LEU  38           H        LEU  38   1.857  -8.670   1.144
  271    HA   LEU  38           HA       LEU  38  -0.369  -6.908   1.582
  272   1HB   LEU  38          1HB       LEU  38   2.274  -7.157   2.966
  273   2HB   LEU  38          2HB       LEU  38   0.961  -6.153   3.528
  274    HG   LEU  38           HG       LEU  38   0.955  -9.164   3.332
  275   1HD1  LEU  38          1HD1      LEU  38   2.214  -7.847   5.207
  276   2HD1  LEU  38          2HD1      LEU  38   1.194  -9.225   5.611
  277   3HD1  LEU  38          3HD1      LEU  38   0.584  -7.587   5.835
  278   1HD2  LEU  38          1HD2      LEU  38  -1.223  -8.824   4.640
  279   2HD2  LEU  38          2HD2      LEU  38  -1.256  -8.570   2.897
  280   3HD2  LEU  38          3HD2      LEU  38  -1.202  -7.187   3.991
  281    H    TRP  39           H        TRP  39  -0.594  -4.936   0.725
  282    HA   TRP  39           HA       TRP  39   1.851  -3.442   0.068
  283   1HB   TRP  39          1HB       TRP  39   0.843  -2.583  -1.984
  284   2HB   TRP  39          2HB       TRP  39   0.893  -4.338  -2.024
  285    HD1  TRP  39           HD1      TRP  39  -1.482  -5.634  -1.770
  286    HE1  TRP  39           HE1      TRP  39  -3.866  -4.878  -2.316
  287    HE3  TRP  39           HE3      TRP  39  -0.718  -0.579  -2.016
  288    HZ2  TRP  39           HZ2      TRP  39  -5.247  -2.462  -2.785
  289    HZ3  TRP  39           HZ3      TRP  39  -2.630   0.876  -2.527
  290    HH2  TRP  39           HH2      TRP  39  -4.851  -0.056  -2.900
  291    H    CYS  40           H        CYS  40   1.314  -1.089  -0.384
  292    HA   CYS  40           HA       CYS  40  -0.964  -0.012   1.073
  293   1HB   CYS  40          1HB       CYS  40   0.380   1.297   2.602
  294   2HB   CYS  40          2HB       CYS  40   0.824  -0.397   2.793
  295    H    SER  41           H        SER  41  -1.101   2.390   0.669
  296    HA   SER  41           HA       SER  41   0.280   3.019  -1.846
  297   1HB   SER  41          1HB       SER  41  -1.465   4.740  -2.193
  298   2HB   SER  41          2HB       SER  41  -2.165   3.135  -2.001
  299    HG   SER  41           HG       SER  41  -2.477   5.372  -0.463
  300    H    THR  42           H        THR  42   0.952   5.303  -2.138
  301    HA   THR  42           HA       THR  42   2.266   6.221   0.298
  302    HB   THR  42           HB       THR  42   2.605   7.306  -2.502
  303    HG1  THR  42           HG1      THR  42   3.809   5.067  -1.260
  304   1HG2  THR  42          1HG2      THR  42   4.915   7.772  -1.701
  305   2HG2  THR  42          2HG2      THR  42   4.382   7.337  -0.078
  306   3HG2  THR  42          3HG2      THR  42   3.657   8.717  -0.900
  307    H    THR  43           H        THR  43  -0.275   7.012  -1.873
  308    HA   THR  43           HA       THR  43  -0.608   9.658  -0.667
  309    HB   THR  43           HB       THR  43  -2.201  10.002  -2.587
  310    HG1  THR  43           HG1      THR  43  -2.754   8.243  -3.588
  311   1HG2  THR  43          1HG2      THR  43  -0.205   9.629  -4.356
  312   2HG2  THR  43          2HG2      THR  43   0.700   9.612  -2.842
  313   3HG2  THR  43          3HG2      THR  43  -0.304  11.003  -3.252
  314    H    TYR  44           H        TYR  44  -3.017  10.295  -0.475
  315    HA   TYR  44           HA       TYR  44  -4.203   8.641   1.460
  316   1HB   TYR  44          1HB       TYR  44  -5.335  10.930  -0.103
  317   2HB   TYR  44          2HB       TYR  44  -6.207  10.134   1.195
  318    HD1  TYR  44           HD1      TYR  44  -2.998  11.947   0.492
  319    HD2  TYR  44           HD2      TYR  44  -5.949  10.906   3.384
  320    HE1  TYR  44           HE1      TYR  44  -1.931  13.444   2.124
  321    HE2  TYR  44           HE2      TYR  44  -4.880  12.399   5.015
  322    HH   TYR  44           HH       TYR  44  -3.324  14.610   4.729
  323    H    ASN  45           H        ASN  45  -5.189   9.302  -1.898
  324    HA   ASN  45           HA       ASN  45  -6.879   6.903  -1.726
  325   1HB   ASN  45          1HB       ASN  45  -7.966   9.130  -2.305
  326   2HB   ASN  45          2HB       ASN  45  -7.063   9.096  -3.802
  327   1HD2  ASN  45          1HD2      ASN  45  -7.598   6.014  -3.706
  328   2HD2  ASN  45          2HD2      ASN  45  -9.170   5.996  -4.351
  329    H    PHE  46           H        PHE  46  -6.104   5.156  -2.740
  330    HA   PHE  46           HA       PHE  46  -3.739   5.218  -4.277
  331   1HB   PHE  46          1HB       PHE  46  -4.331   3.242  -3.007
  332   2HB   PHE  46          2HB       PHE  46  -5.816   3.029  -3.968
  333    HD1  PHE  46           HD1      PHE  46  -2.169   3.581  -4.738
  334    HD2  PHE  46           HD2      PHE  46  -5.664   1.245  -5.418
  335    HE1  PHE  46           HE1      PHE  46  -0.934   2.201  -6.343
  336    HE2  PHE  46           HE2      PHE  46  -4.427  -0.138  -7.023
  337    HZ   PHE  46           HZ       PHE  46  -2.064   0.339  -7.491
  338    H    GLU  47           H        GLU  47  -7.138   5.123  -5.191
  339    HA   GLU  47           HA       GLU  47  -6.811   4.549  -7.929
  340   1HB   GLU  47          1HB       GLU  47  -8.967   4.406  -6.750
  341   2HB   GLU  47          2HB       GLU  47  -8.984   6.147  -6.550
  342   1HG   GLU  47          1HG       GLU  47  -8.829   6.198  -9.131
  343   2HG   GLU  47          2HG       GLU  47  -9.387   4.531  -9.022
  344    H    LYS  48           H        LYS  48  -7.267   7.632  -6.257
  345    HA   LYS  48           HA       LYS  48  -7.241   9.307  -8.439
  346   1HB   LYS  48          1HB       LYS  48  -7.972  10.232  -6.415
  347   2HB   LYS  48          2HB       LYS  48  -6.543   9.713  -5.541
  348   1HG   LYS  48          1HG       LYS  48  -5.217  11.437  -6.724
  349   2HG   LYS  48          2HG       LYS  48  -6.691  11.990  -7.534
  350   1HD   LYS  48          1HD       LYS  48  -7.692  12.510  -5.378
  351   2HD   LYS  48          2HD       LYS  48  -6.243  11.931  -4.553
  352   1HE   LYS  48          1HE       LYS  48  -6.447  14.285  -6.427
  353   2HE   LYS  48          2HE       LYS  48  -6.180  14.336  -4.684
  354   1HZ   LYS  48          1HZ       LYS  48  -4.018  14.279  -5.110
  355   2HZ   LYS  48          2HZ       LYS  48  -4.289  14.033  -6.767
  356   3HZ   LYS  48          3HZ       LYS  48  -4.200  12.700  -5.714
  357    H    ASP  49           H        ASP  49  -4.388   8.791  -6.287
  358    HA   ASP  49           HA       ASP  49  -2.720  10.009  -8.314
  359   1HB   ASP  49          1HB       ASP  49  -2.086   8.961  -5.556
  360   2HB   ASP  49          2HB       ASP  49  -0.868   9.626  -6.641
  361    H    GLY  50           H        GLY  50  -2.565   6.884  -6.580
  362   1HA   GLY  50          1HA       GLY  50  -2.400   4.827  -7.814
  363   2HA   GLY  50          2HA       GLY  50  -1.576   5.714  -9.079
  364    H    LYS  51           H        LYS  51  -0.422   6.599  -6.023
  365    HA   LYS  51           HA       LYS  51   2.082   5.237  -6.521
  366   1HB   LYS  51          1HB       LYS  51   1.126   7.258  -4.523
  367   2HB   LYS  51          2HB       LYS  51   2.625   6.392  -4.243
  368   1HG   LYS  51          1HG       LYS  51   3.104   8.503  -5.229
  369   2HG   LYS  51          2HG       LYS  51   3.462   7.236  -6.398
  370   1HD   LYS  51          1HD       LYS  51   1.344   7.696  -7.537
  371   2HD   LYS  51          2HD       LYS  51   0.991   8.965  -6.359
  372   1HE   LYS  51          1HE       LYS  51   2.955  10.199  -7.071
  373   2HE   LYS  51          2HE       LYS  51   3.372   8.917  -8.209
  374   1HZ   LYS  51          1HZ       LYS  51   1.124  10.832  -8.333
  375   2HZ   LYS  51          2HZ       LYS  51   1.074   9.377  -9.201
  376   3HZ   LYS  51          3HZ       LYS  51   2.302  10.502  -9.508
  377    H    TYR  52           H        TYR  52   2.638   3.296  -5.671
  378    HA   TYR  52           HA       TYR  52   1.535   2.498  -3.107
  379   1HB   TYR  52          1HB       TYR  52   0.586   0.452  -3.887
  380   2HB   TYR  52          2HB       TYR  52  -0.061   1.730  -4.910
  381    HD1  TYR  52           HD1      TYR  52   2.130  -1.190  -4.767
  382    HD2  TYR  52           HD2      TYR  52   0.615   1.906  -7.258
  383    HE1  TYR  52           HE1      TYR  52   2.916  -2.414  -6.745
  384    HE2  TYR  52           HE2      TYR  52   1.394   0.691  -9.244
  385    HH   TYR  52           HH       TYR  52   2.102  -2.417  -9.344
  386    H    GLY  53           H        GLY  53   2.395   0.314  -2.501
  387   1HA   GLY  53          1HA       GLY  53   4.741  -0.698  -3.701
  388   2HA   GLY  53          2HA       GLY  53   5.135   0.296  -2.316
  389    H    PHE  54           H        PHE  54   5.758  -2.387  -2.272
  390    HA   PHE  54           HA       PHE  54   3.618  -3.622  -0.725
  391   1HB   PHE  54          1HB       PHE  54   6.152  -4.826  -1.803
  392   2HB   PHE  54          2HB       PHE  54   4.882  -5.708  -0.963
  393    HD1  PHE  54           HD1      PHE  54   2.458  -5.275  -2.013
  394    HD2  PHE  54           HD2      PHE  54   6.153  -4.951  -4.095
  395    HE1  PHE  54           HE1      PHE  54   1.283  -5.613  -4.144
  396    HE2  PHE  54           HE2      PHE  54   4.980  -5.286  -6.228
  397    HZ   PHE  54           HZ       PHE  54   2.544  -5.617  -6.257
  398    H    CYS  55           H        CYS  55   3.966  -4.555   1.312
  399    HA   CYS  55           HA       CYS  55   5.574  -3.029   3.075
  400   1HB   CYS  55          1HB       CYS  55   3.685  -5.255   3.273
  401   2HB   CYS  55          2HB       CYS  55   5.021  -5.416   4.405
  402    HA   PRO  56           HA       PRO  56   9.481  -5.026   2.550
  403   1HB   PRO  56          1HB       PRO  56  10.652  -4.587   4.933
  404   2HB   PRO  56          2HB       PRO  56  10.381  -3.308   3.748
  405   1HG   PRO  56          1HG       PRO  56   8.775  -4.008   6.180
  406   2HG   PRO  56          2HG       PRO  56   9.277  -2.411   5.591
  407   1HD   PRO  56          1HD       PRO  56   6.790  -3.401   5.175
  408   2HD   PRO  56          2HD       PRO  56   7.594  -2.327   4.015
  409    H    HIS  57           H        HIS  57   7.384  -6.900   3.325
  410    HA   HIS  57           HA       HIS  57   9.123  -8.959   4.318
  411   1HB   HIS  57          1HB       HIS  57   7.380  -9.705   6.061
  412   2HB   HIS  57          2HB       HIS  57   8.439  -8.366   6.475
  413    HD1  HIS  57           HD1      HIS  57   4.911  -8.907   5.163
  414    HD2  HIS  57           HD2      HIS  57   7.124  -6.203   7.415
  415    HE1  HIS  57           HE1      HIS  57   3.244  -7.237   6.040
  416    H    GLU  58           H        GLU  58   8.882  -9.900   2.337
  417    HA   GLU  58           HA       GLU  58   6.329 -10.471   1.199
  418   1HB   GLU  58          1HB       GLU  58   7.812 -10.403  -0.520
  419   2HB   GLU  58          2HB       GLU  58   9.151 -10.903   0.491
  420   1HG   GLU  58          1HG       GLU  58   8.431 -13.214   0.340
  421   2HG   GLU  58          2HG       GLU  58   7.067 -12.728  -0.665
  422    H    ALA  59           H        ALA  59   8.719 -12.253   3.057
  423    HA   ALA  59           HA       ALA  59   6.703 -14.145   3.911
  424   1HB   ALA  59          1HB       ALA  59   8.193 -14.866   1.728
  425   2HB   ALA  59          2HB       ALA  59   7.415 -15.984   2.847
  426   3HB   ALA  59          3HB       ALA  59   9.113 -15.564   3.066
  Start of MODEL   49
    1   1H    ARG   1          1H        ARG   1   6.067   4.153  11.542
    2   2H    ARG   1          2H        ARG   1   5.505   2.531  11.423
    3   3H    ARG   1          3H        ARG   1   4.381   3.828  11.496
    4    HA   ARG   1           HA       ARG   1   4.382   3.346   9.302
    5   1HB   ARG   1          1HB       ARG   1   5.147   5.725  10.017
    6   2HB   ARG   1          2HB       ARG   1   6.727   5.241   9.419
    7   1HG   ARG   1          1HG       ARG   1   5.918   5.017   7.208
    8   2HG   ARG   1          2HG       ARG   1   4.236   5.163   7.734
    9   1HD   ARG   1          1HD       ARG   1   4.732   7.462   8.512
   10   2HD   ARG   1          2HD       ARG   1   6.363   7.302   7.860
   11    HE   ARG   1           HE       ARG   1   4.501   6.759   5.815
   12   1HH1  ARG   1          1HH1      ARG   1   5.579   9.392   7.808
   13   2HH1  ARG   1          2HH1      ARG   1   5.291  10.615   6.609
   14   1HH2  ARG   1          1HH2      ARG   1   4.072   8.356   4.213
   15   2HH2  ARG   1          2HH2      ARG   1   4.441  10.016   4.555
   16    H    ILE   2           H        ILE   2   5.025   1.313   8.628
   17    HA   ILE   2           HA       ILE   2   7.769   0.518   8.764
   18    HB   ILE   2           HB       ILE   2   7.026  -1.540   7.553
   19   1HG1  ILE   2          1HG1      ILE   2   5.045  -0.230   6.489
   20   2HG1  ILE   2          2HG1      ILE   2   4.845  -1.931   6.889
   21   1HG2  ILE   2          1HG2      ILE   2   5.684  -2.473   9.398
   22   2HG2  ILE   2          2HG2      ILE   2   5.445  -0.851  10.037
   23   3HG2  ILE   2          3HG2      ILE   2   7.065  -1.553   9.987
   24   1HD1  ILE   2          1HD1      ILE   2   3.257   0.243   7.696
   25   2HD1  ILE   2          2HD1      ILE   2   4.084  -0.348   9.140
   26   3HD1  ILE   2          3HD1      ILE   2   3.110  -1.451   8.167
   27    HA   PRO   3           HA       PRO   3   9.559   1.526   4.929
   28   1HB   PRO   3          1HB       PRO   3  10.754  -0.862   4.284
   29   2HB   PRO   3          2HB       PRO   3  11.385   0.278   5.480
   30   1HG   PRO   3          1HG       PRO   3   9.676  -2.151   5.906
   31   2HG   PRO   3          2HG       PRO   3  11.141  -1.655   6.781
   32   1HD   PRO   3          1HD       PRO   3   8.757  -1.202   7.842
   33   2HD   PRO   3          2HD       PRO   3  10.011   0.057   7.926
   34    H    VAL   4           H        VAL   4   9.865   0.768   2.651
   35    HA   VAL   4           HA       VAL   4   7.528  -0.741   1.656
   36    HB   VAL   4           HB       VAL   4   8.727   1.781   0.418
   37   1HG1  VAL   4          1HG1      VAL   4   6.545  -0.058  -0.543
   38   2HG1  VAL   4          2HG1      VAL   4   8.050   0.364  -1.364
   39   3HG1  VAL   4          3HG1      VAL   4   6.782   1.574  -1.157
   40   1HG2  VAL   4          1HG2      VAL   4   7.130   1.884   2.480
   41   2HG2  VAL   4          2HG2      VAL   4   5.882   1.490   1.302
   42   3HG2  VAL   4          3HG2      VAL   4   6.851   2.948   1.102
   43    H    LYS   5           H        LYS   5   7.896  -2.008  -0.183
   44    HA   LYS   5           HA       LYS   5  10.730  -2.597  -0.629
   45   1HB   LYS   5          1HB       LYS   5   8.263  -4.186  -0.468
   46   2HB   LYS   5          2HB       LYS   5   9.361  -4.681  -1.744
   47   1HG   LYS   5          1HG       LYS   5  10.045  -4.459   1.180
   48   2HG   LYS   5          2HG       LYS   5   9.712  -5.956   0.287
   49   1HD   LYS   5          1HD       LYS   5  11.658  -5.689  -1.046
   50   2HD   LYS   5          2HD       LYS   5  11.940  -4.055  -0.436
   51   1HE   LYS   5          1HE       LYS   5  12.453  -4.889   1.758
   52   2HE   LYS   5          2HE       LYS   5  11.961  -6.521   1.299
   53   1HZ   LYS   5          1HZ       LYS   5  13.810  -6.641  -0.217
   54   2HZ   LYS   5          2HZ       LYS   5  14.382  -6.227   1.331
   55   3HZ   LYS   5          3HZ       LYS   5  14.256  -5.040   0.125
   56    H    TYR   6           H        TYR   6   8.202  -3.674  -2.743
   57    HA   TYR   6           HA       TYR   6   9.535  -2.362  -4.997
   58   1HB   TYR   6          1HB       TYR   6   7.388  -4.475  -5.173
   59   2HB   TYR   6          2HB       TYR   6   8.612  -4.056  -6.370
   60    HD1  TYR   6           HD1      TYR   6   7.818  -6.786  -4.904
   61    HD2  TYR   6           HD2      TYR   6  11.053  -4.039  -4.552
   62    HE1  TYR   6           HE1      TYR   6   9.254  -8.588  -4.066
   63    HE2  TYR   6           HE2      TYR   6  12.494  -5.840  -3.704
   64    HH   TYR   6           HH       TYR   6  12.286  -8.024  -2.618
   65    H    GLY   7           H        GLY   7   8.103  -1.681  -6.816
   66   1HA   GLY   7          1HA       GLY   7   5.771  -1.092  -7.380
   67   2HA   GLY   7          2HA       GLY   7   5.672  -0.337  -5.803
   68    H    ASN   8           H        ASN   8   5.080   1.603  -6.851
   69    HA   ASN   8           HA       ASN   8   7.312   2.977  -8.216
   70   1HB   ASN   8          1HB       ASN   8   5.755   4.143  -9.564
   71   2HB   ASN   8          2HB       ASN   8   5.230   2.462  -9.580
   72   1HD2  ASN   8          1HD2      ASN   8   3.743   4.958 -10.045
   73   2HD2  ASN   8          2HD2      ASN   8   2.470   4.955  -8.862
   74    H    ALA   9           H        ALA   9   5.988   2.868  -5.295
   75    HA   ALA   9           HA       ALA   9   5.093   5.396  -4.588
   76   1HB   ALA   9          1HB       ALA   9   6.763   4.189  -2.557
   77   2HB   ALA   9          2HB       ALA   9   5.599   3.071  -3.271
   78   3HB   ALA   9          3HB       ALA   9   5.044   4.580  -2.542
   79    H    ASP  10           H        ASP  10   5.992   7.289  -3.995
   80    HA   ASP  10           HA       ASP  10   8.296   8.218  -5.162
   81   1HB   ASP  10          1HB       ASP  10   7.117   9.276  -2.591
   82   2HB   ASP  10          2HB       ASP  10   8.097  10.172  -3.747
   83    H    GLY  11           H        GLY  11   7.935   6.941  -1.887
   84   1HA   GLY  11          1HA       GLY  11  10.224   5.718  -1.421
   85   2HA   GLY  11          2HA       GLY  11  10.779   7.387  -1.383
   86    H    GLU  12           H        GLU  12   7.720   7.549  -0.343
   87    HA   GLU  12           HA       GLU  12   8.502   7.797   2.422
   88   1HB   GLU  12          1HB       GLU  12   5.810   8.121   1.070
   89   2HB   GLU  12          2HB       GLU  12   6.137   8.488   2.757
   90   1HG   GLU  12          1HG       GLU  12   7.543   9.823   0.460
   91   2HG   GLU  12          2HG       GLU  12   6.090  10.462   1.227
   92    H    TYR  13           H        TYR  13   7.386   6.674   4.153
   93    HA   TYR  13           HA       TYR  13   7.094   3.886   3.526
   94   1HB   TYR  13          1HB       TYR  13   6.735   5.279   6.174
   95   2HB   TYR  13          2HB       TYR  13   6.883   3.540   5.923
   96    HD1  TYR  13           HD1      TYR  13   9.054   3.147   4.191
   97    HD2  TYR  13           HD2      TYR  13   8.618   6.110   7.203
   98    HE1  TYR  13           HE1      TYR  13  11.488   3.273   4.402
   99    HE2  TYR  13           HE2      TYR  13  11.060   6.258   7.422
  100    HH   TYR  13           HH       TYR  13  13.200   4.245   5.403
  101    H    CYS  14           H        CYS  14   5.213   2.673   4.668
  102    HA   CYS  14           HA       CYS  14   2.868   3.202   3.332
  103   1HB   CYS  14          1HB       CYS  14   3.346   1.674   5.883
  104   2HB   CYS  14          2HB       CYS  14   1.820   1.648   5.010
  105    H    LYS  15           H        LYS  15   1.287   4.614   3.546
  106    HA   LYS  15           HA       LYS  15   1.169   6.239   5.974
  107   1HB   LYS  15          1HB       LYS  15   1.144   7.089   3.458
  108   2HB   LYS  15          2HB       LYS  15  -0.577   6.747   3.595
  109   1HG   LYS  15          1HG       LYS  15   1.019   8.641   5.318
  110   2HG   LYS  15          2HG       LYS  15  -0.151   9.079   4.072
  111   1HD   LYS  15          1HD       LYS  15  -1.950   8.118   5.354
  112   2HD   LYS  15          2HD       LYS  15  -0.816   7.481   6.545
  113   1HE   LYS  15          1HE       LYS  15  -0.123   9.880   6.965
  114   2HE   LYS  15          2HE       LYS  15  -1.525  10.354   6.003
  115   1HZ   LYS  15          1HZ       LYS  15  -2.977   9.672   7.599
  116   2HZ   LYS  15          2HZ       LYS  15  -1.669  10.083   8.606
  117   3HZ   LYS  15          3HZ       LYS  15  -1.954   8.464   8.202
  118    H    PHE  16           H        PHE  16  -0.166   5.583   7.519
  119    HA   PHE  16           HA       PHE  16  -2.651   4.205   6.728
  120   1HB   PHE  16          1HB       PHE  16  -1.148   3.972   9.345
  121   2HB   PHE  16          2HB       PHE  16  -2.622   3.115   8.921
  122    HD1  PHE  16           HD1      PHE  16  -0.140   1.794   9.856
  123    HD2  PHE  16           HD2      PHE  16  -1.459   2.762   5.931
  124    HE1  PHE  16           HE1      PHE  16   1.193  -0.057   8.956
  125    HE2  PHE  16           HE2      PHE  16  -0.129   0.916   5.015
  126    HZ   PHE  16           HZ       PHE  16   1.208  -0.532   6.534
  127    HA   PRO  17           HA       PRO  17  -4.412   3.910   7.002
  128   1HB   PRO  17          1HB       PRO  17  -6.981   4.757   6.739
  129   2HB   PRO  17          2HB       PRO  17  -6.368   3.973   8.200
  130   1HG   PRO  17          1HG       PRO  17  -7.139   6.769   7.790
  131   2HG   PRO  17          2HG       PRO  17  -6.880   5.893   9.307
  132   1HD   PRO  17          1HD       PRO  17  -5.085   7.706   7.926
  133   2HD   PRO  17          2HD       PRO  17  -4.902   6.960   9.528
  134    H    PHE  18           H        PHE  18  -4.953   3.580   4.808
  135    HA   PHE  18           HA       PHE  18  -4.941   6.026   3.168
  136   1HB   PHE  18          1HB       PHE  18  -3.866   4.794   1.367
  137   2HB   PHE  18          2HB       PHE  18  -2.896   4.686   2.832
  138    HD1  PHE  18           HD1      PHE  18  -2.991   2.539   4.175
  139    HD2  PHE  18           HD2      PHE  18  -4.607   2.893   0.257
  140    HE1  PHE  18           HE1      PHE  18  -2.934   0.094   3.932
  141    HE2  PHE  18           HE2      PHE  18  -4.559   0.451   0.005
  142    HZ   PHE  18           HZ       PHE  18  -3.715  -0.969   1.843
  143    H    LEU  19           H        LEU  19  -6.158   5.905   1.140
  144    HA   LEU  19           HA       LEU  19  -8.649   4.447   1.594
  145   1HB   LEU  19          1HB       LEU  19  -8.612   6.921   1.171
  146   2HB   LEU  19          2HB       LEU  19  -8.070   6.570  -0.461
  147    HG   LEU  19           HG       LEU  19 -10.184   5.220  -0.755
  148   1HD1  LEU  19          1HD1      LEU  19 -10.858   6.571   1.844
  149   2HD1  LEU  19          2HD1      LEU  19 -10.789   4.839   1.527
  150   3HD1  LEU  19          3HD1      LEU  19 -12.043   5.826   0.775
  151   1HD2  LEU  19          1HD2      LEU  19 -10.219   7.244  -1.857
  152   2HD2  LEU  19          2HD2      LEU  19 -10.122   8.173  -0.358
  153   3HD2  LEU  19          3HD2      LEU  19 -11.628   7.368  -0.807
  154    H    PHE  20           H        PHE  20  -9.156   2.688   0.532
  155    HA   PHE  20           HA       PHE  20  -8.035   2.236  -2.164
  156   1HB   PHE  20          1HB       PHE  20  -6.953   0.755  -0.369
  157   2HB   PHE  20          2HB       PHE  20  -8.565   0.106  -0.129
  158    HD1  PHE  20           HD1      PHE  20  -7.127   0.943  -3.427
  159    HD2  PHE  20           HD2      PHE  20  -8.252  -2.077  -0.656
  160    HE1  PHE  20           HE1      PHE  20  -6.824  -0.782  -5.164
  161    HE2  PHE  20           HE2      PHE  20  -7.958  -3.803  -2.377
  162    HZ   PHE  20           HZ       PHE  20  -7.246  -3.149  -4.646
  163    H    ASN  21           H        ASN  21  -9.830   2.596  -3.377
  164    HA   ASN  21           HA       ASN  21 -11.932   2.362  -4.235
  165   1HB   ASN  21          1HB       ASN  21 -11.660  -0.330  -2.888
  166   2HB   ASN  21          2HB       ASN  21 -13.000   0.093  -3.943
  167   1HD2  ASN  21          1HD2      ASN  21 -10.578   1.736  -5.249
  168   2HD2  ASN  21          2HD2      ASN  21  -9.957   0.568  -6.359
  169    H    GLY  22           H        GLY  22 -11.714   3.618  -1.604
  170   1HA   GLY  22          1HA       GLY  22 -13.415   4.668  -0.373
  171   2HA   GLY  22          2HA       GLY  22 -14.525   3.409  -0.882
  172    H    LYS  23           H        LYS  23 -11.515   2.314   0.388
  173    HA   LYS  23           HA       LYS  23 -12.720   1.950   3.044
  174   1HB   LYS  23          1HB       LYS  23 -12.884  -0.115   1.551
  175   2HB   LYS  23          2HB       LYS  23 -11.133  -0.194   1.625
  176   1HG   LYS  23          1HG       LYS  23 -11.231  -0.491   4.041
  177   2HG   LYS  23          2HG       LYS  23 -12.992  -0.378   3.991
  178   1HD   LYS  23          1HD       LYS  23 -11.315  -2.480   2.623
  179   2HD   LYS  23          2HD       LYS  23 -12.257  -2.707   4.100
  180   1HE   LYS  23          1HE       LYS  23 -14.310  -2.216   2.871
  181   2HE   LYS  23          2HE       LYS  23 -13.379  -1.953   1.397
  182   1HZ   LYS  23          1HZ       LYS  23 -12.775  -4.233   1.325
  183   2HZ   LYS  23          2HZ       LYS  23 -14.453  -4.177   1.586
  184   3HZ   LYS  23          3HZ       LYS  23 -13.407  -4.530   2.879
  185    H    GLU  24           H        GLU  24 -11.382   2.496   4.659
  186    HA   GLU  24           HA       GLU  24  -8.647   3.237   3.966
  187   1HB   GLU  24          1HB       GLU  24 -10.324   3.784   6.410
  188   2HB   GLU  24          2HB       GLU  24  -8.656   4.309   6.231
  189   1HG   GLU  24          1HG       GLU  24  -9.267   5.653   4.316
  190   2HG   GLU  24          2HG       GLU  24 -10.929   5.080   4.421
  191    H    TYR  25           H        TYR  25  -6.895   2.162   4.576
  192    HA   TYR  25           HA       TYR  25  -7.245  -0.075   6.459
  193   1HB   TYR  25          1HB       TYR  25  -5.265   0.201   4.215
  194   2HB   TYR  25          2HB       TYR  25  -5.312  -1.141   5.341
  195    HD1  TYR  25           HD1      TYR  25  -7.206   0.578   2.675
  196    HD2  TYR  25           HD2      TYR  25  -6.763  -2.975   4.971
  197    HE1  TYR  25           HE1      TYR  25  -8.789  -0.576   1.176
  198    HE2  TYR  25           HE2      TYR  25  -8.347  -4.141   3.473
  199    HH   TYR  25           HH       TYR  25  -9.751  -3.941   1.767
  200    H    ASN  26           H        ASN  26  -6.074  -0.133   8.247
  201    HA   ASN  26           HA       ASN  26  -4.037   1.945   8.630
  202   1HB   ASN  26          1HB       ASN  26  -5.642   0.284  10.572
  203   2HB   ASN  26          2HB       ASN  26  -4.265   1.258  11.075
  204   1HD2  ASN  26          1HD2      ASN  26  -7.564   1.228  10.446
  205   2HD2  ASN  26          2HD2      ASN  26  -7.854   2.929  10.517
  206    H    SER  27           H        SER  27  -3.902  -0.744   7.258
  207    HA   SER  27           HA       SER  27  -1.286  -1.470   8.168
  208   1HB   SER  27          1HB       SER  27  -1.997  -3.941   8.393
  209   2HB   SER  27          2HB       SER  27  -2.369  -2.867   9.742
  210    HG   SER  27           HG       SER  27  -4.055  -4.273   8.121
  211    H    CYS  28           H        CYS  28  -0.541  -3.466   6.755
  212    HA   CYS  28           HA       CYS  28  -1.124  -2.715   4.035
  213   1HB   CYS  28          1HB       CYS  28   0.553  -5.031   5.016
  214   2HB   CYS  28          2HB       CYS  28   0.597  -4.289   3.419
  215    H    THR  29           H        THR  29  -2.398  -3.793   2.581
  216    HA   THR  29           HA       THR  29  -3.676  -6.250   3.543
  217    HB   THR  29           HB       THR  29  -5.197  -4.296   3.517
  218    HG1  THR  29           HG1      THR  29  -6.217  -6.213   3.194
  219   1HG2  THR  29          1HG2      THR  29  -4.617  -2.862   1.813
  220   2HG2  THR  29          2HG2      THR  29  -6.028  -3.678   1.141
  221   3HG2  THR  29          3HG2      THR  29  -4.408  -4.162   0.640
  222    H    ASP  30           H        ASP  30  -4.397  -7.758   1.841
  223    HA   ASP  30           HA       ASP  30  -2.599  -7.656  -0.469
  224   1HB   ASP  30          1HB       ASP  30  -4.098 -10.113   0.122
  225   2HB   ASP  30          2HB       ASP  30  -2.525  -9.934  -0.586
  226    H    THR  31           H        THR  31  -5.459  -6.617   0.263
  227    HA   THR  31           HA       THR  31  -7.279  -7.754  -1.567
  228    HB   THR  31           HB       THR  31  -7.215  -4.914  -0.519
  229    HG1  THR  31           HG1      THR  31  -7.227  -6.145   1.276
  230   1HG2  THR  31          1HG2      THR  31  -9.414  -6.592  -1.657
  231   2HG2  THR  31          2HG2      THR  31  -8.917  -4.962  -2.107
  232   3HG2  THR  31          3HG2      THR  31  -9.733  -5.238  -0.571
  233    H    GLY  32           H        GLY  32  -7.745  -7.276  -3.681
  234   1HA   GLY  32          1HA       GLY  32  -7.597  -6.083  -5.703
  235   2HA   GLY  32          2HA       GLY  32  -6.310  -5.111  -5.001
  236    H    ARG  33           H        ARG  33  -4.969  -7.483  -3.946
  237    HA   ARG  33           HA       ARG  33  -3.553  -8.297  -6.373
  238   1HB   ARG  33          1HB       ARG  33  -2.854  -8.700  -3.447
  239   2HB   ARG  33          2HB       ARG  33  -1.827  -9.097  -4.806
  240   1HG   ARG  33          1HG       ARG  33  -2.762  -6.301  -4.275
  241   2HG   ARG  33          2HG       ARG  33  -1.298  -6.965  -3.554
  242   1HD   ARG  33          1HD       ARG  33  -1.880  -6.709  -6.503
  243   2HD   ARG  33          2HD       ARG  33  -0.786  -5.690  -5.570
  244    HE   ARG  33           HE       ARG  33   0.002  -8.384  -5.306
  245   1HH1  ARG  33          1HH1      ARG  33  -0.040  -5.774  -7.607
  246   2HH1  ARG  33          2HH1      ARG  33   1.272  -6.399  -8.559
  247   1HH2  ARG  33          1HH2      ARG  33   1.726  -9.243  -6.529
  248   2HH2  ARG  33          2HH2      ARG  33   2.289  -8.396  -7.937
  249    H    SER  34           H        SER  34  -2.741 -10.700  -6.197
  250    HA   SER  34           HA       SER  34  -4.868 -12.383  -5.064
  251   1HB   SER  34          1HB       SER  34  -3.756 -12.773  -7.851
  252   2HB   SER  34          2HB       SER  34  -5.060 -13.681  -7.089
  253    HG   SER  34           HG       SER  34  -5.797 -11.179  -6.940
  254    H    ASP  35           H        ASP  35  -1.683 -11.725  -5.127
  255    HA   ASP  35           HA       ASP  35  -0.801 -14.478  -4.887
  256   1HB   ASP  35          1HB       ASP  35   1.130 -12.279  -4.916
  257   2HB   ASP  35          2HB       ASP  35   1.214 -13.843  -5.678
  258    H    GLY  36           H        GLY  36  -2.171 -12.737  -2.781
  259   1HA   GLY  36          1HA       GLY  36  -1.996 -12.455  -0.506
  260   2HA   GLY  36          2HA       GLY  36  -0.754 -13.696  -0.555
  261    H    PHE  37           H        PHE  37  -0.395 -10.728  -2.360
  262    HA   PHE  37           HA       PHE  37   1.905 -10.080  -0.690
  263   1HB   PHE  37          1HB       PHE  37   1.213  -9.680  -3.493
  264   2HB   PHE  37          2HB       PHE  37   1.847  -8.218  -2.746
  265    HD1  PHE  37           HD1      PHE  37   2.606 -11.869  -3.005
  266    HD2  PHE  37           HD2      PHE  37   4.109  -7.898  -2.699
  267    HE1  PHE  37           HE1      PHE  37   4.903 -12.724  -3.249
  268    HE2  PHE  37           HE2      PHE  37   6.410  -8.742  -2.941
  269    HZ   PHE  37           HZ       PHE  37   6.813 -11.154  -3.216
  270    H    LEU  38           H        LEU  38   1.619  -8.740   0.932
  271    HA   LEU  38           HA       LEU  38  -0.630  -6.991   1.061
  272   1HB   LEU  38          1HB       LEU  38   0.162  -6.466   3.263
  273   2HB   LEU  38          2HB       LEU  38   0.207  -8.190   3.034
  274    HG   LEU  38           HG       LEU  38   2.650  -6.423   2.826
  275   1HD1  LEU  38          1HD1      LEU  38   2.624  -6.228   5.036
  276   2HD1  LEU  38          2HD1      LEU  38   2.791  -7.979   5.149
  277   3HD1  LEU  38          3HD1      LEU  38   1.187  -7.247   5.160
  278   1HD2  LEU  38          1HD2      LEU  38   2.136  -9.284   2.484
  279   2HD2  LEU  38          2HD2      LEU  38   3.459  -8.919   3.593
  280   3HD2  LEU  38          3HD2      LEU  38   3.501  -8.294   1.944
  281    H    TRP  39           H        TRP  39  -0.701  -4.887   0.657
  282    HA   TRP  39           HA       TRP  39   1.816  -3.459   0.157
  283   1HB   TRP  39          1HB       TRP  39   0.857  -2.427  -1.863
  284   2HB   TRP  39          2HB       TRP  39   0.929  -4.173  -2.019
  285    HD1  TRP  39           HD1      TRP  39  -1.439  -5.513  -1.925
  286    HE1  TRP  39           HE1      TRP  39  -3.820  -4.734  -2.475
  287    HE3  TRP  39           HE3      TRP  39  -0.702  -0.452  -1.824
  288    HZ2  TRP  39           HZ2      TRP  39  -5.196  -2.311  -2.840
  289    HZ3  TRP  39           HZ3      TRP  39  -2.611   1.019  -2.302
  290    HH2  TRP  39           HH2      TRP  39  -4.809   0.102  -2.796
  291    H    CYS  40           H        CYS  40   1.297  -1.042  -0.196
  292    HA   CYS  40           HA       CYS  40  -0.965  -0.101   1.364
  293   1HB   CYS  40          1HB       CYS  40   0.436   1.209   2.885
  294   2HB   CYS  40          2HB       CYS  40   0.819  -0.504   3.020
  295    H    SER  41           H        SER  41  -1.051   2.362   1.249
  296    HA   SER  41           HA       SER  41   0.009   3.194  -1.362
  297   1HB   SER  41          1HB       SER  41  -2.466   3.281  -1.097
  298   2HB   SER  41          2HB       SER  41  -2.259   4.453   0.205
  299    HG   SER  41           HG       SER  41  -1.376   4.794  -2.480
  300    H    THR  42           H        THR  42   0.576   5.510  -1.548
  301    HA   THR  42           HA       THR  42   1.956   6.448   0.879
  302    HB   THR  42           HB       THR  42   2.811   6.912  -1.987
  303    HG1  THR  42           HG1      THR  42   3.816   4.992  -0.148
  304   1HG2  THR  42          1HG2      THR  42   4.177   8.371  -1.017
  305   2HG2  THR  42          2HG2      THR  42   5.049   6.950  -0.437
  306   3HG2  THR  42          3HG2      THR  42   3.857   7.739   0.598
  307    H    THR  43           H        THR  43  -0.094   7.247  -1.799
  308    HA   THR  43           HA       THR  43  -0.105  10.082  -1.048
  309    HB   THR  43           HB       THR  43  -1.521  10.170  -3.232
  310    HG1  THR  43           HG1      THR  43  -1.842   8.271  -4.033
  311   1HG2  THR  43          1HG2      THR  43   0.367  11.136  -3.879
  312   2HG2  THR  43          2HG2      THR  43   0.865   9.552  -4.470
  313   3HG2  THR  43          3HG2      THR  43   1.355  10.082  -2.859
  314    H    TYR  44           H        TYR  44  -1.586   7.605   0.159
  315    HA   TYR  44           HA       TYR  44  -3.507   7.279   1.312
  316   1HB   TYR  44          1HB       TYR  44  -3.410   9.640   1.937
  317   2HB   TYR  44          2HB       TYR  44  -4.196  10.094   0.429
  318    HD1  TYR  44           HD1      TYR  44  -6.611   9.400   0.069
  319    HD2  TYR  44           HD2      TYR  44  -4.698   9.013   3.852
  320    HE1  TYR  44           HE1      TYR  44  -8.807   9.245   1.159
  321    HE2  TYR  44           HE2      TYR  44  -6.893   8.859   4.947
  322    HH   TYR  44           HH       TYR  44  -9.179   8.313   4.442
  323    H    ASN  45           H        ASN  45  -4.515   9.180  -1.560
  324    HA   ASN  45           HA       ASN  45  -6.587   7.230  -2.105
  325   1HB   ASN  45          1HB       ASN  45  -6.881   9.731  -2.434
  326   2HB   ASN  45          2HB       ASN  45  -5.791   9.611  -3.794
  327   1HD2  ASN  45          1HD2      ASN  45  -7.185   6.853  -4.288
  328   2HD2  ASN  45          2HD2      ASN  45  -8.587   7.390  -5.083
  329    H    PHE  46           H        PHE  46  -5.819   5.356  -2.930
  330    HA   PHE  46           HA       PHE  46  -3.485   5.241  -4.588
  331   1HB   PHE  46          1HB       PHE  46  -3.912   3.442  -3.051
  332   2HB   PHE  46          2HB       PHE  46  -5.512   3.149  -3.761
  333    HD1  PHE  46           HD1      PHE  46  -1.969   3.432  -5.023
  334    HD2  PHE  46           HD2      PHE  46  -5.611   1.226  -4.995
  335    HE1  PHE  46           HE1      PHE  46  -0.986   1.775  -6.543
  336    HE2  PHE  46           HE2      PHE  46  -4.629  -0.430  -6.514
  337    HZ   PHE  46           HZ       PHE  46  -2.310  -0.154  -7.295
  338    H    GLU  47           H        GLU  47  -6.932   5.247  -5.190
  339    HA   GLU  47           HA       GLU  47  -6.922   4.178  -7.737
  340   1HB   GLU  47          1HB       GLU  47  -8.773   5.908  -6.167
  341   2HB   GLU  47          2HB       GLU  47  -9.119   5.461  -7.809
  342   1HG   GLU  47          1HG       GLU  47 -10.237   3.890  -6.489
  343   2HG   GLU  47          2HG       GLU  47  -8.823   3.059  -7.115
  344    H    LYS  48           H        LYS  48  -6.898   7.613  -6.725
  345    HA   LYS  48           HA       LYS  48  -6.801   8.411  -9.478
  346   1HB   LYS  48          1HB       LYS  48  -8.143   9.801  -8.144
  347   2HB   LYS  48          2HB       LYS  48  -6.947   9.897  -6.866
  348   1HG   LYS  48          1HG       LYS  48  -5.586  11.399  -8.207
  349   2HG   LYS  48          2HG       LYS  48  -6.703  11.256  -9.564
  350   1HD   LYS  48          1HD       LYS  48  -7.073  13.318  -8.305
  351   2HD   LYS  48          2HD       LYS  48  -8.480  12.255  -8.251
  352   1HE   LYS  48          1HE       LYS  48  -7.822  11.489  -6.028
  353   2HE   LYS  48          2HE       LYS  48  -6.399  12.527  -6.080
  354   1HZ   LYS  48          1HZ       LYS  48  -9.034  13.758  -6.479
  355   2HZ   LYS  48          2HZ       LYS  48  -7.631  14.397  -5.761
  356   3HZ   LYS  48          3HZ       LYS  48  -8.591  13.288  -4.905
  357    H    ASP  49           H        ASP  49  -4.500   8.392  -6.771
  358    HA   ASP  49           HA       ASP  49  -2.501   9.708  -8.408
  359   1HB   ASP  49          1HB       ASP  49  -2.470   8.640  -5.591
  360   2HB   ASP  49          2HB       ASP  49  -1.002   9.212  -6.380
  361    H    GLY  50           H        GLY  50  -2.709   6.510  -6.820
  362   1HA   GLY  50          1HA       GLY  50  -2.179   4.473  -7.855
  363   2HA   GLY  50          2HA       GLY  50  -1.386   5.370  -9.131
  364    H    LYS  51           H        LYS  51  -0.397   6.417  -6.052
  365    HA   LYS  51           HA       LYS  51   2.162   5.094  -6.462
  366   1HB   LYS  51          1HB       LYS  51   1.278   7.257  -4.561
  367   2HB   LYS  51          2HB       LYS  51   2.854   6.500  -4.446
  368   1HG   LYS  51          1HG       LYS  51   3.256   8.439  -5.638
  369   2HG   LYS  51          2HG       LYS  51   3.132   7.211  -6.898
  370   1HD   LYS  51          1HD       LYS  51   0.833   7.889  -7.347
  371   2HD   LYS  51          2HD       LYS  51   0.922   9.077  -6.042
  372   1HE   LYS  51          1HE       LYS  51   1.217  10.124  -8.246
  373   2HE   LYS  51          2HE       LYS  51   2.662  10.291  -7.249
  374   1HZ   LYS  51          1HZ       LYS  51   3.425   8.180  -8.481
  375   2HZ   LYS  51          2HZ       LYS  51   3.505   9.665  -9.278
  376   3HZ   LYS  51          3HZ       LYS  51   2.229   8.589  -9.624
  377    H    TYR  52           H        TYR  52   2.580   3.207  -5.563
  378    HA   TYR  52           HA       TYR  52   1.617   2.623  -2.870
  379   1HB   TYR  52          1HB       TYR  52   0.648   0.504  -3.482
  380   2HB   TYR  52          2HB       TYR  52  -0.078   1.732  -4.520
  381    HD1  TYR  52           HD1      TYR  52   1.176   2.104  -6.824
  382    HD2  TYR  52           HD2      TYR  52   1.462  -1.425  -4.465
  383    HE1  TYR  52           HE1      TYR  52   1.943   0.857  -8.790
  384    HE2  TYR  52           HE2      TYR  52   2.219  -2.686  -6.432
  385    HH   TYR  52           HH       TYR  52   1.797  -2.042  -9.322
  386    H    GLY  53           H        GLY  53   2.474   0.388  -2.222
  387   1HA   GLY  53          1HA       GLY  53   4.813  -0.601  -3.507
  388   2HA   GLY  53          2HA       GLY  53   5.206   0.359  -2.094
  389    H    PHE  54           H        PHE  54   5.728  -2.433  -2.350
  390    HA   PHE  54           HA       PHE  54   3.680  -3.734  -0.750
  391   1HB   PHE  54          1HB       PHE  54   6.243  -4.808  -1.907
  392   2HB   PHE  54          2HB       PHE  54   5.073  -5.766  -1.013
  393    HD1  PHE  54           HD1      PHE  54   2.546  -5.267  -1.959
  394    HD2  PHE  54           HD2      PHE  54   6.178  -5.126  -4.168
  395    HE1  PHE  54           HE1      PHE  54   1.298  -5.674  -4.037
  396    HE2  PHE  54           HE2      PHE  54   4.941  -5.533  -6.247
  397    HZ   PHE  54           HZ       PHE  54   2.493  -5.804  -6.187
  398    H    CYS  55           H        CYS  55   3.992  -4.592   1.285
  399    HA   CYS  55           HA       CYS  55   6.019  -3.204   2.845
  400   1HB   CYS  55          1HB       CYS  55   3.865  -5.056   3.864
  401   2HB   CYS  55          2HB       CYS  55   4.743  -3.822   4.767
  402    HA   PRO  56           HA       PRO  56   8.666  -6.766   2.615
  403   1HB   PRO  56          1HB       PRO  56  10.395  -6.000   4.581
  404   2HB   PRO  56          2HB       PRO  56  10.474  -5.439   2.911
  405   1HG   PRO  56          1HG       PRO  56   9.374  -4.075   5.324
  406   2HG   PRO  56          2HG       PRO  56  10.254  -3.389   3.947
  407   1HD   PRO  56          1HD       PRO  56   7.560  -3.183   4.230
  408   2HD   PRO  56          2HD       PRO  56   8.365  -3.241   2.650
  409    H    HIS  57           H        HIS  57   7.803  -8.595   3.383
  410    HA   HIS  57           HA       HIS  57   7.291  -8.776   6.271
  411   1HB   HIS  57          1HB       HIS  57   5.759 -10.595   5.781
  412   2HB   HIS  57          2HB       HIS  57   5.350  -9.209   4.781
  413    HD1  HIS  57           HD1      HIS  57   7.108 -12.569   4.490
  414    HD2  HIS  57           HD2      HIS  57   5.197  -9.742   2.113
  415    HE1  HIS  57           HE1      HIS  57   6.961 -13.601   2.200
  416    H    GLU  58           H        GLU  58   7.921 -10.714   7.375
  417    HA   GLU  58           HA       GLU  58  10.445 -11.721   6.357
  418   1HB   GLU  58          1HB       GLU  58  10.752 -12.656   8.618
  419   2HB   GLU  58          2HB       GLU  58  10.432 -10.931   8.657
  420   1HG   GLU  58          1HG       GLU  58   8.331 -13.028   9.160
  421   2HG   GLU  58          2HG       GLU  58   9.296 -12.276  10.426
  422    H    ALA  59           H        ALA  59   7.218 -12.812   7.156
  423    HA   ALA  59           HA       ALA  59   7.479 -15.134   5.505
  424   1HB   ALA  59          1HB       ALA  59   7.303 -15.493   8.495
  425   2HB   ALA  59          2HB       ALA  59   8.550 -16.106   7.410
  426   3HB   ALA  59          3HB       ALA  59   6.915 -16.761   7.329
  Start of MODEL   50
    1   1H    ARG   1          1H        ARG   1   4.437   4.432  11.544
    2   2H    ARG   1          2H        ARG   1   6.004   5.113  11.338
    3   3H    ARG   1          3H        ARG   1   5.781   3.413  11.207
    4    HA   ARG   1           HA       ARG   1   4.128   4.080   9.377
    5   1HB   ARG   1          1HB       ARG   1   4.470   6.518   9.942
    6   2HB   ARG   1          2HB       ARG   1   6.122   6.359   9.362
    7   1HG   ARG   1          1HG       ARG   1   5.363   5.894   7.136
    8   2HG   ARG   1          2HG       ARG   1   3.683   5.844   7.675
    9   1HD   ARG   1          1HD       ARG   1   3.868   8.220   8.341
   10   2HD   ARG   1          2HD       ARG   1   5.511   8.247   7.702
   11    HE   ARG   1           HE       ARG   1   3.741   7.356   5.698
   12   1HH1  ARG   1          1HH1      ARG   1   4.521  10.257   7.494
   13   2HH1  ARG   1          2HH1      ARG   1   4.072  11.325   6.202
   14   1HH2  ARG   1          1HH2      ARG   1   3.135   8.762   4.009
   15   2HH2  ARG   1          2HH2      ARG   1   3.290  10.477   4.221
   16    H    ILE   2           H        ILE   2   5.050   2.075   8.845
   17    HA   ILE   2           HA       ILE   2   7.764   1.612   8.349
   18    HB   ILE   2           HB       ILE   2   6.817  -0.312   6.862
   19   1HG1  ILE   2          1HG1      ILE   2   4.289   0.682   8.201
   20   2HG1  ILE   2          2HG1      ILE   2   4.623   0.672   6.470
   21   1HG2  ILE   2          1HG2      ILE   2   6.295  -1.684   8.798
   22   2HG2  ILE   2          2HG2      ILE   2   6.005  -0.253   9.782
   23   3HG2  ILE   2          3HG2      ILE   2   7.632  -0.614   9.204
   24   1HD1  ILE   2          1HD1      ILE   2   3.562  -1.408   8.148
   25   2HD1  ILE   2          2HD1      ILE   2   4.995  -1.961   7.280
   26   3HD1  ILE   2          3HD1      ILE   2   3.622  -1.303   6.391
   27    HA   PRO   3           HA       PRO   3   8.715   3.240   4.416
   28   1HB   PRO   3          1HB       PRO   3  10.531   1.454   3.572
   29   2HB   PRO   3          2HB       PRO   3  10.844   2.533   4.938
   30   1HG   PRO   3          1HG       PRO   3   9.870  -0.311   4.977
   31   2HG   PRO   3          2HG       PRO   3  11.216   0.403   5.887
   32   1HD   PRO   3          1HD       PRO   3   8.827   0.065   7.023
   33   2HD   PRO   3          2HD       PRO   3   9.796   1.520   7.358
   34    H    VAL   4           H        VAL   4   9.404   2.244   2.152
   35    HA   VAL   4           HA       VAL   4   7.332   0.350   1.244
   36    HB   VAL   4           HB       VAL   4   8.284   2.797  -0.322
   37   1HG1  VAL   4          1HG1      VAL   4   6.654   0.440  -0.968
   38   2HG1  VAL   4          2HG1      VAL   4   7.584   1.508  -2.022
   39   3HG1  VAL   4          3HG1      VAL   4   5.976   1.989  -1.476
   40   1HG2  VAL   4          1HG2      VAL   4   5.851   3.509  -0.005
   41   2HG2  VAL   4          2HG2      VAL   4   6.928   3.693   1.377
   42   3HG2  VAL   4          3HG2      VAL   4   5.796   2.343   1.313
   43    H    LYS   5           H        LYS   5   8.056  -1.026  -0.514
   44    HA   LYS   5           HA       LYS   5  10.946  -0.828  -0.999
   45   1HB   LYS   5          1HB       LYS   5   9.486  -2.970   0.273
   46   2HB   LYS   5          2HB       LYS   5  10.331  -3.554  -1.153
   47   1HG   LYS   5          1HG       LYS   5  11.544  -2.130   1.204
   48   2HG   LYS   5          2HG       LYS   5  11.709  -3.835   0.787
   49   1HD   LYS   5          1HD       LYS   5  13.050  -3.378  -1.074
   50   2HD   LYS   5          2HD       LYS   5  12.575  -1.681  -1.114
   51   1HE   LYS   5          1HE       LYS   5  13.811  -1.286   0.970
   52   2HE   LYS   5          2HE       LYS   5  14.271  -2.991   1.020
   53   1HZ   LYS   5          1HZ       LYS   5  14.909  -1.558  -1.435
   54   2HZ   LYS   5          2HZ       LYS   5  15.815  -2.711  -0.577
   55   3HZ   LYS   5          3HZ       LYS   5  15.784  -1.095  -0.057
   56    H    TYR   6           H        TYR   6   8.488  -3.108  -2.213
   57    HA   TYR   6           HA       TYR   6   9.495  -2.517  -4.892
   58   1HB   TYR   6          1HB       TYR   6   7.698  -4.807  -4.063
   59   2HB   TYR   6          2HB       TYR   6   8.575  -4.635  -5.581
   60    HD1  TYR   6           HD1      TYR   6   8.979  -5.274  -1.952
   61    HD2  TYR   6           HD2      TYR   6  10.900  -5.243  -5.755
   62    HE1  TYR   6           HE1      TYR   6  10.908  -6.435  -0.980
   63    HE2  TYR   6           HE2      TYR   6  12.827  -6.407  -4.787
   64    HH   TYR   6           HH       TYR   6  12.968  -8.088  -2.401
   65    H    GLY   7           H        GLY   7   8.129  -2.170  -6.659
   66   1HA   GLY   7          1HA       GLY   7   5.712  -2.013  -7.334
   67   2HA   GLY   7          2HA       GLY   7   5.525  -0.966  -5.936
   68    H    ASN   8           H        ASN   8   4.847   0.760  -7.320
   69    HA   ASN   8           HA       ASN   8   6.979   1.762  -9.056
   70   1HB   ASN   8          1HB       ASN   8   5.370   2.970 -10.318
   71   2HB   ASN   8          2HB       ASN   8   4.721   1.358 -10.067
   72   1HD2  ASN   8          1HD2      ASN   8   3.442   3.944 -10.662
   73   2HD2  ASN   8          2HD2      ASN   8   2.258   4.160  -9.425
   74    H    ALA   9           H        ALA   9   6.575   2.089  -6.067
   75    HA   ALA   9           HA       ALA   9   6.591   5.009  -5.871
   76   1HB   ALA   9          1HB       ALA   9   6.680   3.181  -3.510
   77   2HB   ALA   9          2HB       ALA   9   5.149   3.479  -4.341
   78   3HB   ALA   9          3HB       ALA   9   6.041   4.821  -3.624
   79    H    ASP  10           H        ASP  10   8.180   5.642  -3.921
   80    HA   ASP  10           HA       ASP  10  10.751   4.334  -4.508
   81   1HB   ASP  10          1HB       ASP  10  10.139   7.235  -3.958
   82   2HB   ASP  10          2HB       ASP  10  11.766   6.579  -3.834
   83    H    GLY  11           H        GLY  11  11.924   6.079  -2.352
   84   1HA   GLY  11          1HA       GLY  11  11.503   4.216  -0.215
   85   2HA   GLY  11          2HA       GLY  11  12.617   5.571  -0.209
   86    H    GLU  12           H        GLU  12   9.068   5.331  -0.543
   87    HA   GLU  12           HA       GLU  12   8.760   7.503   1.387
   88   1HB   GLU  12          1HB       GLU  12   7.029   6.205  -0.667
   89   2HB   GLU  12          2HB       GLU  12   6.230   6.908   0.731
   90   1HG   GLU  12          1HG       GLU  12   6.774   9.032   0.156
   91   2HG   GLU  12          2HG       GLU  12   8.235   8.553  -0.684
   92    H    TYR  13           H        TYR  13   6.371   6.905   2.555
   93    HA   TYR  13           HA       TYR  13   6.778   4.320   3.861
   94   1HB   TYR  13          1HB       TYR  13   5.857   6.451   5.684
   95   2HB   TYR  13          2HB       TYR  13   6.952   5.098   5.974
   96    HD1  TYR  13           HD1      TYR  13   6.810   8.480   4.409
   97    HD2  TYR  13           HD2      TYR  13   9.230   5.438   6.141
   98    HE1  TYR  13           HE1      TYR  13   8.720  10.017   4.411
   99    HE2  TYR  13           HE2      TYR  13  11.154   6.967   6.145
  100    HH   TYR  13           HH       TYR  13  10.994  10.145   4.641
  101    H    CYS  14           H        CYS  14   4.909   3.332   4.615
  102    HA   CYS  14           HA       CYS  14   2.625   3.671   3.109
  103   1HB   CYS  14          1HB       CYS  14   3.007   2.338   5.780
  104   2HB   CYS  14          2HB       CYS  14   1.537   2.203   4.830
  105    H    LYS  15           H        LYS  15   0.749   4.694   3.282
  106    HA   LYS  15           HA       LYS  15   0.484   6.741   5.347
  107   1HB   LYS  15          1HB       LYS  15   0.151   7.473   3.067
  108   2HB   LYS  15          2HB       LYS  15  -1.019   6.197   2.778
  109   1HG   LYS  15          1HG       LYS  15  -2.338   8.085   3.057
  110   2HG   LYS  15          2HG       LYS  15  -2.389   7.327   4.649
  111   1HD   LYS  15          1HD       LYS  15  -0.614   8.850   5.406
  112   2HD   LYS  15          2HD       LYS  15  -0.633   9.628   3.815
  113   1HE   LYS  15          1HE       LYS  15  -3.161   9.940   4.267
  114   2HE   LYS  15          2HE       LYS  15  -2.737   9.640   5.952
  115   1HZ   LYS  15          1HZ       LYS  15  -0.951  11.532   4.854
  116   2HZ   LYS  15          2HZ       LYS  15  -2.051  11.718   6.141
  117   3HZ   LYS  15          3HZ       LYS  15  -2.541  12.023   4.546
  118    H    PHE  16           H        PHE  16  -0.578   6.166   7.158
  119    HA   PHE  16           HA       PHE  16  -2.834   4.287   6.867
  120   1HB   PHE  16          1HB       PHE  16  -0.892   4.525   9.168
  121   2HB   PHE  16          2HB       PHE  16  -2.362   3.552   9.208
  122    HD1  PHE  16           HD1      PHE  16  -2.413   2.203   6.663
  123    HD2  PHE  16           HD2      PHE  16   0.909   3.134   9.150
  124    HE1  PHE  16           HE1      PHE  16  -1.173   0.303   5.715
  125    HE2  PHE  16           HE2      PHE  16   2.155   1.247   8.217
  126    HZ   PHE  16           HZ       PHE  16   1.123  -0.212   6.494
  127    HA   PRO  17           HA       PRO  17  -4.516   3.882   7.136
  128   1HB   PRO  17          1HB       PRO  17  -7.124   4.523   6.771
  129   2HB   PRO  17          2HB       PRO  17  -6.504   3.848   8.279
  130   1HG   PRO  17          1HG       PRO  17  -7.408   6.588   7.703
  131   2HG   PRO  17          2HG       PRO  17  -7.250   5.759   9.259
  132   1HD   PRO  17          1HD       PRO  17  -5.461   7.656   8.073
  133   2HD   PRO  17          2HD       PRO  17  -5.300   6.820   9.628
  134    H    PHE  18           H        PHE  18  -5.307   3.440   4.970
  135    HA   PHE  18           HA       PHE  18  -5.243   5.820   3.250
  136   1HB   PHE  18          1HB       PHE  18  -4.017   4.701   1.556
  137   2HB   PHE  18          2HB       PHE  18  -3.165   4.412   3.062
  138    HD1  PHE  18           HD1      PHE  18  -5.277   2.891   0.467
  139    HD2  PHE  18           HD2      PHE  18  -2.863   2.210   3.904
  140    HE1  PHE  18           HE1      PHE  18  -5.260   0.483  -0.024
  141    HE2  PHE  18           HE2      PHE  18  -2.842  -0.194   3.424
  142    HZ   PHE  18           HZ       PHE  18  -4.040  -1.079   1.440
  143    H    LEU  19           H        LEU  19  -6.568   5.807   1.419
  144    HA   LEU  19           HA       LEU  19  -9.004   4.277   1.818
  145   1HB   LEU  19          1HB       LEU  19  -9.058   6.726   1.507
  146   2HB   LEU  19          2HB       LEU  19  -8.411   6.516  -0.109
  147    HG   LEU  19           HG       LEU  19 -10.446   5.150  -0.643
  148   1HD1  LEU  19          1HD1      LEU  19 -11.863   4.574   0.961
  149   2HD1  LEU  19          2HD1      LEU  19 -12.163   6.276   1.317
  150   3HD1  LEU  19          3HD1      LEU  19 -10.862   5.419   2.143
  151   1HD2  LEU  19          1HD2      LEU  19 -10.064   7.918  -0.552
  152   2HD2  LEU  19          2HD2      LEU  19 -11.708   7.636   0.021
  153   3HD2  LEU  19          3HD2      LEU  19 -11.204   7.025  -1.555
  154    H    PHE  20           H        PHE  20  -9.515   2.548   0.733
  155    HA   PHE  20           HA       PHE  20  -8.494   2.201  -2.011
  156   1HB   PHE  20          1HB       PHE  20  -7.360   0.712  -0.207
  157   2HB   PHE  20          2HB       PHE  20  -8.930  -0.092  -0.124
  158    HD1  PHE  20           HD1      PHE  20  -8.000  -2.166  -0.730
  159    HD2  PHE  20           HD2      PHE  20  -7.744   1.172  -3.358
  160    HE1  PHE  20           HE1      PHE  20  -7.396  -3.685  -2.566
  161    HE2  PHE  20           HE2      PHE  20  -7.141  -0.351  -5.204
  162    HZ   PHE  20           HZ       PHE  20  -6.976  -2.771  -4.813
  163    H    ASN  21           H        ASN  21 -10.342   2.548  -3.132
  164    HA   ASN  21           HA       ASN  21 -12.481   2.352  -3.891
  165   1HB   ASN  21          1HB       ASN  21 -12.161  -0.412  -2.722
  166   2HB   ASN  21          2HB       ASN  21 -13.454   0.072  -3.812
  167   1HD2  ASN  21          1HD2      ASN  21 -10.709  -1.560  -3.722
  168   2HD2  ASN  21          2HD2      ASN  21 -10.113  -1.286  -5.320
  169    H    GLY  22           H        GLY  22 -12.270   3.525  -1.278
  170   1HA   GLY  22          1HA       GLY  22 -14.031   4.437  -0.026
  171   2HA   GLY  22          2HA       GLY  22 -15.023   3.052  -0.422
  172    H    LYS  23           H        LYS  23 -12.258   1.659   0.517
  173    HA   LYS  23           HA       LYS  23 -13.166   1.571   3.312
  174   1HB   LYS  23          1HB       LYS  23 -13.111  -0.534   1.719
  175   2HB   LYS  23          2HB       LYS  23 -11.399  -0.530   2.116
  176   1HG   LYS  23          1HG       LYS  23 -13.472  -0.502   4.285
  177   2HG   LYS  23          2HG       LYS  23 -13.007  -1.997   3.490
  178   1HD   LYS  23          1HD       LYS  23 -10.701  -1.688   4.145
  179   2HD   LYS  23          2HD       LYS  23 -11.088  -0.114   4.849
  180   1HE   LYS  23          1HE       LYS  23 -12.499  -1.167   6.512
  181   2HE   LYS  23          2HE       LYS  23 -12.256  -2.745   5.768
  182   1HZ   LYS  23          1HZ       LYS  23 -10.816  -1.827   7.820
  183   2HZ   LYS  23          2HZ       LYS  23  -9.829  -1.349   6.531
  184   3HZ   LYS  23          3HZ       LYS  23 -10.250  -2.984   6.712
  185    H    GLU  24           H        GLU  24 -11.715   1.813   4.972
  186    HA   GLU  24           HA       GLU  24  -9.130   2.966   4.199
  187   1HB   GLU  24          1HB       GLU  24 -10.627   3.158   6.819
  188   2HB   GLU  24          2HB       GLU  24  -9.114   3.967   6.447
  189   1HG   GLU  24          1HG       GLU  24 -10.303   5.156   4.604
  190   2HG   GLU  24          2HG       GLU  24 -11.803   4.452   5.208
  191    H    TYR  25           H        TYR  25  -7.236   2.045   4.793
  192    HA   TYR  25           HA       TYR  25  -7.410  -0.356   6.485
  193   1HB   TYR  25          1HB       TYR  25  -5.527   0.270   4.237
  194   2HB   TYR  25          2HB       TYR  25  -5.352  -1.123   5.284
  195    HD1  TYR  25           HD1      TYR  25  -7.504  -2.651   5.446
  196    HD2  TYR  25           HD2      TYR  25  -6.688   0.045   2.260
  197    HE1  TYR  25           HE1      TYR  25  -9.054  -3.906   3.989
  198    HE2  TYR  25           HE2      TYR  25  -8.236  -1.205   0.794
  199    HH   TYR  25           HH       TYR  25  -9.719  -4.224   1.853
  200    H    ASN  26           H        ASN  26  -6.370  -0.353   8.326
  201    HA   ASN  26           HA       ASN  26  -4.595   1.866   9.001
  202   1HB   ASN  26          1HB       ASN  26  -5.802  -0.367  10.646
  203   2HB   ASN  26          2HB       ASN  26  -4.599   0.740  11.294
  204   1HD2  ASN  26          1HD2      ASN  26  -6.509   2.316   9.060
  205   2HD2  ASN  26          2HD2      ASN  26  -7.626   3.057  10.152
  206    H    SER  27           H        SER  27  -4.366  -1.140   7.678
  207    HA   SER  27           HA       SER  27  -1.504  -1.222   8.197
  208   1HB   SER  27          1HB       SER  27  -1.645  -3.725   8.519
  209   2HB   SER  27          2HB       SER  27  -2.305  -2.775   9.850
  210    HG   SER  27           HG       SER  27  -3.983  -4.023   9.551
  211    H    CYS  28           H        CYS  28  -0.627  -3.184   6.758
  212    HA   CYS  28           HA       CYS  28  -1.375  -2.490   4.067
  213   1HB   CYS  28          1HB       CYS  28   0.541  -4.629   5.012
  214   2HB   CYS  28          2HB       CYS  28   0.483  -3.888   3.414
  215    H    THR  29           H        THR  29  -2.531  -3.686   2.619
  216    HA   THR  29           HA       THR  29  -3.612  -6.237   3.581
  217    HB   THR  29           HB       THR  29  -5.312  -4.451   3.628
  218    HG1  THR  29           HG1      THR  29  -5.845  -6.658   2.974
  219   1HG2  THR  29          1HG2      THR  29  -4.185  -3.643   1.164
  220   2HG2  THR  29          2HG2      THR  29  -5.510  -2.905   2.067
  221   3HG2  THR  29          3HG2      THR  29  -5.848  -4.142   0.856
  222    H    ASP  30           H        ASP  30  -4.307  -7.735   1.845
  223    HA   ASP  30           HA       ASP  30  -2.495  -7.566  -0.447
  224   1HB   ASP  30          1HB       ASP  30  -3.949 -10.041  -0.141
  225   2HB   ASP  30          2HB       ASP  30  -2.251  -9.783  -0.427
  226    H    THR  31           H        THR  31  -5.347  -6.482   0.176
  227    HA   THR  31           HA       THR  31  -7.135  -7.645  -1.662
  228    HB   THR  31           HB       THR  31  -7.053  -4.783  -0.704
  229    HG1  THR  31           HG1      THR  31  -7.125  -5.991   1.131
  230   1HG2  THR  31          1HG2      THR  31  -9.246  -4.531  -1.256
  231   2HG2  THR  31          2HG2      THR  31  -9.573  -6.265  -1.190
  232   3HG2  THR  31          3HG2      THR  31  -8.708  -5.581  -2.568
  233    H    GLY  32           H        GLY  32  -7.422  -7.349  -3.816
  234   1HA   GLY  32          1HA       GLY  32  -7.255  -6.276  -5.881
  235   2HA   GLY  32          2HA       GLY  32  -6.153  -5.110  -5.161
  236    H    ARG  33           H        ARG  33  -4.718  -7.511  -3.949
  237    HA   ARG  33           HA       ARG  33  -2.979  -8.036  -6.249
  238   1HB   ARG  33          1HB       ARG  33  -2.519  -8.337  -3.276
  239   2HB   ARG  33          2HB       ARG  33  -1.337  -8.735  -4.507
  240   1HG   ARG  33          1HG       ARG  33  -2.512  -6.005  -4.049
  241   2HG   ARG  33          2HG       ARG  33  -0.944  -6.541  -3.455
  242   1HD   ARG  33          1HD       ARG  33  -1.792  -6.239  -6.340
  243   2HD   ARG  33          2HD       ARG  33  -0.652  -5.222  -5.459
  244    HE   ARG  33           HE       ARG  33   0.177  -7.955  -5.485
  245   1HH1  ARG  33          1HH1      ARG  33   0.103  -5.035  -7.407
  246   2HH1  ARG  33          2HH1      ARG  33   1.440  -5.516  -8.405
  247   1HH2  ARG  33          1HH2      ARG  33   1.902  -8.598  -6.803
  248   2HH2  ARG  33          2HH2      ARG  33   2.467  -7.539  -8.061
  249    H    SER  34           H        SER  34  -2.774 -10.051  -7.076
  250    HA   SER  34           HA       SER  34  -4.441 -12.140  -5.943
  251   1HB   SER  34          1HB       SER  34  -2.821 -12.082  -8.499
  252   2HB   SER  34          2HB       SER  34  -3.942 -13.359  -8.029
  253    HG   SER  34           HG       SER  34  -5.638 -12.011  -8.296
  254    H    ASP  35           H        ASP  35  -1.222 -11.169  -5.717
  255    HA   ASP  35           HA       ASP  35  -0.180 -13.812  -5.381
  256   1HB   ASP  35          1HB       ASP  35   1.606 -11.719  -4.616
  257   2HB   ASP  35          2HB       ASP  35   1.811 -12.927  -5.847
  258    H    GLY  36           H        GLY  36  -1.859 -11.868  -3.443
  259   1HA   GLY  36          1HA       GLY  36  -2.234 -11.862  -1.165
  260   2HA   GLY  36          2HA       GLY  36  -1.184 -13.265  -1.070
  261    H    PHE  37           H        PHE  37  -0.179 -10.149  -2.369
  262    HA   PHE  37           HA       PHE  37   1.802 -10.016  -0.222
  263   1HB   PHE  37          1HB       PHE  37   1.663  -8.830  -2.976
  264   2HB   PHE  37          2HB       PHE  37   2.744  -8.143  -1.772
  265    HD1  PHE  37           HD1      PHE  37   3.984 -10.245  -0.411
  266    HD2  PHE  37           HD2      PHE  37   2.749 -10.160  -4.483
  267    HE1  PHE  37           HE1      PHE  37   5.669 -11.959  -0.951
  268    HE2  PHE  37           HE2      PHE  37   4.423 -11.873  -5.031
  269    HZ   PHE  37           HZ       PHE  37   5.887 -12.779  -3.266
  270    H    LEU  38           H        LEU  38   1.849  -8.426   1.250
  271    HA   LEU  38           HA       LEU  38  -0.440  -6.713   1.478
  272   1HB   LEU  38          1HB       LEU  38   2.039  -6.836   3.158
  273   2HB   LEU  38          2HB       LEU  38   0.593  -5.951   3.566
  274    HG   LEU  38           HG       LEU  38  -0.554  -8.298   3.427
  275   1HD1  LEU  38          1HD1      LEU  38   0.938  -9.856   2.775
  276   2HD1  LEU  38          2HD1      LEU  38   1.310  -9.882   4.498
  277   3HD1  LEU  38          3HD1      LEU  38   2.322  -8.953   3.394
  278   1HD2  LEU  38          1HD2      LEU  38   1.221  -7.405   5.688
  279   2HD2  LEU  38          2HD2      LEU  38  -0.019  -8.652   5.821
  280   3HD2  LEU  38          3HD2      LEU  38  -0.471  -6.991   5.435
  281    H    TRP  39           H        TRP  39  -0.623  -4.717   0.729
  282    HA   TRP  39           HA       TRP  39   1.836  -3.184   0.206
  283   1HB   TRP  39          1HB       TRP  39   0.874  -2.293  -1.853
  284   2HB   TRP  39          2HB       TRP  39   0.928  -4.045  -1.933
  285    HD1  TRP  39           HD1      TRP  39  -1.452  -5.357  -1.747
  286    HE1  TRP  39           HE1      TRP  39  -3.832  -4.609  -2.312
  287    HE3  TRP  39           HE3      TRP  39  -0.717  -0.299  -1.921
  288    HZ2  TRP  39           HZ2      TRP  39  -5.219  -2.203  -2.794
  289    HZ3  TRP  39           HZ3      TRP  39  -2.633   1.148  -2.472
  290    HH2  TRP  39           HH2      TRP  39  -4.832   0.204  -2.895
  291    H    CYS  40           H        CYS  40   1.230  -0.810  -0.216
  292    HA   CYS  40           HA       CYS  40  -1.092   0.120   1.266
  293   1HB   CYS  40          1HB       CYS  40   0.234   1.466   2.819
  294   2HB   CYS  40          2HB       CYS  40   0.682  -0.226   2.984
  295    H    SER  41           H        SER  41  -1.236   2.556   1.077
  296    HA   SER  41           HA       SER  41  -0.005   3.395  -1.456
  297   1HB   SER  41          1HB       SER  41  -2.500   3.337  -1.422
  298   2HB   SER  41          2HB       SER  41  -2.475   4.541  -0.131
  299    HG   SER  41           HG       SER  41  -1.446   4.847  -2.762
  300    H    THR  42           H        THR  42   0.522   5.723  -1.578
  301    HA   THR  42           HA       THR  42   1.568   6.648   1.013
  302    HB   THR  42           HB       THR  42   2.611   7.497  -1.689
  303    HG1  THR  42           HG1      THR  42   4.215   5.829  -1.345
  304   1HG2  THR  42          1HG2      THR  42   3.276   8.567   0.606
  305   2HG2  THR  42          2HG2      THR  42   4.488   8.237  -0.635
  306   3HG2  THR  42          3HG2      THR  42   4.300   7.129   0.727
  307    H    THR  43           H        THR  43  -0.616   7.276  -1.479
  308    HA   THR  43           HA       THR  43  -0.803  10.122  -0.757
  309    HB   THR  43           HB       THR  43  -2.041  10.295  -2.942
  310    HG1  THR  43           HG1      THR  43  -2.673   8.293  -3.461
  311   1HG2  THR  43          1HG2      THR  43   0.572   9.081  -3.615
  312   2HG2  THR  43          2HG2      THR  43   0.562  10.510  -2.581
  313   3HG2  THR  43          3HG2      THR  43  -0.166  10.576  -4.188
  314    H    TYR  44           H        TYR  44  -1.982   7.784   0.673
  315    HA   TYR  44           HA       TYR  44  -3.880   7.278   1.795
  316   1HB   TYR  44          1HB       TYR  44  -4.149   9.685   2.159
  317   2HB   TYR  44          2HB       TYR  44  -4.936   9.858   0.591
  318    HD1  TYR  44           HD1      TYR  44  -5.325   7.769   3.704
  319    HD2  TYR  44           HD2      TYR  44  -7.234  10.040   0.652
  320    HE1  TYR  44           HE1      TYR  44  -7.505   7.370   4.768
  321    HE2  TYR  44           HE2      TYR  44  -9.411   9.643   1.707
  322    HH   TYR  44           HH       TYR  44  -9.732   7.579   4.572
  323    H    ASN  45           H        ASN  45  -5.351   8.825  -1.046
  324    HA   ASN  45           HA       ASN  45  -6.876   6.403  -1.560
  325   1HB   ASN  45          1HB       ASN  45  -7.881   8.739  -1.707
  326   2HB   ASN  45          2HB       ASN  45  -6.897   8.986  -3.132
  327   1HD2  ASN  45          1HD2      ASN  45  -7.529   5.968  -3.702
  328   2HD2  ASN  45          2HD2      ASN  45  -9.045   6.158  -4.439
  329    H    PHE  46           H        PHE  46  -5.995   4.866  -2.754
  330    HA   PHE  46           HA       PHE  46  -3.604   5.100  -4.192
  331   1HB   PHE  46          1HB       PHE  46  -4.453   3.009  -3.226
  332   2HB   PHE  46          2HB       PHE  46  -5.780   2.998  -4.410
  333    HD1  PHE  46           HD1      PHE  46  -5.099   0.768  -5.139
  334    HD2  PHE  46           HD2      PHE  46  -2.405   4.056  -5.465
  335    HE1  PHE  46           HE1      PHE  46  -3.709  -0.520  -6.688
  336    HE2  PHE  46           HE2      PHE  46  -1.021   2.759  -7.027
  337    HZ   PHE  46           HZ       PHE  46  -1.671   0.470  -7.634
  338    H    GLU  47           H        GLU  47  -6.931   4.883  -5.350
  339    HA   GLU  47           HA       GLU  47  -6.539   4.769  -8.065
  340   1HB   GLU  47          1HB       GLU  47  -8.678   4.539  -6.748
  341   2HB   GLU  47          2HB       GLU  47  -8.778   6.288  -6.740
  342   1HG   GLU  47          1HG       GLU  47  -8.832   6.299  -9.180
  343   2HG   GLU  47          2HG       GLU  47  -8.747   4.539  -9.188
  344    H    LYS  48           H        LYS  48  -6.939   7.752  -6.141
  345    HA   LYS  48           HA       LYS  48  -6.951   9.458  -8.367
  346   1HB   LYS  48          1HB       LYS  48  -6.664  11.315  -6.849
  347   2HB   LYS  48          2HB       LYS  48  -7.824  10.163  -6.208
  348   1HG   LYS  48          1HG       LYS  48  -6.073   9.295  -4.699
  349   2HG   LYS  48          2HG       LYS  48  -4.968  10.528  -5.319
  350   1HD   LYS  48          1HD       LYS  48  -6.630  12.258  -4.609
  351   2HD   LYS  48          2HD       LYS  48  -7.559  10.972  -3.837
  352   1HE   LYS  48          1HE       LYS  48  -6.208  12.050  -2.178
  353   2HE   LYS  48          2HE       LYS  48  -5.580  10.428  -2.455
  354   1HZ   LYS  48          1HZ       LYS  48  -3.787  11.305  -3.738
  355   2HZ   LYS  48          2HZ       LYS  48  -3.861  12.200  -2.287
  356   3HZ   LYS  48          3HZ       LYS  48  -4.454  12.869  -3.731
  357    H    ASP  49           H        ASP  49  -4.121   8.326  -6.525
  358    HA   ASP  49           HA       ASP  49  -2.486  10.008  -8.289
  359   1HB   ASP  49          1HB       ASP  49  -1.874   8.766  -5.619
  360   2HB   ASP  49          2HB       ASP  49  -0.613   9.432  -6.649
  361    H    GLY  50           H        GLY  50  -2.402   6.700  -6.923
  362   1HA   GLY  50          1HA       GLY  50  -2.211   4.823  -8.411
  363   2HA   GLY  50          2HA       GLY  50  -1.325   5.859  -9.510
  364    H    LYS  51           H        LYS  51  -0.183   6.422  -6.417
  365    HA   LYS  51           HA       LYS  51   2.127   4.736  -6.997
  366   1HB   LYS  51          1HB       LYS  51   1.749   7.040  -5.091
  367   2HB   LYS  51          2HB       LYS  51   3.185   6.031  -5.067
  368   1HG   LYS  51          1HG       LYS  51   4.000   7.545  -6.482
  369   2HG   LYS  51          2HG       LYS  51   3.024   6.719  -7.695
  370   1HD   LYS  51          1HD       LYS  51   2.535   9.020  -7.921
  371   2HD   LYS  51          2HD       LYS  51   1.159   8.314  -7.071
  372   1HE   LYS  51          1HE       LYS  51   1.891  10.469  -6.100
  373   2HE   LYS  51          2HE       LYS  51   1.983   9.125  -4.961
  374   1HZ   LYS  51          1HZ       LYS  51   3.954  10.690  -5.009
  375   2HZ   LYS  51          2HZ       LYS  51   4.334  10.038  -6.530
  376   3HZ   LYS  51          3HZ       LYS  51   4.319   9.039  -5.161
  377    H    TYR  52           H        TYR  52   2.443   2.880  -6.054
  378    HA   TYR  52           HA       TYR  52   1.411   2.423  -3.364
  379   1HB   TYR  52          1HB       TYR  52   0.335   0.393  -3.927
  380   2HB   TYR  52          2HB       TYR  52  -0.188   1.524  -5.172
  381    HD1  TYR  52           HD1      TYR  52   1.802  -1.447  -4.439
  382    HD2  TYR  52           HD2      TYR  52   0.610   1.277  -7.481
  383    HE1  TYR  52           HE1      TYR  52   2.605  -3.018  -6.144
  384    HE2  TYR  52           HE2      TYR  52   1.411  -0.288  -9.198
  385    HH   TYR  52           HH       TYR  52   1.814  -2.774  -9.393
  386    H    GLY  53           H        GLY  53   2.413   0.488  -2.383
  387   1HA   GLY  53          1HA       GLY  53   4.701  -0.674  -3.642
  388   2HA   GLY  53          2HA       GLY  53   5.121   0.453  -2.373
  389    H    PHE  54           H        PHE  54   5.810  -2.208  -2.230
  390    HA   PHE  54           HA       PHE  54   3.845  -3.438  -0.480
  391   1HB   PHE  54          1HB       PHE  54   6.455  -4.502  -1.536
  392   2HB   PHE  54          2HB       PHE  54   5.310  -5.416  -0.564
  393    HD1  PHE  54           HD1      PHE  54   2.806  -5.290  -1.543
  394    HD2  PHE  54           HD2      PHE  54   6.391  -4.864  -3.794
  395    HE1  PHE  54           HE1      PHE  54   1.598  -5.930  -3.594
  396    HE2  PHE  54           HE2      PHE  54   5.193  -5.502  -5.837
  397    HZ   PHE  54           HZ       PHE  54   2.790  -6.035  -5.739
  398    H    CYS  55           H        CYS  55   4.016  -3.545   1.640
  399    HA   CYS  55           HA       CYS  55   5.900  -1.929   3.013
  400   1HB   CYS  55          1HB       CYS  55   4.164  -3.954   4.388
  401   2HB   CYS  55          2HB       CYS  55   4.636  -2.345   4.926
  402    HA   PRO  56           HA       PRO  56   7.669  -6.061   4.768
  403   1HB   PRO  56          1HB       PRO  56   7.261  -8.319   3.328
  404   2HB   PRO  56          2HB       PRO  56   6.234  -7.828   4.679
  405   1HG   PRO  56          1HG       PRO  56   5.779  -7.498   1.738
  406   2HG   PRO  56          2HG       PRO  56   4.629  -7.978   3.002
  407   1HD   PRO  56          1HD       PRO  56   4.708  -5.471   2.005
  408   2HD   PRO  56          2HD       PRO  56   4.293  -5.803   3.700
  409    H    HIS  57           H        HIS  57   9.763  -6.146   4.384
  410    HA   HIS  57           HA       HIS  57  10.815  -5.616   1.756
  411   1HB   HIS  57          1HB       HIS  57  11.975  -4.612   3.615
  412   2HB   HIS  57          2HB       HIS  57  12.119  -6.162   4.434
  413    HD1  HIS  57           HD1      HIS  57  13.140  -5.095   0.919
  414    HD2  HIS  57           HD2      HIS  57  14.751  -6.788   4.358
  415    HE1  HIS  57           HE1      HIS  57  15.528  -5.631   0.350
  416    H    GLU  58           H        GLU  58  10.690  -8.274   4.032
  417    HA   GLU  58           HA       GLU  58  11.346 -10.133   1.865
  418   1HB   GLU  58          1HB       GLU  58  12.227 -11.574   3.872
  419   2HB   GLU  58          2HB       GLU  58  13.255 -10.349   3.147
  420   1HG   GLU  58          1HG       GLU  58  13.563  -9.959   5.387
  421   2HG   GLU  58          2HG       GLU  58  12.291  -8.808   4.996
  422    H    ALA  59           H        ALA  59  10.385 -12.299   2.194
  423    HA   ALA  59           HA       ALA  59   8.141 -12.405   4.043
  424   1HB   ALA  59          1HB       ALA  59   6.935 -11.465   2.301
  425   2HB   ALA  59          2HB       ALA  59   6.686 -13.197   2.059
  426   3HB   ALA  59          3HB       ALA  59   7.858 -12.330   1.064